0 B10R1.18 C=C(C)CN1CC=CCC1 2230a_100000698166_100000748629 [0,0,0,0,0,0|1,0,3]=4 1 B10R1.18 C=C(C)CN1CC=CCC1 269982a_100000698166_100000748629 [0,0,0,0,0,0|1,0,3]=4 2 B10R1.18 C=C(C)CN1CC=CCC1 34a_100000698166_100000748629 [0,0,0,0,0,0|1,0,3]=4 3 B10R1.18 CC(=Cc1ccccc1)C 271570a_100102525489_100000210277 [0,0,0,0,0,0|0,0,2]=2 4 B10R1.18 CC(=Cc1ccccn1)C 271570a_100102525489_100011216584 [0,0,0,0,0,0|1,0,2]=3 5 B10R1.18 CC(=Cc1cccnc1)C 271570a_100102525489_100000752921 [0,0,0,0,0,0|1,0,2]=3 6 B10R1.18 CC(=Cc1cccnn1)C 271570a_100102525489_100016991348 [0,0,0,0,0,0|2,0,2]=4 7 B10R1.18 CC(=Cc1ccncc1)C 271570a_100102525489_100000035832 [0,0,0,0,0,0|1,0,2]=3 8 B10R1.18 CC(=Cc1ccncn1)C 271570a_100102525489_100000703185 [0,0,0,0,0,0|2,0,2]=4 9 B10R1.18 CC(=Cc1ccnnc1)C 271570a_100102525489_100000732662 [0,0,0,0,0,0|2,0,2]=4 10 B10R1.18 CC(=Cc1cnccn1)C 271570a_100102525489_100000758340 [0,0,0,0,0,0|2,0,2]=4 11 B10R1.18 CC(=Cc1cncnc1)C 271570a_100102525489_100011206942 [0,0,0,0,0,0|2,0,2]=4 12 B10R1.18 CC(=Cc1ncccn1)C 271570a_100102525489_100000211032 [0,0,0,0,0,0|2,0,2]=4 13 B10R1.18 CC(=O)C[n+]1ccccc1 1458a_200000086051_200000210301 [0,0,0,0,0,0|2,0,0]=2 14 B10R1.18 CC(=O)Cc1ccccc1 1458a_100000070787_100015291786 [0,0,0,0,0,0|1,0,0]=1 15 B10R1.18 CC(=O)Cc1ccccn1 1458a_100000070787_100000721315 [0,0,0,0,0,0|2,0,0]=2 16 B10R1.18 CC(=O)Cc1ccccn1 1458a_100000233486_200000210301 [0,0,0,0,0,0|2,0,0]=2 17 B10R1.18 CC(=O)Cc1cccnc1 1458a_100000070787_100000733263 [0,0,0,0,0,0|2,0,0]=2 18 B10R1.18 CC(=O)Cc1cccnc1 1458a_100000737805_200000210301 [0,0,0,0,0,0|2,0,0]=2 19 B10R1.18 CC(=O)Cc1cccnn1 1458a_100000070787_100016990269 [0,0,0,0,0,0|3,0,0]=3 20 B10R1.18 CC(=O)Cc1ccncc1 1458a_100000070787_100000705612 [0,0,0,0,0,0|2,0,0]=2 21 B10R1.18 CC(=O)Cc1cnccn1 1458a_100000070787_100016995436 [0,0,0,0,0,0|3,0,0]=3 22 B10R1.18 CC(=O)Cc1cncnc1 1458a_100000070787_100015196519 [0,0,0,0,0,0|3,0,0]=3 23 B10R1.18 CC(=O)Cc1cncnc1 1458a_100000721575_200000210301 [0,0,0,0,0,0|3,0,0]=3 24 B10R1.18 CC(=O)Cc1ncccn1 1458a_100000070787_100000703007 [0,0,0,0,0,0|3,0,0]=3 25 B10R1.18 CC(=O)Nc1ccccc1 11a_100000106764_100015343762 [0,0,0,0,0,0|2,0,0]=2 26 B10R1.18 CC(=O)Nc1ccccc1 1626a_100000106764_100015343762 [0,0,0,0,0,0|2,0,0]=2 27 B10R1.18 CC(=O)Nc1ccccc1 22a_100000106764_100000070787 [0,0,0,0,0,0|2,0,0]=2 28 B10R1.18 CC(=O)Nc1ccccc1 527a_100000106764_100103153847 [0,0,0,0,0,0|2,0,0]=2 29 B10R1.18 CC(C)Nc1ccccc1 34a_100000106764_100000210206 [0,0,0,0,0,0|1,0,2]=3 30 B10R1.18 CC(C)Oc1ccccc1 34a_100000210340_100000210206 [0,0,0,0,0,0|1,0,2]=3 31 B10R1.18 CC(C)Oc1ccccc1 7a_100000210340_100000210206 [0,0,0,0,0,0|1,0,2]=3 32 B10R1.18 CC(C)Oc1cccnc1 34a_100000210849_100000210206 [0,0,0,0,0,0|2,0,2]=4 33 B10R1.18 CC(C)Oc1cccnc1 7a_100000210849_100000210206 [0,0,0,0,0,0|2,0,2]=4 34 B10R1.18 CC(C)Oc1ccncc1 34a_100000212176_100000210206 [0,0,0,0,0,0|2,0,2]=4 35 B10R1.18 CC(C)Sc1ccccc1 62a_100000210206_100000041952 [0,0,0,0,0,0|1,0,2]=3 36 B10R1.18 CC(C)Sc1ccccc1 62a_100000719477_100000210206 [0,0,0,0,0,0|1,0,2]=3 37 B10R1.18 CC(C)Sc1ccccn1 62a_100000210206_100011216584 [0,0,0,0,0,0|2,0,2]=4 38 B10R1.18 CC(C)Sc1ccccn1 62a_100011216584_100000210206 [0,0,0,0,0,0|2,0,2]=4 39 B10R1.18 CC(C)Sc1cccnc1 62a_100000210063_100000210206 [0,0,0,0,0,0|2,0,2]=4 40 B10R1.18 CC(C)Sc1cccnc1 62a_100000210206_100000210063 [0,0,0,0,0,0|2,0,2]=4 41 B10R1.18 CC(C)Sc1ccncc1 62a_100000210206_100000728582 [0,0,0,0,0,0|2,0,2]=4 42 B10R1.18 CC(C)Sc1ccncc1 62a_100000728582_100000210206 [0,0,0,0,0,0|2,0,2]=4 43 B10R1.18 CN(C)Cc1ccccc1 2230a_100000186898_200000210301 [0,0,0,0,0,0|1,0,1]=2 44 B10R1.18 CN(C)Cc1ccccc1 2230a_100102631434_100015291786 [0,0,0,0,0,0|1,0,1]=2 45 B10R1.18 CN(C)Cc1ccccc1 269982a_100000186898_200000210301 [0,0,0,0,0,0|1,0,1]=2 46 B10R1.18 CN(C)Cc1ccccc1 269982a_100102631434_100000211182 [0,0,0,0,0,0|1,0,1]=2 47 B10R1.18 CN(C)Cc1ccccc1 270004a_100102631434_100015611070 [0,0,0,0,0,0|1,0,1]=2 48 B10R1.18 CN(C)Cc1ccccn1 2230a_100000207498_200000210301 [0,0,0,0,0,0|2,0,1]=3 49 B10R1.18 CN(C)Cc1ccccn1 2230a_100102631434_100000721315 [0,0,0,0,0,0|2,0,1]=3 50 B10R1.18 CN(C)Cc1ccccn1 269982a_100000207498_200000210301 [0,0,0,0,0,0|2,0,1]=3 51 B10R1.18 CN(C)Cc1ccccn1 269982a_100102631434_100000721315 [0,0,0,0,0,0|2,0,1]=3 52 B10R1.18 CN(C)Cc1ccccn1 270004a_100102631434_100000209966 [0,0,0,0,0,0|2,0,1]=3 53 B10R1.18 CN(C)Cc1cccnc1 2230a_100000184577_200000210301 [0,0,0,0,0,0|2,0,1]=3 54 B10R1.18 CN(C)Cc1cccnc1 2230a_100102631434_100000741622 [0,0,0,0,0,0|2,0,1]=3 55 B10R1.18 CN(C)Cc1cccnc1 269982a_100000184577_200000210301 [0,0,0,0,0,0|2,0,1]=3 56 B10R1.18 CN(C)Cc1cccnc1 269982a_100102631434_100000733263 [0,0,0,0,0,0|2,0,1]=3 57 B10R1.18 CN(C)Cc1cccnc1 270004a_100102631434_100000209961 [0,0,0,0,0,0|2,0,1]=3 58 B10R1.18 CN(C)Cc1cccnn1 2230a_100102631434_100016990269 [0,0,0,0,0,0|3,0,1]=4 59 B10R1.18 CN(C)Cc1ccncc1 2230a_100000187231_200000210301 [0,0,0,0,0,0|2,0,1]=3 60 B10R1.18 CN(C)Cc1ccncc1 2230a_100102631434_100015193705 [0,0,0,0,0,0|2,0,1]=3 61 B10R1.18 CN(C)Cc1ccncc1 269982a_100000187231_200000210301 [0,0,0,0,0,0|2,0,1]=3 62 B10R1.18 CN(C)Cc1ccncc1 269982a_100102631434_100015193705 [0,0,0,0,0,0|2,0,1]=3 63 B10R1.18 CN(C)Cc1ccnnc1 270004a_100102631434_100011934578 [0,0,0,0,0,0|3,0,1]=4 64 B10R1.18 CN(C)Cc1cnccn1 2230a_100011269079_200000210301 [0,0,0,0,0,0|3,0,1]=4 65 B10R1.18 CN(C)Cc1cnccn1 2230a_100102631434_100016995436 [0,0,0,0,0,0|3,0,1]=4 66 B10R1.18 CN(C)Cc1cnccn1 269982a_100011269079_200000210301 [0,0,0,0,0,0|3,0,1]=4 67 B10R1.18 CN(C)Cc1cnccn1 269982a_100102631434_100016995436 [0,0,0,0,0,0|3,0,1]=4 68 B10R1.18 CN(C)Cc1cnccn1 270004a_100102631434_100000749867 [0,0,0,0,0,0|3,0,1]=4 69 B10R1.18 CN(C)Cc1cncnc1 2230a_100102631434_100015196519 [0,0,0,0,0,0|3,0,1]=4 70 B10R1.18 CN(C)Cc1cncnc1 269982a_100102631434_100016991940 [0,0,0,0,0,0|3,0,1]=4 71 B10R1.18 CN(C)Cc1cncnc1 270004a_100102631434_100000749868 [0,0,0,0,0,0|3,0,1]=4 72 B10R1.18 CN(C)Cc1ncccn1 2230a_100025716638_200000210301 [0,0,0,0,0,0|3,0,1]=4 73 B10R1.18 CN(C)Cc1ncccn1 2230a_100102631434_100000703007 [0,0,0,0,0,0|3,0,1]=4 74 B10R1.18 CN(C)Cc1ncccn1 269982a_100025716638_200000210301 [0,0,0,0,0,0|3,0,1]=4 75 B10R1.18 CN(C)Cc1ncccn1 269982a_100102631434_100000703007 [0,0,0,0,0,0|3,0,1]=4 76 B10R1.18 CN(C)Cc1ncccn1 270004a_100102631434_100011532527 [0,0,0,0,0,0|3,0,1]=4 77 B10R1.18 CN([13CH3])Cc1ccccc1 2230a_100000186898_200025704644 [0,0,0,0,0,0|1,0,1]=2 78 B10R1.18 CN([13CH3])Cc1ccccc1 269982a_100000186898_200025704644 [0,0,0,0,0,0|1,0,1]=2 79 B10R1.18 CN([13CH3])Cc1ccccn1 2230a_100000207498_200025704644 [0,0,0,0,0,0|2,0,1]=3 80 B10R1.18 CN([13CH3])Cc1ccccn1 269982a_100000207498_200025704644 [0,0,0,0,0,0|2,0,1]=3 81 B10R1.18 CN([13CH3])Cc1cccnc1 2230a_100000184577_200025704644 [0,0,0,0,0,0|2,0,1]=3 82 B10R1.18 CN([13CH3])Cc1cccnc1 269982a_100000184577_200025704644 [0,0,0,0,0,0|2,0,1]=3 83 B10R1.18 CN([13CH3])Cc1ccncc1 2230a_100000187231_200025704644 [0,0,0,0,0,0|2,0,1]=3 84 B10R1.18 CN([13CH3])Cc1ccncc1 269982a_100000187231_200025704644 [0,0,0,0,0,0|2,0,1]=3 85 B10R1.18 CN([13CH3])Cc1cnccn1 2230a_100011269079_200025704644 [0,0,0,0,0,0|3,0,1]=4 86 B10R1.18 CN([13CH3])Cc1cnccn1 269982a_100011269079_200025704644 [0,0,0,0,0,0|3,0,1]=4 87 B10R1.18 CN([13CH3])Cc1ncccn1 2230a_100025716638_200025704644 [0,0,0,0,0,0|3,0,1]=4 88 B10R1.18 CN([13CH3])Cc1ncccn1 269982a_100025716638_200025704644 [0,0,0,0,0,0|3,0,1]=4 89 B10R1.18 [13CH3]C(=O)C[n+]1ccccc1 1458a_200000086051_200025704644 [0,0,0,0,0,0|2,0,0]=2 90 B10R1.18 [13CH3]C(=O)Cc1ccccn1 1458a_100000233486_200025704644 [0,0,0,0,0,0|2,0,0]=2 91 B10R1.18 [13CH3]C(=O)Cc1cccnc1 1458a_100000737805_200025704644 [0,0,0,0,0,0|2,0,0]=2 92 B10R1.18 [13CH3]C(=O)Cc1cncnc1 1458a_100000721575_200025704644 [0,0,0,0,0,0|3,0,0]=3 93 B9R1.8 C=C=Cc1ccccc1 271570a_100015277604_100000210277 [1,0,0,0,0,0|0,0,2]=3 94 B9R1.8 C=C=Cc1ccccn1 271570a_100015277604_100011216584 [1,0,0,0,0,0|1,0,2]=4 95 B9R1.8 C=C=Cc1cccnc1 271570a_100015277604_100000752921 [1,0,0,0,0,0|1,0,2]=4 96 B9R1.8 C=C=Cc1ccncc1 271570a_100015277604_100000035832 [1,0,0,0,0,0|1,0,2]=4 97 B9R1.8 CC=Cc1ccccc1 271570a_100016259895_100000210277 [1,0,0,0,0,0|0,0,1]=2 98 B9R1.8 CC=Cc1ccccn1 271570a_100016259895_100011216584 [1,0,0,0,0,0|1,0,1]=3 99 B9R1.8 CC=Cc1cccnc1 271570a_100016259895_100000752921 [1,0,0,0,0,0|1,0,1]=3 100 B9R1.8 CC=Cc1cccnn1 271570a_100016259895_100016991348 [1,0,0,0,0,0|2,0,1]=4 101 B9R1.8 CC=Cc1ccncc1 271570a_100016259895_100000035832 [1,0,0,0,0,0|1,0,1]=3 102 B9R1.8 CC=Cc1ccncn1 271570a_100016259895_100000703185 [1,0,0,0,0,0|2,0,1]=4 103 B9R1.8 CC=Cc1ccnnc1 271570a_100016259895_100000732662 [1,0,0,0,0,0|2,0,1]=4 104 B9R1.8 CC=Cc1cnccn1 271570a_100016259895_100000758340 [1,0,0,0,0,0|2,0,1]=4 105 B9R1.8 CC=Cc1cncnc1 271570a_100016259895_100011206942 [1,0,0,0,0,0|2,0,1]=4 106 B9R1.8 CC=Cc1ncccn1 271570a_100016259895_100000211032 [1,0,0,0,0,0|2,0,1]=4 107 B9R1.8 CCNc1ccccc1 34a_100000106764_100000210202 [1,0,0,0,0,0|1,0,1]=3 108 B9R1.8 CCOc1ccccc1 34a_100000210340_100000210202 [1,0,0,0,0,0|1,0,1]=3 109 B9R1.8 CCOc1ccccc1 7a_100000210340_100000210202 [1,0,0,0,0,0|1,0,1]=3 110 B9R1.8 CCOc1cccnc1 34a_100000210849_100000210202 [1,0,0,0,0,0|2,0,1]=4 111 B9R1.8 CCOc1cccnc1 7a_100000210849_100000210202 [1,0,0,0,0,0|2,0,1]=4 112 B9R1.8 CCOc1ccncc1 34a_100000212176_100000210202 [1,0,0,0,0,0|2,0,1]=4 113 B9R1.8 CCSc1ccccc1 62a_100000210202_100000041952 [1,0,0,0,0,0|1,0,1]=3 114 B9R1.8 CCSc1ccccc1 62a_100000719477_100000210202 [1,0,0,0,0,0|1,0,1]=3 115 B9R1.8 CCSc1ccccn1 62a_100000210202_100011216584 [1,0,0,0,0,0|2,0,1]=4 116 B9R1.8 CCSc1ccccn1 62a_100011216584_100000210202 [1,0,0,0,0,0|2,0,1]=4 117 B9R1.8 CCSc1cccnc1 62a_100000210063_100000210202 [1,0,0,0,0,0|2,0,1]=4 118 B9R1.8 CCSc1cccnc1 62a_100000210202_100000210063 [1,0,0,0,0,0|2,0,1]=4 119 B9R1.8 CCSc1ccncc1 62a_100000210202_100000728582 [1,0,0,0,0,0|2,0,1]=4 120 B9R1.8 CCSc1ccncc1 62a_100000728582_100000210202 [1,0,0,0,0,0|2,0,1]=4 121 B9R1.8 CNCc1ccccc1 207a_100102657272_100015611070 [1,0,0,0,0,0|1,0,0]=2 122 B9R1.8 CNCc1ccccc1 2230a_100015324214_200000210301 [1,0,0,0,0,0|1,0,0]=2 123 B9R1.8 CNCc1ccccc1 2230a_106832991635_100015291786 [1,0,0,0,0,0|1,0,0]=2 124 B9R1.8 CNCc1ccccc1 270004a_106832991635_100015611070 [1,0,0,0,0,0|1,0,0]=2 125 B9R1.8 CNCc1ccccc1 34a_100015324214_200000210301 [1,0,0,0,0,0|1,0,0]=2 126 B9R1.8 CNCc1ccccc1 34a_100102657272_100015291786 [1,0,0,0,0,0|1,0,0]=2 127 B9R1.8 CNCc1ccccc1 7a_106832991635_100000211182 [1,0,0,0,0,0|1,0,0]=2 128 B9R1.8 CNCc1ccccn1 207a_100102657272_100000209966 [1,0,0,0,0,0|2,0,0]=3 129 B9R1.8 CNCc1ccccn1 2230a_106832991635_100000721315 [1,0,0,0,0,0|2,0,0]=3 130 B9R1.8 CNCc1ccccn1 270004a_106832991635_100000209966 [1,0,0,0,0,0|2,0,0]=3 131 B9R1.8 CNCc1ccccn1 34a_100102657272_100000721315 [1,0,0,0,0,0|2,0,0]=3 132 B9R1.8 CNCc1ccccn1 7a_106832991635_100000721315 [1,0,0,0,0,0|2,0,0]=3 133 B9R1.8 CNCc1cccnc1 207a_100102657272_100000209961 [1,0,0,0,0,0|2,0,0]=3 134 B9R1.8 CNCc1cccnc1 2230a_106832991635_100000741622 [1,0,0,0,0,0|2,0,0]=3 135 B9R1.8 CNCc1cccnc1 270004a_106832991635_100000209961 [1,0,0,0,0,0|2,0,0]=3 136 B9R1.8 CNCc1cccnc1 34a_100102657272_100000733263 [1,0,0,0,0,0|2,0,0]=3 137 B9R1.8 CNCc1cccnc1 7a_106832991635_100000741622 [1,0,0,0,0,0|2,0,0]=3 138 B9R1.8 CNCc1cccnn1 2230a_100159270163_200000210301 [1,0,0,0,0,0|3,0,0]=4 139 B9R1.8 CNCc1cccnn1 2230a_106832991635_100016990269 [1,0,0,0,0,0|3,0,0]=4 140 B9R1.8 CNCc1cccnn1 34a_100102657272_100016990269 [1,0,0,0,0,0|3,0,0]=4 141 B9R1.8 CNCc1cccnn1 7a_106832991635_100016990269 [1,0,0,0,0,0|3,0,0]=4 142 B9R1.8 CNCc1ccncc1 207a_100102657272_100000186114 [1,0,0,0,0,0|2,0,0]=3 143 B9R1.8 CNCc1ccncc1 2230a_106832991635_100015193705 [1,0,0,0,0,0|2,0,0]=3 144 B9R1.8 CNCc1ccncc1 7a_106832991635_100015193705 [1,0,0,0,0,0|2,0,0]=3 145 B9R1.8 CNCc1ccnnc1 270004a_106832991635_100011934578 [1,0,0,0,0,0|3,0,0]=4 146 B9R1.8 CNCc1cnccn1 2230a_106832991635_100016995436 [1,0,0,0,0,0|3,0,0]=4 147 B9R1.8 CNCc1cnccn1 270004a_106832991635_100000749867 [1,0,0,0,0,0|3,0,0]=4 148 B9R1.8 CNCc1cnccn1 34a_100102657272_100016995436 [1,0,0,0,0,0|3,0,0]=4 149 B9R1.8 CNCc1cnccn1 7a_106832991635_100016995436 [1,0,0,0,0,0|3,0,0]=4 150 B9R1.8 CNCc1cncnc1 2230a_100011243677_200000210301 [1,0,0,0,0,0|3,0,0]=4 151 B9R1.8 CNCc1cncnc1 2230a_106832991635_100015196519 [1,0,0,0,0,0|3,0,0]=4 152 B9R1.8 CNCc1cncnc1 270004a_106832991635_100000749868 [1,0,0,0,0,0|3,0,0]=4 153 B9R1.8 CNCc1cncnc1 34a_100102657272_100015196519 [1,0,0,0,0,0|3,0,0]=4 154 B9R1.8 CNCc1cncnc1 7a_106832991635_100015196519 [1,0,0,0,0,0|3,0,0]=4 155 B9R1.8 CNCc1ncccn1 2230a_106832991635_100000703007 [1,0,0,0,0,0|3,0,0]=4 156 B9R1.8 CNCc1ncccn1 270004a_106832991635_100011532527 [1,0,0,0,0,0|3,0,0]=4 157 B9R1.8 CNCc1ncccn1 34a_100102657272_100000703007 [1,0,0,0,0,0|3,0,0]=4 158 B9R1.8 CNCc1ncccn1 7a_106832991635_100000703007 [1,0,0,0,0,0|3,0,0]=4 159 B9R1.8 COCc1ccccc1 34a_100000210790_200000210301 [1,0,0,0,0,0|1,0,0]=2 160 B9R1.8 COCc1ccccc1 34a_100138415774_100015291786 [1,0,0,0,0,0|1,0,0]=2 161 B9R1.8 COCc1ccccc1 7a_100000210790_200000210301 [1,0,0,0,0,0|1,0,0]=2 162 B9R1.8 COCc1ccccn1 34a_100138415774_100000721315 [1,0,0,0,0,0|2,0,0]=3 163 B9R1.8 COCc1cccnc1 34a_100138415774_100000733263 [1,0,0,0,0,0|2,0,0]=3 164 B9R1.8 COCc1cccnn1 34a_100138415774_100016990269 [1,0,0,0,0,0|3,0,0]=4 165 B9R1.8 COCc1cnccn1 34a_100138415774_100016995436 [1,0,0,0,0,0|3,0,0]=4 166 B9R1.8 COCc1cncnc1 34a_100138415774_100015196519 [1,0,0,0,0,0|3,0,0]=4 167 B9R1.8 COCc1ncccn1 34a_100138415774_100000703007 [1,0,0,0,0,0|3,0,0]=4 168 B9R1.8 CSCc1ccccc1 62a_100000211182_200000210301 [1,0,0,0,0,0|1,0,0]=2 169 B9R1.8 CSCc1ccccc1 62a_200000210301_100015291786 [1,0,0,0,0,0|1,0,0]=2 170 B9R1.8 CSCc1ccccn1 62a_100000721315_200000210301 [1,0,0,0,0,0|2,0,0]=3 171 B9R1.8 CSCc1ccccn1 62a_200000210301_100000721315 [1,0,0,0,0,0|2,0,0]=3 172 B9R1.8 CSCc1cccnc1 62a_100000741622_200000210301 [1,0,0,0,0,0|2,0,0]=3 173 B9R1.8 CSCc1cccnc1 62a_200000210301_100000741622 [1,0,0,0,0,0|2,0,0]=3 174 B9R1.8 CSCc1cccnn1 62a_100016990269_200000210301 [1,0,0,0,0,0|3,0,0]=4 175 B9R1.8 CSCc1cccnn1 62a_200000210301_100016990269 [1,0,0,0,0,0|3,0,0]=4 176 B9R1.8 CSCc1ccncc1 62a_100015193705_200000210301 [1,0,0,0,0,0|2,0,0]=3 177 B9R1.8 CSCc1ccncc1 62a_200000210301_100015193705 [1,0,0,0,0,0|2,0,0]=3 178 B9R1.8 CSCc1cnccn1 62a_100016995436_200000210301 [1,0,0,0,0,0|3,0,0]=4 179 B9R1.8 CSCc1cnccn1 62a_200000210301_100016995436 [1,0,0,0,0,0|3,0,0]=4 180 B9R1.8 CSCc1cncnc1 62a_100015196519_200000210301 [1,0,0,0,0,0|3,0,0]=4 181 B9R1.8 CSCc1cncnc1 62a_200000210301_100015196519 [1,0,0,0,0,0|3,0,0]=4 182 B9R1.8 CSCc1ncccn1 62a_100000703007_200000210301 [1,0,0,0,0,0|3,0,0]=4 183 B9R1.8 CSCc1ncccn1 62a_200000210301_100000703007 [1,0,0,0,0,0|3,0,0]=4 184 B9R1.8 FCNc1ccccc1 34a_100000106764_100015361967 [1,0,0,0,0,0|2,0,1]=4 185 B9R1.8 FCOc1ccccc1 34a_100000210340_100015361967 [1,0,0,0,0,0|2,0,1]=4 186 B9R1.8 FCOc1ccccc1 7a_100000210340_100015361967 [1,0,0,0,0,0|2,0,1]=4 187 B9R1.8 FCSc1ccccc1 62a_100000719477_100015361967 [1,0,0,0,0,0|2,0,1]=4 188 B9R1.8 FCSc1ccccc1 62a_100015361967_100000041952 [1,0,0,0,0,0|2,0,1]=4 189 B9R1.8 [13CH3]NCc1ccccc1 2230a_100015324214_200025704644 [1,0,0,0,0,0|1,0,0]=2 190 B9R1.8 [13CH3]NCc1ccccc1 34a_100015324214_200025704644 [1,0,0,0,0,0|1,0,0]=2 191 B9R1.8 [13CH3]NCc1cccnn1 2230a_100159270163_200025704644 [1,0,0,0,0,0|3,0,0]=4 192 B9R1.8 [13CH3]NCc1cncnc1 2230a_100011243677_200025704644 [1,0,0,0,0,0|3,0,0]=4 193 B9R1.8 [13CH3]OCc1ccccc1 34a_100000210790_200025704644 [1,0,0,0,0,0|1,0,0]=2 194 B9R1.8 [13CH3]OCc1ccccc1 7a_100000210790_200025704644 [1,0,0,0,0,0|1,0,0]=2 195 B9R1.8 [13CH3]SCc1ccccc1 62a_100000211182_200025704644 [1,0,0,0,0,0|1,0,0]=2 196 B9R1.8 [13CH3]SCc1ccccc1 62a_200025704644_100015291786 [1,0,0,0,0,0|1,0,0]=2 197 B9R1.8 [13CH3]SCc1ccccn1 62a_100000721315_200025704644 [1,0,0,0,0,0|2,0,0]=3 198 B9R1.8 [13CH3]SCc1ccccn1 62a_200025704644_100000721315 [1,0,0,0,0,0|2,0,0]=3 199 B9R1.8 [13CH3]SCc1cccnc1 62a_100000741622_200025704644 [1,0,0,0,0,0|2,0,0]=3 200 B9R1.8 [13CH3]SCc1cccnc1 62a_200025704644_100000741622 [1,0,0,0,0,0|2,0,0]=3 201 B9R1.8 [13CH3]SCc1cccnn1 62a_100016990269_200025704644 [1,0,0,0,0,0|3,0,0]=4 202 B9R1.8 [13CH3]SCc1cccnn1 62a_200025704644_100016990269 [1,0,0,0,0,0|3,0,0]=4 203 B9R1.8 [13CH3]SCc1ccncc1 62a_100015193705_200025704644 [1,0,0,0,0,0|2,0,0]=3 204 B9R1.8 [13CH3]SCc1ccncc1 62a_200025704644_100015193705 [1,0,0,0,0,0|2,0,0]=3 205 B9R1.8 [13CH3]SCc1cnccn1 62a_100016995436_200025704644 [1,0,0,0,0,0|3,0,0]=4 206 B9R1.8 [13CH3]SCc1cnccn1 62a_200025704644_100016995436 [1,0,0,0,0,0|3,0,0]=4 207 B9R1.8 [13CH3]SCc1cncnc1 62a_100015196519_200025704644 [1,0,0,0,0,0|3,0,0]=4 208 B9R1.8 [13CH3]SCc1cncnc1 62a_200025704644_100015196519 [1,0,0,0,0,0|3,0,0]=4 209 B9R1.8 [13CH3]SCc1ncccn1 62a_100000703007_200025704644 [1,0,0,0,0,0|3,0,0]=4 210 B9R1.8 [13CH3]SCc1ncccn1 62a_200025704644_100000703007 [1,0,0,0,0,0|3,0,0]=4 211 B11R1.20 CC(=Cc1cc[n+](cc1)[O-])C 271570a_100102525489_100000039755 [0,1,0,0,0,0|1,0,2]=4 212 B11R1.20 CC(=Cc1ccc(=O)[nH]c1)C 271570a_100102525489_100000212171 [0,1,0,0,0,0|1,0,2]=4 213 B11R1.20 CC(=Cc1ccc(cc1)Br)C 271570a_100102525489_100000752885 [0,1,0,0,0,0|0,0,2]=3 214 B11R1.20 CC(=Cc1ccc(cc1)C)C 271570a_100102525489_100000186775 [0,1,0,0,0,0|0,0,2]=3 215 B11R1.20 CC(=Cc1ccc(cc1)Cl)C 271570a_100102525489_100000755918 [0,1,0,0,0,0|0,0,2]=3 216 B11R1.20 CC(=Cc1ccc(cc1)F)C 271570a_100102525489_100000211213 [0,1,0,0,0,0|0,0,2]=3 217 B11R1.20 CC(=Cc1ccc(cc1)N)C 271570a_100102525489_100000185761 [0,1,0,0,0,0|0,0,2]=3 218 B11R1.20 CC(=Cc1ccc(cc1)O)C 271570a_100102525489_100000185759 [0,1,0,0,0,0|0,0,2]=3 219 B11R1.20 CC(=Cc1ccc(cn1)Br)C 271570a_100102525489_100000686858 [0,1,0,0,0,0|1,0,2]=4 220 B11R1.20 CC(=Cc1ccc(cn1)C)C 271570a_100102525489_100000754016 [0,1,0,0,0,0|1,0,2]=4 221 B11R1.20 CC(=Cc1ccc(cn1)Cl)C 271570a_100102525489_100011356976 [0,1,0,0,0,0|1,0,2]=4 222 B11R1.20 CC(=Cc1ccc(cn1)F)C 271570a_100102525489_100000744514 [0,1,0,0,0,0|1,0,2]=4 223 B11R1.20 CC(=Cc1ccc(cn1)N)C 271570a_100102525489_100000744251 [0,1,0,0,0,0|1,0,2]=4 224 B11R1.20 CC(=Cc1ccc(cn1)O)C 271570a_100102525489_100000685995 [0,1,0,0,0,0|1,0,2]=4 225 B11R1.20 CC(=Cc1ccc(nc1)Br)C 271570a_100102525489_100009814638 [0,1,0,0,0,0|1,0,2]=4 226 B11R1.20 CC(=Cc1ccc(nc1)C)C 271570a_100102525489_100000751577 [0,1,0,0,0,0|1,0,2]=4 227 B11R1.20 CC(=Cc1ccc(nc1)Cl)C 271570a_100102525489_100000034144 [0,1,0,0,0,0|1,0,2]=4 228 B11R1.20 CC(=Cc1ccc(nc1)F)C 271570a_100102525489_100000748661 [0,1,0,0,0,0|1,0,2]=4 229 B11R1.20 CC(=Cc1ccc(nc1)N)C 271570a_100102525489_100000187370 [0,1,0,0,0,0|1,0,2]=4 230 B11R1.20 CC(=O)Cc1ccc(cc1)Br 1458a_100000070787_100000189115 [0,1,0,0,0,0|1,0,0]=2 231 B11R1.20 CC(=O)Cc1ccc(cc1)Br 1458a_100000198978_200000210301 [0,1,0,0,0,0|1,0,0]=2 232 B11R1.20 CC(=O)Cc1ccc(cc1)C 1458a_100000070787_100000210814 [0,1,0,0,0,0|1,0,0]=2 233 B11R1.20 CC(=O)Cc1ccc(cc1)C 1458a_100000212244_200000210301 [0,1,0,0,0,0|1,0,0]=2 234 B11R1.20 CC(=O)Cc1ccc(cc1)Cl 1458a_100000070787_100000694040 [0,1,0,0,0,0|1,0,0]=2 235 B11R1.20 CC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_200000210301 [0,1,0,0,0,0|1,0,0]=2 236 B11R1.20 CC(=O)Cc1ccc(cc1)F 1458a_100000070787_100000198546 [0,1,0,0,0,0|1,0,0]=2 237 B11R1.20 CC(=O)Cc1ccc(cc1)F 1458a_100000210951_200000210301 [0,1,0,0,0,0|1,0,0]=2 238 B11R1.20 CC(=O)Cc1ccc(cc1)I 1458a_100000070787_100000189116 [0,1,0,0,0,0|1,0,0]=2 239 B11R1.20 CC(=O)Cc1ccc(cc1)I 1458a_100000688869_200000210301 [0,1,0,0,0,0|1,0,0]=2 240 B11R1.20 CC(=O)Cc1ccc(cc1)O 1458a_100000198540_200000210301 [0,1,0,0,0,0|1,0,0]=2 241 B11R1.20 CC(=O)Cc1ccc(cc1)O 271570a_203496583355_100000691760 [0,1,0,0,0,0|1,0,0]=2 242 B11R1.20 CC(=O)Cc1ccc(cn1)Br 1458a_100000070787_100000702658 [0,1,0,0,0,0|2,0,0]=3 243 B11R1.20 CC(=O)Cc1ccc(cn1)Br 1458a_100020629044_200000210301 [0,1,0,0,0,0|2,0,0]=3 244 B11R1.20 CC(=O)Cc1ccc(cn1)C 1458a_100000070787_100000691093 [0,1,0,0,0,0|2,0,0]=3 245 B11R1.20 CC(=O)Cc1ccc(cn1)C 1458a_100025705728_200000210301 [0,1,0,0,0,0|2,0,0]=3 246 B11R1.20 CC(=O)Cc1ccc(cn1)Cl 1458a_100000070787_100012066911 [0,1,0,0,0,0|2,0,0]=3 247 B11R1.20 CC(=O)Cc1ccc(cn1)Cl 1458a_100000728320_200000210301 [0,1,0,0,0,0|2,0,0]=3 248 B11R1.20 CC(=O)Cc1ccc(cn1)F 1458a_100000070787_100000703193 [0,1,0,0,0,0|2,0,0]=3 249 B11R1.20 CC(=O)Cc1ccc(nc1)Br 1458a_100000070787_100009831999 [0,1,0,0,0,0|2,0,0]=3 250 B11R1.20 CC(=O)Cc1ccc(nc1)Br 1458a_100010067268_200000210301 [0,1,0,0,0,0|2,0,0]=3 251 B11R1.20 CC(=O)Cc1ccc(nc1)C 1458a_100000070787_100016987292 [0,1,0,0,0,0|2,0,0]=3 252 B11R1.20 CC(=O)Cc1ccc(nc1)C 1458a_100000740413_200000210301 [0,1,0,0,0,0|2,0,0]=3 253 B11R1.20 CC(=O)Cc1ccc(nc1)Cl 1458a_100000061944_200000210301 [0,1,0,0,0,0|2,0,0]=3 254 B11R1.20 CC(=O)Cc1ccc(nc1)Cl 1458a_100000070787_100000735431 [0,1,0,0,0,0|2,0,0]=3 255 B11R1.20 CC(=O)Cc1ccc(nc1)F 1458a_100000070787_100009820150 [0,1,0,0,0,0|2,0,0]=3 256 B11R1.20 CC(=O)Cc1ccc(nn1)Cl 1458a_100000070787_100016992710 [0,1,0,0,0,0|3,0,0]=4 257 B11R1.20 CC(=O)Cc1cnc(cn1)C 1458a_100000070787_100000752025 [0,1,0,0,0,0|3,0,0]=4 258 B11R1.20 CC(=O)Cc1ncc(cn1)Br 1458a_100000070787_100010064664 [0,1,0,0,0,0|3,0,0]=4 259 B11R1.20 CC(=O)Cc1ncc(cn1)C 1458a_100000070787_100000685645 [0,1,0,0,0,0|3,0,0]=4 260 B11R1.20 CC(=O)Cn1ccc(=O)cc1 1458a_200000238563_200000210301 [0,1,0,0,0,0|2,0,0]=3 261 B11R1.20 CC(=O)Nc1ccc(cc1)Br 11a_100000210018_100015343762 [0,1,0,0,0,0|2,0,0]=3 262 B11R1.20 CC(=O)Nc1ccc(cc1)Br 1626a_100000210018_100015343762 [0,1,0,0,0,0|2,0,0]=3 263 B11R1.20 CC(=O)Nc1ccc(cc1)Br 22a_100000210018_100000070787 [0,1,0,0,0,0|2,0,0]=3 264 B11R1.20 CC(=O)Nc1ccc(cc1)Br 527a_100000210018_100103153847 [0,1,0,0,0,0|2,0,0]=3 265 B11R1.20 CC(=O)Nc1ccc(cc1)C 11a_100000124888_100015343762 [0,1,0,0,0,0|2,0,0]=3 266 B11R1.20 CC(=O)Nc1ccc(cc1)C 1626a_100000124888_100015343762 [0,1,0,0,0,0|2,0,0]=3 267 B11R1.20 CC(=O)Nc1ccc(cc1)C 22a_100000124888_100000070787 [0,1,0,0,0,0|2,0,0]=3 268 B11R1.20 CC(=O)Nc1ccc(cc1)C 527a_100000124888_100103153847 [0,1,0,0,0,0|2,0,0]=3 269 B11R1.20 CC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100015343762 [0,1,0,0,0,0|2,0,0]=3 270 B11R1.20 CC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100015343762 [0,1,0,0,0,0|2,0,0]=3 271 B11R1.20 CC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000070787 [0,1,0,0,0,0|2,0,0]=3 272 B11R1.20 CC(=O)Nc1ccc(cc1)Cl 527a_100000210052_100103153847 [0,1,0,0,0,0|2,0,0]=3 273 B11R1.20 CC(=O)Nc1ccc(cc1)F 11a_100000185862_100015343762 [0,1,0,0,0,0|2,0,0]=3 274 B11R1.20 CC(=O)Nc1ccc(cc1)F 1626a_100000185862_100015343762 [0,1,0,0,0,0|2,0,0]=3 275 B11R1.20 CC(=O)Nc1ccc(cc1)F 22a_100000185862_100000070787 [0,1,0,0,0,0|2,0,0]=3 276 B11R1.20 CC(=O)Nc1ccc(cc1)F 527a_100000185862_100103153847 [0,1,0,0,0,0|2,0,0]=3 277 B11R1.20 CC(=O)Nc1ccc(cc1)I 11a_100000185761_100015343762 [0,1,0,0,0,0|2,0,0]=3 278 B11R1.20 CC(=O)Nc1ccc(cc1)I 1626a_100000185761_100015343762 [0,1,0,0,0,0|2,0,0]=3 279 B11R1.20 CC(=O)Nc1ccc(cc1)I 22a_100000185761_100000070787 [0,1,0,0,0,0|2,0,0]=3 280 B11R1.20 CC(=O)Nc1ccc(cc1)I 527a_100000185761_100103153847 [0,1,0,0,0,0|2,0,0]=3 281 B11R1.20 CC(=O)Nc1ccc(cc1)O 22a_100000185829_100000070787 [0,1,0,0,0,0|2,0,0]=3 282 B11R1.20 CC(=O)Nc1ccc(cc1)O 271570a_203496583355_100000155215 [0,1,0,0,0,0|2,0,0]=3 283 B11R1.20 CC(=O)Nc1ccc(cn1)O 271570a_203496583355_100000193312 [0,1,0,0,0,0|3,0,0]=4 284 B11R1.20 CC(=O)Nc1ccc(nc1)O 271570a_203496583355_100011934715 [0,1,0,0,0,0|3,0,0]=4 285 B11R1.20 CC(=O)Oc1ccc(cc1)O 271570a_203496583355_100000002173 [0,1,0,0,0,0|2,0,0]=3 286 B11R1.20 CC(=O)Sc1ccc(cc1)O 271570a_203496583355_200009995050 [0,1,0,0,0,0|2,0,0]=3 287 B11R1.20 CC(=S)Oc1ccc(cc1)O 271570a_203496583355_200009816735 [0,1,0,0,0,0|2,0,0]=3 288 B11R1.20 CC(C)Cc1ccc(cc1)O 271570a_203496583355_100011221366 [0,1,0,0,0,0|0,0,2]=3 289 B11R1.20 CC(C)Nc1ccc(cc1)Br 2230a_100000210018_100000210206 [0,1,0,0,0,0|1,0,2]=4 290 B11R1.20 CC(C)Nc1ccc(cc1)Br 34a_100000210018_100000210206 [0,1,0,0,0,0|1,0,2]=4 291 B11R1.20 CC(C)Nc1ccc(cc1)Cl 2230a_100000210052_100000210206 [0,1,0,0,0,0|1,0,2]=4 292 B11R1.20 CC(C)Nc1ccc(cc1)Cl 34a_100000210052_100000210206 [0,1,0,0,0,0|1,0,2]=4 293 B11R1.20 CC(C)Nc1ccc(cc1)F 34a_100000185862_100000210206 [0,1,0,0,0,0|1,0,2]=4 294 B11R1.20 CC(C)Nc1ccc(cc1)I 34a_100000185761_100000210206 [0,1,0,0,0,0|1,0,2]=4 295 B11R1.20 CC(C)Nc1ccc(cc1)O 271570a_203496583355_100000219625 [0,1,0,0,0,0|1,0,2]=4 296 B11R1.20 CC(C)Nc1ccc(cc1)O 34a_100000185829_100000210206 [0,1,0,0,0,0|1,0,2]=4 297 B11R1.20 CC(C)Oc1ccc(cc1)Br 34a_100000185759_100000210206 [0,1,0,0,0,0|1,0,2]=4 298 B11R1.20 CC(C)Oc1ccc(cc1)Br 7a_100000185759_100000210206 [0,1,0,0,0,0|1,0,2]=4 299 B11R1.20 CC(C)Oc1ccc(cc1)Cl 34a_100000210216_100000210206 [0,1,0,0,0,0|1,0,2]=4 300 B11R1.20 CC(C)Oc1ccc(cc1)Cl 7a_100000210216_100000210206 [0,1,0,0,0,0|1,0,2]=4 301 B11R1.20 CC(C)Oc1ccc(cc1)F 34a_100000210339_100000210206 [0,1,0,0,0,0|1,0,2]=4 302 B11R1.20 CC(C)Oc1ccc(cc1)I 34a_100000212066_100000210206 [0,1,0,0,0,0|1,0,2]=4 303 B11R1.20 CC(C)Oc1ccc(cc1)I 7a_100000212066_100000210206 [0,1,0,0,0,0|1,0,2]=4 304 B11R1.20 CC(C)Oc1ccc(cc1)N 34a_100000185829_100000210206 [0,1,0,0,0,0|1,0,2]=4 305 B11R1.20 CC(C)Oc1ccc(cc1)O 271570a_203496583355_100000169947 [0,1,0,0,0,0|1,0,2]=4 306 B11R1.20 CC(C)Sc1ccc(cc1)Br 62a_100000210206_100000752885 [0,1,0,0,0,0|1,0,2]=4 307 B11R1.20 CC(C)Sc1ccc(cc1)Br 62a_100000752885_100000210206 [0,1,0,0,0,0|1,0,2]=4 308 B11R1.20 CC(C)Sc1ccc(cc1)Cl 62a_100000210206_100000755918 [0,1,0,0,0,0|1,0,2]=4 309 B11R1.20 CC(C)Sc1ccc(cc1)Cl 62a_100000755918_100000210206 [0,1,0,0,0,0|1,0,2]=4 310 B11R1.20 CC(C)Sc1ccc(cc1)F 62a_100000210206_100000211213 [0,1,0,0,0,0|1,0,2]=4 311 B11R1.20 CC(C)Sc1ccc(cc1)F 62a_100000211213_100000210206 [0,1,0,0,0,0|1,0,2]=4 312 B11R1.20 CC(C)Sc1ccc(cc1)N 62a_100000185761_100000210206 [0,1,0,0,0,0|1,0,2]=4 313 B11R1.20 CC(C)Sc1ccc(cc1)N 62a_100000210206_100000185761 [0,1,0,0,0,0|1,0,2]=4 314 B11R1.20 CC(C)Sc1ccc(cc1)O 271570a_203496583355_100009811894 [0,1,0,0,0,0|1,0,2]=4 315 B11R1.20 CC(C)Sc1ccc(cc1)O 62a_100000210206_100000185759 [0,1,0,0,0,0|1,0,2]=4 316 B11R1.20 CN(C)Cc1ccc(cc1)Br 2230a_100000180866_200000210301 [0,1,0,0,0,0|1,0,1]=3 317 B11R1.20 CN(C)Cc1ccc(cc1)Br 2230a_100102631434_100011217064 [0,1,0,0,0,0|1,0,1]=3 318 B11R1.20 CN(C)Cc1ccc(cc1)Br 269982a_100000180866_200000210301 [0,1,0,0,0,0|1,0,1]=3 319 B11R1.20 CN(C)Cc1ccc(cc1)Br 269982a_100102631434_100011217064 [0,1,0,0,0,0|1,0,1]=3 320 B11R1.20 CN(C)Cc1ccc(cc1)Br 270004a_100102631434_100000186029 [0,1,0,0,0,0|1,0,1]=3 321 B11R1.20 CN(C)Cc1ccc(cc1)Cl 2230a_100000184517_200000210301 [0,1,0,0,0,0|1,0,1]=3 322 B11R1.20 CN(C)Cc1ccc(cc1)Cl 2230a_100102631434_100000694040 [0,1,0,0,0,0|1,0,1]=3 323 B11R1.20 CN(C)Cc1ccc(cc1)Cl 269982a_100000184517_200000210301 [0,1,0,0,0,0|1,0,1]=3 324 B11R1.20 CN(C)Cc1ccc(cc1)Cl 269982a_100102631434_100000187161 [0,1,0,0,0,0|1,0,1]=3 325 B11R1.20 CN(C)Cc1ccc(cc1)Cl 270004a_100102631434_100000189385 [0,1,0,0,0,0|1,0,1]=3 326 B11R1.20 CN(C)Cc1ccc(cc1)Cl 34a_100000184517_200000210301 [0,1,0,0,0,0|1,0,1]=3 327 B11R1.20 CN(C)Cc1ccc(cc1)F 2230a_100000184576_200000210301 [0,1,0,0,0,0|1,0,1]=3 328 B11R1.20 CN(C)Cc1ccc(cc1)F 2230a_100102631434_100000198546 [0,1,0,0,0,0|1,0,1]=3 329 B11R1.20 CN(C)Cc1ccc(cc1)F 269982a_100000184576_200000210301 [0,1,0,0,0,0|1,0,1]=3 330 B11R1.20 CN(C)Cc1ccc(cc1)F 269982a_100102631434_100000198546 [0,1,0,0,0,0|1,0,1]=3 331 B11R1.20 CN(C)Cc1ccc(cc1)F 270004a_100102631434_100000210084 [0,1,0,0,0,0|1,0,1]=3 332 B11R1.20 CN(C)Cc1ccc(cc1)F 34a_100000184576_200000210301 [0,1,0,0,0,0|1,0,1]=3 333 B11R1.20 CN(C)Cc1ccc(cc1)I 2230a_100102631434_100000189116 [0,1,0,0,0,0|1,0,1]=3 334 B11R1.20 CN(C)Cc1ccc(cc1)I 269982a_100102631434_100000189116 [0,1,0,0,0,0|1,0,1]=3 335 B11R1.20 CN(C)Cc1ccc(cc1)O 2230a_100000207500_200000210301 [0,1,0,0,0,0|1,0,1]=3 336 B11R1.20 CN(C)Cc1ccc(cc1)O 269982a_100000207500_200000210301 [0,1,0,0,0,0|1,0,1]=3 337 B11R1.20 CN(C)Cc1ccc(cc1)O 271570a_203496583355_100000174694 [0,1,0,0,0,0|1,0,1]=3 338 B11R1.20 CN(C)Cc1ccc(cn1)Br 2230a_100102631434_100000702658 [0,1,0,0,0,0|2,0,1]=4 339 B11R1.20 CN(C)Cc1ccc(cn1)Br 269982a_100102631434_100000702658 [0,1,0,0,0,0|2,0,1]=4 340 B11R1.20 CN(C)Cc1ccc(cn1)Br 270004a_100102631434_100000754260 [0,1,0,0,0,0|2,0,1]=4 341 B11R1.20 CN(C)Cc1ccc(cn1)Cl 2230a_100102631434_100012066911 [0,1,0,0,0,0|2,0,1]=4 342 B11R1.20 CN(C)Cc1ccc(cn1)Cl 269982a_100102631434_100000697101 [0,1,0,0,0,0|2,0,1]=4 343 B11R1.20 CN(C)Cc1ccc(cn1)Cl 270004a_100102631434_100011361569 [0,1,0,0,0,0|2,0,1]=4 344 B11R1.20 CN(C)Cc1ccc(cn1)F 2230a_100102631434_100000703193 [0,1,0,0,0,0|2,0,1]=4 345 B11R1.20 CN(C)Cc1ccc(cn1)F 269982a_100102631434_100000703193 [0,1,0,0,0,0|2,0,1]=4 346 B11R1.20 CN(C)Cc1ccc(cn1)F 270004a_100102631434_100011934744 [0,1,0,0,0,0|2,0,1]=4 347 B11R1.20 CN(C)Cc1ccc(nc1)Br 2230a_100102631434_100009831999 [0,1,0,0,0,0|2,0,1]=4 348 B11R1.20 CN(C)Cc1ccc(nc1)Br 269982a_100102631434_100009831999 [0,1,0,0,0,0|2,0,1]=4 349 B11R1.20 CN(C)Cc1ccc(nc1)Cl 2230a_100000026953_200000210301 [0,1,0,0,0,0|2,0,1]=4 350 B11R1.20 CN(C)Cc1ccc(nc1)Cl 2230a_100102631434_100000735431 [0,1,0,0,0,0|2,0,1]=4 351 B11R1.20 CN(C)Cc1ccc(nc1)Cl 269982a_100000026953_200000210301 [0,1,0,0,0,0|2,0,1]=4 352 B11R1.20 CN(C)Cc1ccc(nc1)Cl 269982a_100102631434_100000735431 [0,1,0,0,0,0|2,0,1]=4 353 B11R1.20 CN(C)Cc1ccc(nc1)Cl 34a_100000026953_200000210301 [0,1,0,0,0,0|2,0,1]=4 354 B11R1.20 CN(C)Cc1ccc(nc1)F 2230a_100102631434_100009820150 [0,1,0,0,0,0|2,0,1]=4 355 B11R1.20 CN(C)Cc1ccc(nc1)F 269982a_100102631434_100009820150 [0,1,0,0,0,0|2,0,1]=4 356 B11R1.20 CN(C)Cc1ccc(nc1)O 271570a_203496583355_106446545466 [0,1,0,0,0,0|2,0,1]=4 357 B11R1.20 CN([13CH3])Cc1ccc(cc1)Br 2230a_100000180866_200025704644 [0,1,0,0,0,0|1,0,1]=3 358 B11R1.20 CN([13CH3])Cc1ccc(cc1)Br 269982a_100000180866_200025704644 [0,1,0,0,0,0|1,0,1]=3 359 B11R1.20 CN([13CH3])Cc1ccc(cc1)Cl 2230a_100000184517_200025704644 [0,1,0,0,0,0|1,0,1]=3 360 B11R1.20 CN([13CH3])Cc1ccc(cc1)Cl 269982a_100000184517_200025704644 [0,1,0,0,0,0|1,0,1]=3 361 B11R1.20 CN([13CH3])Cc1ccc(cc1)Cl 34a_100000184517_200025704644 [0,1,0,0,0,0|1,0,1]=3 362 B11R1.20 CN([13CH3])Cc1ccc(cc1)F 2230a_100000184576_200025704644 [0,1,0,0,0,0|1,0,1]=3 363 B11R1.20 CN([13CH3])Cc1ccc(cc1)F 269982a_100000184576_200025704644 [0,1,0,0,0,0|1,0,1]=3 364 B11R1.20 CN([13CH3])Cc1ccc(cc1)F 34a_100000184576_200025704644 [0,1,0,0,0,0|1,0,1]=3 365 B11R1.20 CN([13CH3])Cc1ccc(cc1)O 2230a_100000207500_200025704644 [0,1,0,0,0,0|1,0,1]=3 366 B11R1.20 CN([13CH3])Cc1ccc(cc1)O 269982a_100000207500_200025704644 [0,1,0,0,0,0|1,0,1]=3 367 B11R1.20 CN([13CH3])Cc1ccc(nc1)Cl 2230a_100000026953_200025704644 [0,1,0,0,0,0|2,0,1]=4 368 B11R1.20 CN([13CH3])Cc1ccc(nc1)Cl 269982a_100000026953_200025704644 [0,1,0,0,0,0|2,0,1]=4 369 B11R1.20 CN([13CH3])Cc1ccc(nc1)Cl 34a_100000026953_200025704644 [0,1,0,0,0,0|2,0,1]=4 370 B11R1.20 Cc1ccc(cc1)CC(=O)[13CH3] 1458a_100000212244_200025704644 [0,1,0,0,0,0|1,0,0]=2 371 B11R1.20 Cc1ccc(cc1)CN(C)C 2230a_100000744650_200000210301 [0,1,0,0,0,0|1,0,1]=3 372 B11R1.20 Cc1ccc(cc1)CN(C)C 2230a_100102631434_100000210814 [0,1,0,0,0,0|1,0,1]=3 373 B11R1.20 Cc1ccc(cc1)CN(C)C 269982a_100000744650_200000210301 [0,1,0,0,0,0|1,0,1]=3 374 B11R1.20 Cc1ccc(cc1)CN(C)C 269982a_100102631434_100000210814 [0,1,0,0,0,0|1,0,1]=3 375 B11R1.20 Cc1ccc(cc1)CN(C)C 270004a_100102631434_100000211033 [0,1,0,0,0,0|1,0,1]=3 376 B11R1.20 Cc1ccc(cc1)CN(C)C 34a_100000744650_200000210301 [0,1,0,0,0,0|1,0,1]=3 377 B11R1.20 Cc1ccc(cc1)CN(C)[13CH3] 2230a_100000744650_200025704644 [0,1,0,0,0,0|1,0,1]=3 378 B11R1.20 Cc1ccc(cc1)CN(C)[13CH3] 269982a_100000744650_200025704644 [0,1,0,0,0,0|1,0,1]=3 379 B11R1.20 Cc1ccc(cc1)CN(C)[13CH3] 34a_100000744650_200025704644 [0,1,0,0,0,0|1,0,1]=3 380 B11R1.20 Cc1ccc(cc1)NC(C)C 34a_100000124888_100000210206 [0,1,0,0,0,0|1,0,2]=4 381 B11R1.20 Cc1ccc(cc1)OC(C)C 34a_100000210336_100000210206 [0,1,0,0,0,0|1,0,2]=4 382 B11R1.20 Cc1ccc(cc1)OC(C)C 7a_100000210336_100000210206 [0,1,0,0,0,0|1,0,2]=4 383 B11R1.20 Cc1ccc(cc1)SC(C)C 62a_100000186775_100000210206 [0,1,0,0,0,0|1,0,2]=4 384 B11R1.20 Cc1ccc(cc1)SC(C)C 62a_100000210206_100000186775 [0,1,0,0,0,0|1,0,2]=4 385 B11R1.20 Cc1ccc(cn1)CC(=O)[13CH3] 1458a_100000740413_200025704644 [0,1,0,0,0,0|2,0,0]=3 386 B11R1.20 Cc1ccc(cn1)CN(C)C 2230a_100102631434_100016987292 [0,1,0,0,0,0|2,0,1]=4 387 B11R1.20 Cc1ccc(cn1)CN(C)C 2230a_106623407658_200000210301 [0,1,0,0,0,0|2,0,1]=4 388 B11R1.20 Cc1ccc(cn1)CN(C)C 269982a_100102631434_100016987292 [0,1,0,0,0,0|2,0,1]=4 389 B11R1.20 Cc1ccc(cn1)CN(C)C 269982a_106623407658_200000210301 [0,1,0,0,0,0|2,0,1]=4 390 B11R1.20 Cc1ccc(cn1)CN(C)C 270004a_100102631434_100000743784 [0,1,0,0,0,0|2,0,1]=4 391 B11R1.20 Cc1ccc(cn1)CN(C)C 34a_106623407658_200000210301 [0,1,0,0,0,0|2,0,1]=4 392 B11R1.20 Cc1ccc(cn1)CN(C)[13CH3] 2230a_106623407658_200025704644 [0,1,0,0,0,0|2,0,1]=4 393 B11R1.20 Cc1ccc(cn1)CN(C)[13CH3] 269982a_106623407658_200025704644 [0,1,0,0,0,0|2,0,1]=4 394 B11R1.20 Cc1ccc(cn1)CN(C)[13CH3] 34a_106623407658_200025704644 [0,1,0,0,0,0|2,0,1]=4 395 B11R1.20 Cc1ccc(nc1)CC(=O)[13CH3] 1458a_100025705728_200025704644 [0,1,0,0,0,0|2,0,0]=3 396 B11R1.20 Cc1ccc(nc1)CN(C)C 2230a_100102631434_100000691093 [0,1,0,0,0,0|2,0,1]=4 397 B11R1.20 Cc1ccc(nc1)CN(C)C 2230a_200000717808_200000210301 [0,1,0,0,0,0|2,0,1]=4 398 B11R1.20 Cc1ccc(nc1)CN(C)C 269982a_100102631434_100000691093 [0,1,0,0,0,0|2,0,1]=4 399 B11R1.20 Cc1ccc(nc1)CN(C)C 269982a_200000717808_200000210301 [0,1,0,0,0,0|2,0,1]=4 400 B11R1.20 Cc1ccc(nc1)CN(C)C 270004a_100102631434_100000050478 [0,1,0,0,0,0|2,0,1]=4 401 B11R1.20 Cc1ccc(nc1)CN(C)[13CH3] 2230a_200000717808_200025704644 [0,1,0,0,0,0|2,0,1]=4 402 B11R1.20 Cc1ccc(nc1)CN(C)[13CH3] 269982a_200000717808_200025704644 [0,1,0,0,0,0|2,0,1]=4 403 B11R1.20 NC(=O)Cc1ccc(cc1)O 271570a_203496583355_100000162331 [0,1,0,0,0,0|2,0,0]=3 404 B11R1.20 NC(=O)Cc1ccc(cn1)O 271570a_203496583355_200010888337 [0,1,0,0,0,0|3,0,0]=4 405 B11R1.20 NC(=O)Cc1ccc(nc1)O 271570a_203496583355_200000071513 [0,1,0,0,0,0|3,0,0]=4 406 B11R1.20 NC(=O)Nc1ccc(cc1)O 271570a_203496583355_100000198584 [0,1,0,0,0,0|3,0,0]=4 407 B11R1.20 Oc1ccc(cc1)C=C(Br)Br 271570a_203496583355_200013992848 [0,1,0,0,0,0|2,0,1]=4 408 B11R1.20 Oc1ccc(cc1)C=C(F)F 271570a_203496583355_200009816947 [0,1,0,0,0,0|2,0,1]=4 409 B11R1.20 [13CH3]C(=O)Cc1ccc(cc1)Br 1458a_100000198978_200025704644 [0,1,0,0,0,0|1,0,0]=2 410 B11R1.20 [13CH3]C(=O)Cc1ccc(cc1)Cl 1458a_100000211027_200025704644 [0,1,0,0,0,0|1,0,0]=2 411 B11R1.20 [13CH3]C(=O)Cc1ccc(cc1)F 1458a_100000210951_200025704644 [0,1,0,0,0,0|1,0,0]=2 412 B11R1.20 [13CH3]C(=O)Cc1ccc(cc1)I 1458a_100000688869_200025704644 [0,1,0,0,0,0|1,0,0]=2 413 B11R1.20 [13CH3]C(=O)Cc1ccc(cc1)O 1458a_100000198540_200025704644 [0,1,0,0,0,0|1,0,0]=2 414 B11R1.20 [13CH3]C(=O)Cc1ccc(cn1)Br 1458a_100020629044_200025704644 [0,1,0,0,0,0|2,0,0]=3 415 B11R1.20 [13CH3]C(=O)Cc1ccc(cn1)Cl 1458a_100000728320_200025704644 [0,1,0,0,0,0|2,0,0]=3 416 B11R1.20 [13CH3]C(=O)Cc1ccc(nc1)Br 1458a_100010067268_200025704644 [0,1,0,0,0,0|2,0,0]=3 417 B11R1.20 [13CH3]C(=O)Cc1ccc(nc1)Cl 1458a_100000061944_200025704644 [0,1,0,0,0,0|2,0,0]=3 418 B11R1.20 [13CH3]C(=O)Cn1ccc(=O)cc1 1458a_200000238563_200025704644 [0,1,0,0,0,0|2,0,0]=3 419 B11R1.36 C=C(C(=O)C)c1ccccc1 1458a_100000065200_200000210301 [0,1,0,0,0,0|1,0,1]=3 420 B11R1.36 C=C(C(=O)[13CH3])c1ccccc1 1458a_100000065200_200025704644 [0,1,0,0,0,0|1,0,1]=3 421 B11R1.36 CC(=C(C)c1ccccc1)C 271570a_200000049429_100000210277 [0,1,0,0,0,0|0,0,2]=3 422 B11R1.36 CC(=C(C)c1ccccn1)C 271570a_200000049429_100011216584 [0,1,0,0,0,0|1,0,2]=4 423 B11R1.36 CC(=C(C)c1cccnc1)C 271570a_200000049429_100000752921 [0,1,0,0,0,0|1,0,2]=4 424 B11R1.36 CC(=C(C)c1ccncc1)C 271570a_200000049429_100000035832 [0,1,0,0,0,0|1,0,2]=4 425 B11R1.36 CC(=O)C(C)c1ccccc1 1458a_100000070787_100000230085 [0,1,0,0,0,0|1,0,0]=2 426 B11R1.36 CC(=O)C(C)c1ccccn1 1458a_100000722050_200000210301 [0,1,0,0,0,0|2,0,0]=3 427 B11R1.36 CC(=O)C(C)c1cnccn1 1458a_100000070787_200000703233 [0,1,0,0,0,0|3,0,0]=4 428 B11R1.36 CC(=O)C(F)c1ccccc1 1458a_100000698975_200000210301 [0,1,0,0,0,0|1,0,0]=2 429 B11R1.36 CC(=O)N(C)c1ccccc1 11a_100000210012_100015343762 [0,1,0,0,0,0|2,0,0]=3 430 B11R1.36 CC(=O)N(C)c1ccccc1 1626a_100000210012_100015343762 [0,1,0,0,0,0|2,0,0]=3 431 B11R1.36 CC(=O)N(C)c1ccccc1 22a_100000210012_100000070787 [0,1,0,0,0,0|2,0,0]=3 432 B11R1.36 CC(=O)[C@@H](C)c1ccccc1 1458a_100000751047_200000210301 [0,1,0,0,0,0|1,0,0]=2 433 B11R1.36 CC(=O)[C@H](O)c1ccccc1 1458a_100000684486_200000210301 [0,1,0,0,0,0|1,0,0]=2 434 B11R1.36 CC(C(=O)[13CH3])c1ccccn1 1458a_100000722050_200025704644 [0,1,0,0,0,0|2,0,0]=3 435 B11R1.36 CC(C)C(=O)c1ccccc1 1458a_100000185807_100000210206 [0,1,0,0,0,0|0,0,3]=4 436 B11R1.36 CC(C)N(C)c1ccccc1 2230a_100000210012_100000210206 [0,1,0,0,0,0|1,0,2]=4 437 B11R1.36 CC(C)N(C)c1ccccc1 2230a_100000210572_200000210301 [0,1,0,0,0,0|1,0,2]=4 438 B11R1.36 CC(C)N(C)c1ccccc1 269982a_100000210012_100000210206 [0,1,0,0,0,0|1,0,2]=4 439 B11R1.36 CC(C)N(C)c1ccccc1 269982a_100000210572_200000210301 [0,1,0,0,0,0|1,0,2]=4 440 B11R1.36 CC(C)N(C)c1ccccc1 34a_100000210012_100000210206 [0,1,0,0,0,0|1,0,2]=4 441 B11R1.36 CC(C)N(C)c1ccccc1 34a_100000210572_200000210301 [0,1,0,0,0,0|1,0,2]=4 442 B11R1.36 CC(C)N(C)c1ccccc1 7a_100000210572_200000210301 [0,1,0,0,0,0|1,0,2]=4 443 B11R1.36 CC(C)N([13CH3])c1ccccc1 2230a_100000210572_200025704644 [0,1,0,0,0,0|1,0,2]=4 444 B11R1.36 CC(C)N([13CH3])c1ccccc1 269982a_100000210572_200025704644 [0,1,0,0,0,0|1,0,2]=4 445 B11R1.36 CC(C)N([13CH3])c1ccccc1 34a_100000210572_200025704644 [0,1,0,0,0,0|1,0,2]=4 446 B11R1.36 CC(C)N([13CH3])c1ccccc1 7a_100000210572_200025704644 [0,1,0,0,0,0|1,0,2]=4 447 B11R1.36 CC(c1ccccc1)N(C)C 2230a_100000195388_200000210301 [0,1,0,0,0,0|1,0,1]=3 448 B11R1.36 CC(c1ccccc1)N(C)C 2230a_100102631434_100000230085 [0,1,0,0,0,0|1,0,1]=3 449 B11R1.36 CC(c1ccccc1)N(C)C 269982a_100000195388_200000210301 [0,1,0,0,0,0|1,0,1]=3 450 B11R1.36 CC(c1ccccc1)N(C)C 269982a_100102631434_100000230085 [0,1,0,0,0,0|1,0,1]=3 451 B11R1.36 CC(c1ccccc1)N(C)[13CH3] 2230a_100000195388_200025704644 [0,1,0,0,0,0|1,0,1]=3 452 B11R1.36 CC(c1ccccc1)N(C)[13CH3] 269982a_100000195388_200025704644 [0,1,0,0,0,0|1,0,1]=3 453 B11R1.36 CC(c1ccccn1)N(C)C 2230a_100000231138_200000210301 [0,1,0,0,0,0|2,0,1]=4 454 B11R1.36 CC(c1ccccn1)N(C)C 269982a_100000231138_200000210301 [0,1,0,0,0,0|2,0,1]=4 455 B11R1.36 CC(c1ccccn1)N(C)[13CH3] 2230a_100000231138_200025704644 [0,1,0,0,0,0|2,0,1]=4 456 B11R1.36 CC(c1ccccn1)N(C)[13CH3] 269982a_100000231138_200025704644 [0,1,0,0,0,0|2,0,1]=4 457 B11R1.36 CC(c1cccnc1)N(C)C 2230a_100000232774_200000210301 [0,1,0,0,0,0|2,0,1]=4 458 B11R1.36 CC(c1cccnc1)N(C)C 269982a_100000232774_200000210301 [0,1,0,0,0,0|2,0,1]=4 459 B11R1.36 CC(c1cccnc1)N(C)[13CH3] 2230a_100000232774_200025704644 [0,1,0,0,0,0|2,0,1]=4 460 B11R1.36 CC(c1cccnc1)N(C)[13CH3] 269982a_100000232774_200025704644 [0,1,0,0,0,0|2,0,1]=4 461 B11R1.36 CC(c1ccncc1)N(C)C 2230a_100000231139_200000210301 [0,1,0,0,0,0|2,0,1]=4 462 B11R1.36 CC(c1ccncc1)N(C)C 269982a_100000231139_200000210301 [0,1,0,0,0,0|2,0,1]=4 463 B11R1.36 CC(c1ccncc1)N(C)[13CH3] 2230a_100000231139_200025704644 [0,1,0,0,0,0|2,0,1]=4 464 B11R1.36 CC(c1ccncc1)N(C)[13CH3] 269982a_100000231139_200025704644 [0,1,0,0,0,0|2,0,1]=4 465 B11R1.36 CN(C)C(=O)c1ccccc1 11a_100102631434_100000185807 [0,1,0,0,0,0|1,0,2]=4 466 B11R1.36 CN(C)C(=O)c1ccccc1 1626a_100102631434_100000185807 [0,1,0,0,0,0|1,0,2]=4 467 B11R1.36 CN(C)C(=O)c1ccccc1 240690a_100102631434_100000185807 [0,1,0,0,0,0|1,0,2]=4 468 B11R1.36 CN(C)C(=O)c1ccccc1 527a_100102631434_100000185807 [0,1,0,0,0,0|1,0,2]=4 469 B11R1.36 C[C@H](C(=O)[13CH3])c1ccccc1 1458a_100000751047_200025704644 [0,1,0,0,0,0|1,0,0]=2 470 B11R1.36 [13CH3]C(=O)C(F)c1ccccc1 1458a_100000698975_200025704644 [0,1,0,0,0,0|1,0,0]=2 471 B11R1.36 [13CH3]C(=O)[C@H](O)c1ccccc1 1458a_100000684486_200025704644 [0,1,0,0,0,0|1,0,0]=2 472 B11R1.40 C#CC(=O)Cc1ccccc1 1458a_100000211873_100015291786 [0,1,0,0,0,0|1,0,1]=3 473 B11R1.40 C#CC(=O)Cc1ccccn1 1458a_100000211873_100000721315 [0,1,0,0,0,0|2,0,1]=4 474 B11R1.40 C#CC(=O)Cc1cccnc1 1458a_100000211873_100000733263 [0,1,0,0,0,0|2,0,1]=4 475 B11R1.40 C#CC(=O)Cc1ccncc1 1458a_100000211873_100000705612 [0,1,0,0,0,0|2,0,1]=4 476 B11R1.40 C#CC(C)Nc1ccccc1 34a_100000106764_200000035995 [0,1,0,0,0,0|1,0,2]=4 477 B11R1.40 C#CC(C)Oc1ccccc1 34a_100000210340_200000035995 [0,1,0,0,0,0|1,0,2]=4 478 B11R1.40 C#CC(C)Sc1ccccc1 62a_200000035995_100000041952 [0,1,0,0,0,0|1,0,2]=4 479 B11R1.40 C=CC(=O)Cc1ccccc1 1458a_100000185746_100015291786 [0,1,0,0,0,0|1,0,0]=2 480 B11R1.40 C=CC(=O)Cc1ccccn1 1458a_100000185746_100000721315 [0,1,0,0,0,0|2,0,0]=3 481 B11R1.40 C=CC(=O)Cc1cccnc1 1458a_100000185746_100000733263 [0,1,0,0,0,0|2,0,0]=3 482 B11R1.40 C=CC(=O)Cc1cccnn1 1458a_100000185746_100016990269 [0,1,0,0,0,0|3,0,0]=4 483 B11R1.40 C=CC(=O)Cc1ccncc1 1458a_100000185746_100000705612 [0,1,0,0,0,0|2,0,0]=3 484 B11R1.40 C=CC(=O)Cc1cnccn1 1458a_100000185746_100016995436 [0,1,0,0,0,0|3,0,0]=4 485 B11R1.40 C=CC(=O)Cc1cncnc1 1458a_100000185746_100015196519 [0,1,0,0,0,0|3,0,0]=4 486 B11R1.40 C=CC(=O)Cc1ncccn1 1458a_100000185746_100000703007 [0,1,0,0,0,0|3,0,0]=4 487 B11R1.40 C=CC(=O)Nc1ccccc1 1626a_100000106764_100000185746 [0,1,0,0,0,0|2,0,0]=3 488 B11R1.40 C=CC(=O)Nc1ccccc1 22a_100000106764_100000185746 [0,1,0,0,0,0|2,0,0]=3 489 B11R1.40 C=CC(C)Sc1ccccc1 62a_100011215867_100000041952 [0,1,0,0,0,0|1,0,1]=3 490 B11R1.40 C=CC(C)Sc1ccccn1 62a_100011215867_100011216584 [0,1,0,0,0,0|2,0,1]=4 491 B11R1.40 C=CC(C)Sc1cccnc1 62a_100011215867_100000210063 [0,1,0,0,0,0|2,0,1]=4 492 B11R1.40 C=CC(C)Sc1ccncc1 62a_100011215867_100000728582 [0,1,0,0,0,0|2,0,1]=4 493 B11R1.40 CC(C#N)Oc1ccccc1 7a_100000210340_100000703298 [0,1,0,0,0,0|1,0,2]=4 494 B11R1.40 CC(C#N)Sc1ccccc1 62a_100000703298_100000041952 [0,1,0,0,0,0|1,0,2]=4 495 B11R1.40 CC(C#N)Sc1ccccc1 62a_100000719477_100000703298 [0,1,0,0,0,0|1,0,2]=4 496 B11R1.40 CC(CO)Nc1ccccc1 34a_100000106764_100012180447 [0,1,0,0,0,0|1,0,2]=4 497 B11R1.40 CC(CO)Oc1ccccc1 34a_100000210340_100012180447 [0,1,0,0,0,0|1,0,2]=4 498 B11R1.40 CC(CO)Oc1ccccc1 7a_100000210340_100012180447 [0,1,0,0,0,0|1,0,2]=4 499 B11R1.40 CC(CO)Sc1ccccc1 62a_100012180447_100000041952 [0,1,0,0,0,0|1,0,2]=4 500 B11R1.40 CC(Cc1ccccc1)O[13CH3] 34a_100000748627_200025704644 [0,1,0,0,0,0|0,0,2]=3 501 B11R1.40 CC(Cc1ccccc1)O[13CH3] 7a_100000748627_200025704644 [0,1,0,0,0,0|0,0,2]=3 502 B11R1.40 CC(Cc1ccccc1)S[13CH3] 62a_200011218536_200025704644 [0,1,0,0,0,0|0,0,2]=3 503 B11R1.40 CC(Cc1ccccc1)S[13CH3] 62a_200025704644_200011218536 [0,1,0,0,0,0|0,0,2]=3 504 B11R1.40 CC(Cc1ccccn1)N[13CH3] 2230a_100000238496_200025704644 [0,1,0,0,0,0|1,0,2]=4 505 B11R1.40 CC(Cc1cccnc1)N[13CH3] 2230a_100011207255_200025704644 [0,1,0,0,0,0|1,0,2]=4 506 B11R1.40 CCC(=O)C[n+]1ccccc1 1458a_200000086051_100000210202 [0,1,0,0,0,0|2,0,0]=3 507 B11R1.40 CCC(=O)Cc1ccccc1 1458a_100000210414_100015291786 [0,1,0,0,0,0|1,0,0]=2 508 B11R1.40 CCC(=O)Cc1ccccn1 1458a_100000210414_100000721315 [0,1,0,0,0,0|2,0,0]=3 509 B11R1.40 CCC(=O)Cc1ccccn1 1458a_100000233486_100000210202 [0,1,0,0,0,0|2,0,0]=3 510 B11R1.40 CCC(=O)Cc1cccnc1 1458a_100000210414_100000733263 [0,1,0,0,0,0|2,0,0]=3 511 B11R1.40 CCC(=O)Cc1cccnc1 1458a_100000737805_100000210202 [0,1,0,0,0,0|2,0,0]=3 512 B11R1.40 CCC(=O)Cc1cccnn1 1458a_100000210414_100016990269 [0,1,0,0,0,0|3,0,0]=4 513 B11R1.40 CCC(=O)Cc1ccncc1 1458a_100000210414_100000705612 [0,1,0,0,0,0|2,0,0]=3 514 B11R1.40 CCC(=O)Cc1cnccn1 1458a_100000210414_100016995436 [0,1,0,0,0,0|3,0,0]=4 515 B11R1.40 CCC(=O)Cc1cncnc1 1458a_100000210414_100015196519 [0,1,0,0,0,0|3,0,0]=4 516 B11R1.40 CCC(=O)Cc1cncnc1 1458a_100000721575_100000210202 [0,1,0,0,0,0|3,0,0]=4 517 B11R1.40 CCC(=O)Cc1ncccn1 1458a_100000210414_100000703007 [0,1,0,0,0,0|3,0,0]=4 518 B11R1.40 CCC(=O)Nc1ccccc1 11a_100000106764_100000210414 [0,1,0,0,0,0|2,0,0]=3 519 B11R1.40 CCC(=O)Nc1ccccc1 1626a_100000106764_100000210414 [0,1,0,0,0,0|2,0,0]=3 520 B11R1.40 CCC(=O)Nc1ccccc1 22a_100000106764_100000210414 [0,1,0,0,0,0|2,0,0]=3 521 B11R1.40 CCC(=O)Nc1ccccc1 527a_100000106764_100000210414 [0,1,0,0,0,0|2,0,0]=3 522 B11R1.40 CCC(C)Nc1ccccc1 34a_100000106764_100011215416 [0,1,0,0,0,0|1,0,2]=4 523 B11R1.40 CCC(C)Oc1ccccc1 34a_100000210340_100011215416 [0,1,0,0,0,0|1,0,2]=4 524 B11R1.40 CCC(C)Oc1ccccc1 7a_100000210340_100000758301 [0,1,0,0,0,0|1,0,2]=4 525 B11R1.40 CCC(C)Sc1ccccc1 62a_100000719477_100000758301 [0,1,0,0,0,0|1,0,2]=4 526 B11R1.40 CCC(C)Sc1ccccc1 62a_100000758301_100000041952 [0,1,0,0,0,0|1,0,2]=4 527 B11R1.40 CCN(C)Cc1ccccc1 2230a_100000186898_100000210202 [0,1,0,0,0,0|1,0,1]=3 528 B11R1.40 CCN(C)Cc1ccccc1 2230a_100000186914_200000210301 [0,1,0,0,0,0|1,0,1]=3 529 B11R1.40 CCN(C)Cc1ccccc1 2230a_100000225621_100015291786 [0,1,0,0,0,0|1,0,1]=3 530 B11R1.40 CCN(C)Cc1ccccc1 269982a_100000186898_100000204670 [0,1,0,0,0,0|1,0,1]=3 531 B11R1.40 CCN(C)Cc1ccccc1 269982a_100000186914_200000210301 [0,1,0,0,0,0|1,0,1]=3 532 B11R1.40 CCN(C)Cc1ccccc1 269982a_100000225621_100000211182 [0,1,0,0,0,0|1,0,1]=3 533 B11R1.40 CCN(C)Cc1ccccn1 2230a_100000201164_200000210301 [0,1,0,0,0,0|2,0,1]=4 534 B11R1.40 CCN(C)Cc1ccccn1 2230a_100000207498_100000210202 [0,1,0,0,0,0|2,0,1]=4 535 B11R1.40 CCN(C)Cc1ccccn1 2230a_100000225621_100000721315 [0,1,0,0,0,0|2,0,1]=4 536 B11R1.40 CCN(C)Cc1ccccn1 269982a_100000201164_200000210301 [0,1,0,0,0,0|2,0,1]=4 537 B11R1.40 CCN(C)Cc1ccccn1 269982a_100000207498_100000204670 [0,1,0,0,0,0|2,0,1]=4 538 B11R1.40 CCN(C)Cc1ccccn1 269982a_100000225621_100000721315 [0,1,0,0,0,0|2,0,1]=4 539 B11R1.40 CCN(C)Cc1cccnc1 2230a_100000184577_100000210202 [0,1,0,0,0,0|2,0,1]=4 540 B11R1.40 CCN(C)Cc1cccnc1 2230a_100000186920_200000210301 [0,1,0,0,0,0|2,0,1]=4 541 B11R1.40 CCN(C)Cc1cccnc1 2230a_100000225621_100000741622 [0,1,0,0,0,0|2,0,1]=4 542 B11R1.40 CCN(C)Cc1cccnc1 269982a_100000184577_100000204670 [0,1,0,0,0,0|2,0,1]=4 543 B11R1.40 CCN(C)Cc1cccnc1 269982a_100000186920_200000210301 [0,1,0,0,0,0|2,0,1]=4 544 B11R1.40 CCN(C)Cc1cccnc1 269982a_100000225621_100000733263 [0,1,0,0,0,0|2,0,1]=4 545 B11R1.40 CCN(C)Cc1ccncc1 2230a_100000186919_200000210301 [0,1,0,0,0,0|2,0,1]=4 546 B11R1.40 CCN(C)Cc1ccncc1 2230a_100000187231_100000210202 [0,1,0,0,0,0|2,0,1]=4 547 B11R1.40 CCN(C)Cc1ccncc1 2230a_100000225621_100015193705 [0,1,0,0,0,0|2,0,1]=4 548 B11R1.40 CCN(C)Cc1ccncc1 269982a_100000186919_200000210301 [0,1,0,0,0,0|2,0,1]=4 549 B11R1.40 CCN(C)Cc1ccncc1 269982a_100000187231_100000204670 [0,1,0,0,0,0|2,0,1]=4 550 B11R1.40 CCN(C)Cc1ccncc1 269982a_100000225621_100015193705 [0,1,0,0,0,0|2,0,1]=4 551 B11R1.40 CCN([13CH3])Cc1ccccc1 2230a_100000186914_200025704644 [0,1,0,0,0,0|1,0,1]=3 552 B11R1.40 CCN([13CH3])Cc1ccccc1 269982a_100000186914_200025704644 [0,1,0,0,0,0|1,0,1]=3 553 B11R1.40 CCN([13CH3])Cc1ccccn1 2230a_100000201164_200025704644 [0,1,0,0,0,0|2,0,1]=4 554 B11R1.40 CCN([13CH3])Cc1ccccn1 269982a_100000201164_200025704644 [0,1,0,0,0,0|2,0,1]=4 555 B11R1.40 CCN([13CH3])Cc1cccnc1 2230a_100000186920_200025704644 [0,1,0,0,0,0|2,0,1]=4 556 B11R1.40 CCN([13CH3])Cc1cccnc1 269982a_100000186920_200025704644 [0,1,0,0,0,0|2,0,1]=4 557 B11R1.40 CCN([13CH3])Cc1ccncc1 2230a_100000186919_200025704644 [0,1,0,0,0,0|2,0,1]=4 558 B11R1.40 CCN([13CH3])Cc1ccncc1 269982a_100000186919_200025704644 [0,1,0,0,0,0|2,0,1]=4 559 B11R1.40 CN(CF)Cc1ccccc1 269982a_100000186898_100015361967 [0,1,0,0,0,0|1,0,1]=3 560 B11R1.40 CN(CF)Cc1ccccn1 269982a_100000207498_100015361967 [0,1,0,0,0,0|2,0,1]=4 561 B11R1.40 CN(CF)Cc1cccnc1 269982a_100000184577_100015361967 [0,1,0,0,0,0|2,0,1]=4 562 B11R1.40 CN(CF)Cc1ccncc1 269982a_100000187231_100015361967 [0,1,0,0,0,0|2,0,1]=4 563 B11R1.40 CNC(=O)C[n+]1ccccc1 11a_106832991635_200000086051 [0,1,0,0,0,0|2,0,0]=3 564 B11R1.40 CNC(=O)C[n+]1ccccc1 240690a_100102657272_200000086051 [0,1,0,0,0,0|2,0,0]=3 565 B11R1.40 CNC(=O)C[n+]1ccccc1 527a_100102657272_200000086051 [0,1,0,0,0,0|2,0,0]=3 566 B11R1.40 CNC(=O)Cc1ccccn1 11a_106832991635_100000233486 [0,1,0,0,0,0|2,0,0]=3 567 B11R1.40 CNC(=O)Cc1cccnc1 11a_106832991635_100000737805 [0,1,0,0,0,0|2,0,0]=3 568 B11R1.40 CNC(=O)Cc1cccnc1 240690a_100102657272_100000737805 [0,1,0,0,0,0|2,0,0]=3 569 B11R1.40 CNC(=O)Cc1cccnc1 527a_100102657272_100000737805 [0,1,0,0,0,0|2,0,0]=3 570 B11R1.40 CNC(=O)Cc1ccncc1 11a_106832991635_100011201483 [0,1,0,0,0,0|2,0,0]=3 571 B11R1.40 CNC(=O)Cc1ccncc1 240690a_100102657272_100011201483 [0,1,0,0,0,0|2,0,0]=3 572 B11R1.40 CNC(=O)Cc1cnccn1 11a_106832991635_100000726051 [0,1,0,0,0,0|3,0,0]=4 573 B11R1.40 CNC(=O)Cc1cnccn1 240690a_100102657272_100000726051 [0,1,0,0,0,0|3,0,0]=4 574 B11R1.40 CNC(=O)Cc1cnccn1 527a_100102657272_100000726051 [0,1,0,0,0,0|3,0,0]=4 575 B11R1.40 CNC(=O)Cc1cncnc1 11a_106832991635_100000721575 [0,1,0,0,0,0|3,0,0]=4 576 B11R1.40 CNC(=O)Cc1cncnc1 240690a_100102657272_100000721575 [0,1,0,0,0,0|3,0,0]=4 577 B11R1.40 CNC(=O)Cc1cncnc1 527a_100102657272_100000721575 [0,1,0,0,0,0|3,0,0]=4 578 B11R1.40 CNC(=O)Nc1ccccc1 2430a_100000106764_100102657272 [0,1,0,0,0,0|2,0,0]=3 579 B11R1.40 CNC(C)C[n+]1ccccc1 270004a_106832991635_100000034229 [0,1,0,0,0,0|1,0,2]=4 580 B11R1.40 CNC(C)Cc1ccccc1 34a_100102657272_200011218536 [0,1,0,0,0,0|0,0,2]=3 581 B11R1.40 CNC(C)Cc1ccccc1 7a_106832991635_200011218536 [0,1,0,0,0,0|0,0,2]=3 582 B11R1.40 CNC(C)Cc1ccccn1 2230a_100000238496_200000210301 [0,1,0,0,0,0|1,0,2]=4 583 B11R1.40 CNC(C)Cc1cccnc1 2230a_100011207255_200000210301 [0,1,0,0,0,0|1,0,2]=4 584 B11R1.40 CNC(C)Cc1cccnc1 270004a_106832991635_100015187140 [0,1,0,0,0,0|1,0,2]=4 585 B11R1.40 CNC(C)Cc1ccncc1 270004a_106832991635_100000238508 [0,1,0,0,0,0|1,0,2]=4 586 B11R1.40 COC(C)Cc1ccccc1 34a_100000748627_200000210301 [0,1,0,0,0,0|0,0,2]=3 587 B11R1.40 COC(C)Cc1ccccc1 34a_100138415774_200011218536 [0,1,0,0,0,0|0,0,2]=3 588 B11R1.40 COC(C)Cc1ccccc1 7a_100000748627_200000210301 [0,1,0,0,0,0|0,0,2]=3 589 B11R1.40 COC(C)Sc1ccccc1 62a_100000719477_100009879195 [0,1,0,0,0,0|1,0,2]=4 590 B11R1.40 COC(C)Sc1ccccc1 62a_100009879195_100000041952 [0,1,0,0,0,0|1,0,2]=4 591 B11R1.40 CSC(C)Cc1ccccc1 62a_200000210301_200011218536 [0,1,0,0,0,0|0,0,2]=3 592 B11R1.40 CSC(C)Cc1ccccc1 62a_200011218536_200000210301 [0,1,0,0,0,0|0,0,2]=3 593 B11R1.40 C[C@H](CO)Sc1ccccc1 62a_100000719477_100016084084 [0,1,0,0,0,0|1,0,2]=4 594 B11R1.40 C[C@H](CO)Sc1ccccc1 62a_100016084084_100000041952 [0,1,0,0,0,0|1,0,2]=4 595 B11R1.40 O=C(CF)C[n+]1ccccc1 1458a_200000086051_100015361967 [0,1,0,0,0,0|2,0,0]=3 596 B11R1.40 O=C(CF)Cc1ccccn1 1458a_100000233486_100015361967 [0,1,0,0,0,0|2,0,0]=3 597 B11R1.40 O=C(CF)Cc1cccnc1 1458a_100000737805_100015361967 [0,1,0,0,0,0|2,0,0]=3 598 B11R1.40 O=C(CF)Cc1cncnc1 1458a_100000721575_100015361967 [0,1,0,0,0,0|3,0,0]=4 599 B11R1.40 O=C(CO)Cc1ccccc1 1458a_100000210174_100015291786 [0,1,0,0,0,0|1,0,0]=2 600 B11R1.40 O=C(CO)Cc1ccccn1 1458a_100000210174_100000721315 [0,1,0,0,0,0|2,0,0]=3 601 B11R1.40 O=C(CO)Cc1cccnc1 1458a_100000210174_100000733263 [0,1,0,0,0,0|2,0,0]=3 602 B11R1.40 O=C(CO)Cc1cccnn1 1458a_100000210174_100016990269 [0,1,0,0,0,0|3,0,0]=4 603 B11R1.40 O=C(CO)Cc1ccncc1 1458a_100000210174_100000705612 [0,1,0,0,0,0|2,0,0]=3 604 B11R1.40 O=C(CO)Cc1cnccn1 1458a_100000210174_100016995436 [0,1,0,0,0,0|3,0,0]=4 605 B11R1.40 O=C(CO)Cc1cncnc1 1458a_100000210174_100015196519 [0,1,0,0,0,0|3,0,0]=4 606 B11R1.40 O=C(CO)Cc1ncccn1 1458a_100000210174_100000703007 [0,1,0,0,0,0|3,0,0]=4 607 B11R1.40 O=C(CO)Nc1ccccc1 22a_100000106764_100000210174 [0,1,0,0,0,0|2,0,0]=3 608 B11R1.40 O=C(CO)Nc1ccccc1 527a_100000106764_100000210174 [0,1,0,0,0,0|2,0,0]=3 609 B11R1.86 CC(=Cc1c[nH]ccc1=O)C 271570a_100102525489_100009998708 [0,1,0,0,0,0|1,0,2]=4 610 B11R1.86 CC(=Cc1c[nH]ccc1=S)C 271570a_100102525489_200012280681 [0,1,0,0,0,0|1,0,2]=4 611 B11R1.86 CC(=Cc1ccc[nH]c1=O)C 271570a_100102525489_100000050042 [0,1,0,0,0,0|1,0,2]=4 612 B11R1.86 CC(=Cc1cccc[n+]1C)C 271570a_100102525489_100000212160 [0,1,0,0,0,0|1,0,2]=4 613 B11R1.86 CC(=Cc1cccc[n+]1[O-])C 271570a_100102525489_200000042595 [0,1,0,0,0,0|1,0,2]=4 614 B11R1.86 CC(=Cc1ccccc1Br)C 271570a_100102525489_100000695589 [0,1,0,0,0,0|0,0,2]=3 615 B11R1.86 CC(=Cc1ccccc1C)C 271570a_100102525489_100000210755 [0,1,0,0,0,0|0,0,2]=3 616 B11R1.86 CC(=Cc1ccccc1Cl)C 271570a_100102525489_100000764095 [0,1,0,0,0,0|0,0,2]=3 617 B11R1.86 CC(=Cc1ccccc1F)C 271570a_100102525489_100011215700 [0,1,0,0,0,0|0,0,2]=3 618 B11R1.86 CC(=Cc1ccccc1N)C 271570a_100102525489_100000210017 [0,1,0,0,0,0|0,0,2]=3 619 B11R1.86 CC(=Cc1ccccc1O)C 271570a_100102525489_100000739446 [0,1,0,0,0,0|0,0,2]=3 620 B11R1.86 CC(=Cc1cccnc1Br)C 271570a_100102525489_100010202626 [0,1,0,0,0,0|1,0,2]=4 621 B11R1.86 CC(=Cc1cccnc1C)C 271570a_100102525489_100000751574 [0,1,0,0,0,0|1,0,2]=4 622 B11R1.86 CC(=Cc1cccnc1Cl)C 271570a_100102525489_100000036424 [0,1,0,0,0,0|1,0,2]=4 623 B11R1.86 CC(=Cc1cccnc1F)C 271570a_100102525489_100009816115 [0,1,0,0,0,0|1,0,2]=4 624 B11R1.86 CC(=Cc1cccnc1N)C 271570a_100102525489_100000045569 [0,1,0,0,0,0|1,0,2]=4 625 B11R1.86 CC(=Cc1ccncc1Br)C 271570a_100102525489_100000726257 [0,1,0,0,0,0|1,0,2]=4 626 B11R1.86 CC(=Cc1ccncc1C)C 271570a_100102525489_100015191297 [0,1,0,0,0,0|1,0,2]=4 627 B11R1.86 CC(=Cc1ccncc1Cl)C 271570a_100102525489_100000708259 [0,1,0,0,0,0|1,0,2]=4 628 B11R1.86 CC(=Cc1ccncc1F)C 271570a_100102525489_100000047030 [0,1,0,0,0,0|1,0,2]=4 629 B11R1.86 CC(=Cc1ccncc1N)C 271570a_100102525489_100009815883 [0,1,0,0,0,0|1,0,2]=4 630 B11R1.86 CC(=Cc1ccncc1O)C 271570a_100102525489_100009817591 [0,1,0,0,0,0|1,0,2]=4 631 B11R1.86 CC(=Cc1cnccc1Br)C 271570a_100102525489_100010138639 [0,1,0,0,0,0|1,0,2]=4 632 B11R1.86 CC(=Cc1cnccc1C)C 271570a_100102525489_100000761580 [0,1,0,0,0,0|1,0,2]=4 633 B11R1.86 CC(=Cc1cnccc1Cl)C 271570a_100102525489_100009995489 [0,1,0,0,0,0|1,0,2]=4 634 B11R1.86 CC(=Cc1cnccc1F)C 271570a_100102525489_100009820683 [0,1,0,0,0,0|1,0,2]=4 635 B11R1.86 CC(=Cc1cnccc1N)C 271570a_100102525489_100000047001 [0,1,0,0,0,0|1,0,2]=4 636 B11R1.86 CC(=Cc1ncccc1Br)C 271570a_100102525489_100000696092 [0,1,0,0,0,0|1,0,2]=4 637 B11R1.86 CC(=Cc1ncccc1C)C 271570a_100102525489_100000751373 [0,1,0,0,0,0|1,0,2]=4 638 B11R1.86 CC(=Cc1ncccc1Cl)C 271570a_100102525489_100011356963 [0,1,0,0,0,0|1,0,2]=4 639 B11R1.86 CC(=Cc1ncccc1F)C 271570a_100102525489_100000685392 [0,1,0,0,0,0|1,0,2]=4 640 B11R1.86 CC(=Cc1ncccc1N)C 271570a_100102525489_100000688686 [0,1,0,0,0,0|1,0,2]=4 641 B11R1.86 CC(=Cc1ncccc1O)C 271570a_100102525489_100000034122 [0,1,0,0,0,0|1,0,2]=4 642 B11R1.86 CC(=O)Cc1ccccc1Br 1458a_100000070787_100000184730 [0,1,0,0,0,0|1,0,0]=2 643 B11R1.86 CC(=O)Cc1ccccc1Br 1458a_100000751119_200000210301 [0,1,0,0,0,0|1,0,0]=2 644 B11R1.86 CC(=O)Cc1ccccc1C 1458a_100000070787_100000211839 [0,1,0,0,0,0|1,0,0]=2 645 B11R1.86 CC(=O)Cc1ccccc1C 1458a_100000212180_200000210301 [0,1,0,0,0,0|1,0,0]=2 646 B11R1.86 CC(=O)Cc1ccccc1Cl 1458a_100000070787_100000187162 [0,1,0,0,0,0|1,0,0]=2 647 B11R1.86 CC(=O)Cc1ccccc1Cl 1458a_100000183793_200000210301 [0,1,0,0,0,0|1,0,0]=2 648 B11R1.86 CC(=O)Cc1ccccc1F 1458a_100000070787_100000187165 [0,1,0,0,0,0|1,0,0]=2 649 B11R1.86 CC(=O)Cc1ccccc1F 1458a_100000212012_200000210301 [0,1,0,0,0,0|1,0,0]=2 650 B11R1.86 CC(=O)Cc1ccccc1I 1458a_100000036491_200000210301 [0,1,0,0,0,0|1,0,0]=2 651 B11R1.86 CC(=O)Cc1ccccc1I 1458a_100000070787_100011216222 [0,1,0,0,0,0|1,0,0]=2 652 B11R1.86 CC(=O)Cc1ccccc1O 1458a_100000743006_200000210301 [0,1,0,0,0,0|1,0,0]=2 653 B11R1.86 CC(=O)Cc1ccccc1O 271570a_203496583355_100011350739 [0,1,0,0,0,0|1,0,0]=2 654 B11R1.86 CC(=O)Cc1cccnc1Br 1458a_100000070787_100010140945 [0,1,0,0,0,0|2,0,0]=3 655 B11R1.86 CC(=O)Cc1cccnc1C 1458a_100000070787_100000732876 [0,1,0,0,0,0|2,0,0]=3 656 B11R1.86 CC(=O)Cc1cccnc1Cl 1458a_100000070787_100000045678 [0,1,0,0,0,0|2,0,0]=3 657 B11R1.86 CC(=O)Cc1cccnc1Cl 1458a_100000093521_200000210301 [0,1,0,0,0,0|2,0,0]=3 658 B11R1.86 CC(=O)Cc1cccnc1F 1458a_100000070787_100000099810 [0,1,0,0,0,0|2,0,0]=3 659 B11R1.86 CC(=O)Cc1ccncc1C 1458a_100000070787_100020672808 [0,1,0,0,0,0|2,0,0]=3 660 B11R1.86 CC(=O)Cc1ccncc1Cl 1458a_100000070787_100000763264 [0,1,0,0,0,0|2,0,0]=3 661 B11R1.86 CC(=O)Cc1cnccc1C 1458a_100000070787_100000690890 [0,1,0,0,0,0|2,0,0]=3 662 B11R1.86 CC(=O)Cc1ncccc1Br 1458a_100000070787_100025702911 [0,1,0,0,0,0|2,0,0]=3 663 B11R1.86 CC(=O)Cc1ncccc1Br 1458a_200012357574_200000210301 [0,1,0,0,0,0|2,0,0]=3 664 B11R1.86 CC(=O)Cc1ncccc1C 1458a_100000070787_100000696600 [0,1,0,0,0,0|2,0,0]=3 665 B11R1.86 CC(=O)Cc1ncccc1C 1458a_200000722269_200000210301 [0,1,0,0,0,0|2,0,0]=3 666 B11R1.86 CC(=O)Cc1ncccc1Cl 1458a_100000070787_100000099807 [0,1,0,0,0,0|2,0,0]=3 667 B11R1.86 CC(=O)Cc1ncccc1Cl 1458a_100011998755_200000210301 [0,1,0,0,0,0|2,0,0]=3 668 B11R1.86 CC(=O)Cc1ncccc1F 1458a_100000070787_100000104219 [0,1,0,0,0,0|2,0,0]=3 669 B11R1.86 CC(=O)Cc1ncccc1O 1458a_100000070787_200020655725 [0,1,0,0,0,0|2,0,0]=3 670 B11R1.86 CC(=O)Cn1ccccc1=O 1458a_100000189665_200000210301 [0,1,0,0,0,0|2,0,0]=3 671 B11R1.86 CC(=O)Cn1cccnc1=O 1458a_100000738077_200000210301 [0,1,0,0,0,0|3,0,0]=4 672 B11R1.86 CC(=O)Cn1ncccc1=O 1458a_100000238584_200000210301 [0,1,0,0,0,0|3,0,0]=4 673 B11R1.86 CC(=O)Nc1ccccc1Br 11a_100000210017_100015343762 [0,1,0,0,0,0|2,0,0]=3 674 B11R1.86 CC(=O)Nc1ccccc1Br 1626a_100000210017_100015343762 [0,1,0,0,0,0|2,0,0]=3 675 B11R1.86 CC(=O)Nc1ccccc1C 11a_100015192222_100015343762 [0,1,0,0,0,0|2,0,0]=3 676 B11R1.86 CC(=O)Nc1ccccc1C 1626a_100015192222_100015343762 [0,1,0,0,0,0|2,0,0]=3 677 B11R1.86 CC(=O)Nc1ccccc1C 22a_100015192222_100000070787 [0,1,0,0,0,0|2,0,0]=3 678 B11R1.86 CC(=O)Nc1ccccc1C 527a_100015192222_100103153847 [0,1,0,0,0,0|2,0,0]=3 679 B11R1.86 CC(=O)Nc1ccccc1Cl 11a_100000185783_100015343762 [0,1,0,0,0,0|2,0,0]=3 680 B11R1.86 CC(=O)Nc1ccccc1Cl 1626a_100000185783_100015343762 [0,1,0,0,0,0|2,0,0]=3 681 B11R1.86 CC(=O)Nc1ccccc1Cl 22a_100000185783_100000070787 [0,1,0,0,0,0|2,0,0]=3 682 B11R1.86 CC(=O)Nc1ccccc1Cl 527a_100000185783_100103153847 [0,1,0,0,0,0|2,0,0]=3 683 B11R1.86 CC(=O)Nc1ccccc1F 11a_100000210422_100015343762 [0,1,0,0,0,0|2,0,0]=3 684 B11R1.86 CC(=O)Nc1ccccc1F 1626a_100000210422_100015343762 [0,1,0,0,0,0|2,0,0]=3 685 B11R1.86 CC(=O)Nc1ccccc1F 22a_100000210422_100000070787 [0,1,0,0,0,0|2,0,0]=3 686 B11R1.86 CC(=O)Nc1ccccc1F 527a_100000210422_100103153847 [0,1,0,0,0,0|2,0,0]=3 687 B11R1.86 CC(=O)Nc1ccccc1I 11a_100000210053_100015343762 [0,1,0,0,0,0|2,0,0]=3 688 B11R1.86 CC(=O)Nc1ccccc1I 1626a_100000210053_100015343762 [0,1,0,0,0,0|2,0,0]=3 689 B11R1.86 CC(=O)Nc1ccccc1O 22a_100000185747_100000070787 [0,1,0,0,0,0|2,0,0]=3 690 B11R1.86 CC(=O)Nc1ccccc1O 271570a_203496583355_100000153524 [0,1,0,0,0,0|2,0,0]=3 691 B11R1.86 CC(=O)Nc1ccccc1O 527a_100000185747_100103153847 [0,1,0,0,0,0|2,0,0]=3 692 B11R1.86 CC(=O)Nc1ccncc1O 271570a_203496583355_100016132053 [0,1,0,0,0,0|3,0,0]=4 693 B11R1.86 CC(=O)Oc1ccccc1O 271570a_203496583355_100000051690 [0,1,0,0,0,0|2,0,0]=3 694 B11R1.86 CC(=O)Oc1cccnc1O 271570a_203496583355_200009815371 [0,1,0,0,0,0|3,0,0]=4 695 B11R1.86 CC(C)Nc1ccccc1Br 34a_100000210017_100000210206 [0,1,0,0,0,0|1,0,2]=4 696 B11R1.86 CC(C)Nc1ccccc1Cl 34a_100000185783_100000210206 [0,1,0,0,0,0|1,0,2]=4 697 B11R1.86 CC(C)Nc1ccccc1F 34a_100000210422_100000210206 [0,1,0,0,0,0|1,0,2]=4 698 B11R1.86 CC(C)Nc1ccccc1I 34a_100000210053_100000210206 [0,1,0,0,0,0|1,0,2]=4 699 B11R1.86 CC(C)Nc1ccccc1O 271570a_203496583355_100000219599 [0,1,0,0,0,0|1,0,2]=4 700 B11R1.86 CC(C)Nc1ccccc1O 34a_100000185747_100000210206 [0,1,0,0,0,0|1,0,2]=4 701 B11R1.86 CC(C)Oc1ccccc1Br 34a_100000181306_100000210206 [0,1,0,0,0,0|1,0,2]=4 702 B11R1.86 CC(C)Oc1ccccc1Br 7a_100000181306_100000210206 [0,1,0,0,0,0|1,0,2]=4 703 B11R1.86 CC(C)Oc1ccccc1Cl 34a_100000210172_100000210206 [0,1,0,0,0,0|1,0,2]=4 704 B11R1.86 CC(C)Oc1ccccc1Cl 7a_100000210172_100000210206 [0,1,0,0,0,0|1,0,2]=4 705 B11R1.86 CC(C)Oc1ccccc1F 34a_100000210171_100000210206 [0,1,0,0,0,0|1,0,2]=4 706 B11R1.86 CC(C)Oc1ccccc1F 7a_100000210171_100000210206 [0,1,0,0,0,0|1,0,2]=4 707 B11R1.86 CC(C)Oc1ccccc1I 34a_100000739446_100000210206 [0,1,0,0,0,0|1,0,2]=4 708 B11R1.86 CC(C)Oc1ccccc1I 7a_100000739446_100000210206 [0,1,0,0,0,0|1,0,2]=4 709 B11R1.86 CC(C)Oc1ccccc1N 34a_100000185747_100000210206 [0,1,0,0,0,0|1,0,2]=4 710 B11R1.86 CC(C)Oc1ccccc1N 7a_100000185747_100000210206 [0,1,0,0,0,0|1,0,2]=4 711 B11R1.86 CC(C)Oc1ccccc1O 271570a_203496583355_100000173919 [0,1,0,0,0,0|1,0,2]=4 712 B11R1.86 CC(C)Sc1ccccc1Br 62a_100000210206_100000695589 [0,1,0,0,0,0|1,0,2]=4 713 B11R1.86 CC(C)Sc1ccccc1Br 62a_100000695589_100000210206 [0,1,0,0,0,0|1,0,2]=4 714 B11R1.86 CC(C)Sc1ccccc1Cl 62a_100000210206_100000764095 [0,1,0,0,0,0|1,0,2]=4 715 B11R1.86 CC(C)Sc1ccccc1Cl 62a_100000764095_100000210206 [0,1,0,0,0,0|1,0,2]=4 716 B11R1.86 CC(C)Sc1ccccc1F 62a_100000210206_100011215700 [0,1,0,0,0,0|1,0,2]=4 717 B11R1.86 CC(C)Sc1ccccc1F 62a_100011215700_100000210206 [0,1,0,0,0,0|1,0,2]=4 718 B11R1.86 CC(C)Sc1ccccc1N 62a_100000210017_100000210206 [0,1,0,0,0,0|1,0,2]=4 719 B11R1.86 CC(C)Sc1ccccc1N 62a_100000210206_100000210017 [0,1,0,0,0,0|1,0,2]=4 720 B11R1.86 CC(C)Sc1ccccc1O 62a_100000210206_100000739446 [0,1,0,0,0,0|1,0,2]=4 721 B11R1.86 CC(C)Sc1ccccc1O 62a_100000739446_100000210206 [0,1,0,0,0,0|1,0,2]=4 722 B11R1.86 CN(C)Cc1ccccc1Br 2230a_100000184654_200000210301 [0,1,0,0,0,0|1,0,1]=3 723 B11R1.86 CN(C)Cc1ccccc1Br 2230a_100102631434_100000184730 [0,1,0,0,0,0|1,0,1]=3 724 B11R1.86 CN(C)Cc1ccccc1Br 269982a_100000184654_200000210301 [0,1,0,0,0,0|1,0,1]=3 725 B11R1.86 CN(C)Cc1ccccc1Br 269982a_100102631434_100000184730 [0,1,0,0,0,0|1,0,1]=3 726 B11R1.86 CN(C)Cc1ccccc1Br 270004a_100102631434_100000211189 [0,1,0,0,0,0|1,0,1]=3 727 B11R1.86 CN(C)Cc1ccccc1Cl 2230a_100000184507_200000210301 [0,1,0,0,0,0|1,0,1]=3 728 B11R1.86 CN(C)Cc1ccccc1Cl 2230a_100102631434_100000187162 [0,1,0,0,0,0|1,0,1]=3 729 B11R1.86 CN(C)Cc1ccccc1Cl 269982a_100000184507_200000210301 [0,1,0,0,0,0|1,0,1]=3 730 B11R1.86 CN(C)Cc1ccccc1Cl 269982a_100102631434_100000187162 [0,1,0,0,0,0|1,0,1]=3 731 B11R1.86 CN(C)Cc1ccccc1Cl 270004a_100102631434_100000210073 [0,1,0,0,0,0|1,0,1]=3 732 B11R1.86 CN(C)Cc1ccccc1F 2230a_100000742528_200000210301 [0,1,0,0,0,0|1,0,1]=3 733 B11R1.86 CN(C)Cc1ccccc1F 2230a_100102631434_100000211605 [0,1,0,0,0,0|1,0,1]=3 734 B11R1.86 CN(C)Cc1ccccc1F 269982a_100000742528_200000210301 [0,1,0,0,0,0|1,0,1]=3 735 B11R1.86 CN(C)Cc1ccccc1F 269982a_100102631434_100000211605 [0,1,0,0,0,0|1,0,1]=3 736 B11R1.86 CN(C)Cc1ccccc1F 270004a_100102631434_100000210811 [0,1,0,0,0,0|1,0,1]=3 737 B11R1.86 CN(C)Cc1ccccc1F 34a_100000742528_200000210301 [0,1,0,0,0,0|1,0,1]=3 738 B11R1.86 CN(C)Cc1ccccc1I 2230a_100102631434_100011215278 [0,1,0,0,0,0|1,0,1]=3 739 B11R1.86 CN(C)Cc1ccccc1I 269982a_100102631434_100011215278 [0,1,0,0,0,0|1,0,1]=3 740 B11R1.86 CN(C)Cc1ccccc1I 270004a_100102631434_100000010305 [0,1,0,0,0,0|1,0,1]=3 741 B11R1.86 CN(C)Cc1ccccc1O 2230a_100015189988_200000210301 [0,1,0,0,0,0|1,0,1]=3 742 B11R1.86 CN(C)Cc1ccccc1O 269982a_100015189988_200000210301 [0,1,0,0,0,0|1,0,1]=3 743 B11R1.86 CN(C)Cc1ccccc1O 271570a_203496583355_100000174758 [0,1,0,0,0,0|1,0,1]=3 744 B11R1.86 CN(C)Cc1cccnc1Br 2230a_100102631434_100010140945 [0,1,0,0,0,0|2,0,1]=4 745 B11R1.86 CN(C)Cc1cccnc1Br 269982a_100102631434_100010140945 [0,1,0,0,0,0|2,0,1]=4 746 B11R1.86 CN(C)Cc1cccnc1Cl 2230a_100102631434_100000045678 [0,1,0,0,0,0|2,0,1]=4 747 B11R1.86 CN(C)Cc1cccnc1Cl 2230a_103496529121_200000210301 [0,1,0,0,0,0|2,0,1]=4 748 B11R1.86 CN(C)Cc1cccnc1Cl 269982a_100102631434_100000045678 [0,1,0,0,0,0|2,0,1]=4 749 B11R1.86 CN(C)Cc1cccnc1Cl 269982a_103496529121_200000210301 [0,1,0,0,0,0|2,0,1]=4 750 B11R1.86 CN(C)Cc1cccnc1F 2230a_100102631434_100000099810 [0,1,0,0,0,0|2,0,1]=4 751 B11R1.86 CN(C)Cc1cccnc1F 269982a_100102631434_100000099810 [0,1,0,0,0,0|2,0,1]=4 752 B11R1.86 CN(C)Cc1cccnc1O 270004a_100102631434_100011998315 [0,1,0,0,0,0|2,0,1]=4 753 B11R1.86 CN(C)Cc1ccncc1Br 270004a_100102631434_100000755692 [0,1,0,0,0,0|2,0,1]=4 754 B11R1.86 CN(C)Cc1ccncc1Cl 2230a_100102631434_100000763264 [0,1,0,0,0,0|2,0,1]=4 755 B11R1.86 CN(C)Cc1ccncc1Cl 269982a_100102631434_100000763264 [0,1,0,0,0,0|2,0,1]=4 756 B11R1.86 CN(C)Cc1ccncc1Cl 270004a_100102631434_100011934409 [0,1,0,0,0,0|2,0,1]=4 757 B11R1.86 CN(C)Cc1cnccc1Br 270004a_100102631434_100009816821 [0,1,0,0,0,0|2,0,1]=4 758 B11R1.86 CN(C)Cc1cnccc1Cl 270004a_100102631434_100000050567 [0,1,0,0,0,0|2,0,1]=4 759 B11R1.86 CN(C)Cc1ncccc1Br 2230a_100102631434_100025702911 [0,1,0,0,0,0|2,0,1]=4 760 B11R1.86 CN(C)Cc1ncccc1Br 270004a_100102631434_100011934733 [0,1,0,0,0,0|2,0,1]=4 761 B11R1.86 CN(C)Cc1ncccc1Cl 2230a_100102631434_100000099807 [0,1,0,0,0,0|2,0,1]=4 762 B11R1.86 CN(C)Cc1ncccc1Cl 269982a_100102631434_100000099807 [0,1,0,0,0,0|2,0,1]=4 763 B11R1.86 CN(C)Cc1ncccc1Cl 270004a_100102631434_100012001307 [0,1,0,0,0,0|2,0,1]=4 764 B11R1.86 CN(C)Cc1ncccc1F 2230a_100102631434_100000104219 [0,1,0,0,0,0|2,0,1]=4 765 B11R1.86 CN(C)Cc1ncccc1F 269982a_100102631434_100000104219 [0,1,0,0,0,0|2,0,1]=4 766 B11R1.86 CN(C)Cc1ncccc1F 270004a_100102631434_100011934734 [0,1,0,0,0,0|2,0,1]=4 767 B11R1.86 CN([13CH3])Cc1ccccc1Br 2230a_100000184654_200025704644 [0,1,0,0,0,0|1,0,1]=3 768 B11R1.86 CN([13CH3])Cc1ccccc1Br 269982a_100000184654_200025704644 [0,1,0,0,0,0|1,0,1]=3 769 B11R1.86 CN([13CH3])Cc1ccccc1Cl 2230a_100000184507_200025704644 [0,1,0,0,0,0|1,0,1]=3 770 B11R1.86 CN([13CH3])Cc1ccccc1Cl 269982a_100000184507_200025704644 [0,1,0,0,0,0|1,0,1]=3 771 B11R1.86 CN([13CH3])Cc1ccccc1F 2230a_100000742528_200025704644 [0,1,0,0,0,0|1,0,1]=3 772 B11R1.86 CN([13CH3])Cc1ccccc1F 269982a_100000742528_200025704644 [0,1,0,0,0,0|1,0,1]=3 773 B11R1.86 CN([13CH3])Cc1ccccc1F 34a_100000742528_200025704644 [0,1,0,0,0,0|1,0,1]=3 774 B11R1.86 CN([13CH3])Cc1ccccc1O 2230a_100015189988_200025704644 [0,1,0,0,0,0|1,0,1]=3 775 B11R1.86 CN([13CH3])Cc1ccccc1O 269982a_100015189988_200025704644 [0,1,0,0,0,0|1,0,1]=3 776 B11R1.86 CN([13CH3])Cc1cccnc1Cl 2230a_103496529121_200025704644 [0,1,0,0,0,0|2,0,1]=4 777 B11R1.86 CN([13CH3])Cc1cccnc1Cl 269982a_103496529121_200025704644 [0,1,0,0,0,0|2,0,1]=4 778 B11R1.86 Cc1ccccc1CC(=O)[13CH3] 1458a_100000212180_200025704644 [0,1,0,0,0,0|1,0,0]=2 779 B11R1.86 Cc1ccccc1CN(C)C 2230a_100000184421_200000210301 [0,1,0,0,0,0|1,0,1]=3 780 B11R1.86 Cc1ccccc1CN(C)C 2230a_100102631434_100000211839 [0,1,0,0,0,0|1,0,1]=3 781 B11R1.86 Cc1ccccc1CN(C)C 269982a_100000184421_200000210301 [0,1,0,0,0,0|1,0,1]=3 782 B11R1.86 Cc1ccccc1CN(C)C 269982a_100102631434_100000211839 [0,1,0,0,0,0|1,0,1]=3 783 B11R1.86 Cc1ccccc1CN(C)C 270004a_100102631434_100000211143 [0,1,0,0,0,0|1,0,1]=3 784 B11R1.86 Cc1ccccc1CN(C)[13CH3] 2230a_100000184421_200025704644 [0,1,0,0,0,0|1,0,1]=3 785 B11R1.86 Cc1ccccc1CN(C)[13CH3] 269982a_100000184421_200025704644 [0,1,0,0,0,0|1,0,1]=3 786 B11R1.86 Cc1ccccc1NC(C)C 34a_100015192222_100000210206 [0,1,0,0,0,0|1,0,2]=4 787 B11R1.86 Cc1ccccc1OC(C)C 34a_100000210338_100000210206 [0,1,0,0,0,0|1,0,2]=4 788 B11R1.86 Cc1ccccc1OC(C)C 7a_100000210338_100000210206 [0,1,0,0,0,0|1,0,2]=4 789 B11R1.86 Cc1ccccc1SC(C)C 62a_100000210206_100000210755 [0,1,0,0,0,0|1,0,2]=4 790 B11R1.86 Cc1ccccc1SC(C)C 62a_100000210755_100000210206 [0,1,0,0,0,0|1,0,2]=4 791 B11R1.86 Cc1cccnc1CC(=O)[13CH3] 1458a_200000722269_200025704644 [0,1,0,0,0,0|2,0,0]=3 792 B11R1.86 Cc1cccnc1CN(C)C 2230a_100102631434_100000696600 [0,1,0,0,0,0|2,0,1]=4 793 B11R1.86 Cc1cccnc1CN(C)C 269982a_100102631434_100000696600 [0,1,0,0,0,0|2,0,1]=4 794 B11R1.86 Cc1cccnc1CN(C)C 270004a_100102631434_100000698913 [0,1,0,0,0,0|2,0,1]=4 795 B11R1.86 Cc1ccncc1CN(C)C 2230a_100102631434_100000690890 [0,1,0,0,0,0|2,0,1]=4 796 B11R1.86 Cc1ccncc1CN(C)C 269982a_100102631434_100000690890 [0,1,0,0,0,0|2,0,1]=4 797 B11R1.86 Cc1ccncc1CN(C)C 270004a_100102631434_100000685662 [0,1,0,0,0,0|2,0,1]=4 798 B11R1.86 Cc1cnccc1CN(C)C 2230a_100015187836_200000210301 [0,1,0,0,0,0|2,0,1]=4 799 B11R1.86 Cc1cnccc1CN(C)C 2230a_100102631434_100020672808 [0,1,0,0,0,0|2,0,1]=4 800 B11R1.86 Cc1cnccc1CN(C)C 269982a_100015187836_200000210301 [0,1,0,0,0,0|2,0,1]=4 801 B11R1.86 Cc1cnccc1CN(C)C 269982a_100102631434_100020672808 [0,1,0,0,0,0|2,0,1]=4 802 B11R1.86 Cc1cnccc1CN(C)[13CH3] 2230a_100015187836_200025704644 [0,1,0,0,0,0|2,0,1]=4 803 B11R1.86 Cc1cnccc1CN(C)[13CH3] 269982a_100015187836_200025704644 [0,1,0,0,0,0|2,0,1]=4 804 B11R1.86 Cc1ncccc1CN(C)C 2230a_100102631434_100000732876 [0,1,0,0,0,0|2,0,1]=4 805 B11R1.86 Cc1ncccc1CN(C)C 2230a_200011875998_200000210301 [0,1,0,0,0,0|2,0,1]=4 806 B11R1.86 Cc1ncccc1CN(C)C 269982a_100102631434_100000732876 [0,1,0,0,0,0|2,0,1]=4 807 B11R1.86 Cc1ncccc1CN(C)C 269982a_200011875998_200000210301 [0,1,0,0,0,0|2,0,1]=4 808 B11R1.86 Cc1ncccc1CN(C)C 270004a_100102631434_100000751968 [0,1,0,0,0,0|2,0,1]=4 809 B11R1.86 Cc1ncccc1CN(C)[13CH3] 2230a_200011875998_200025704644 [0,1,0,0,0,0|2,0,1]=4 810 B11R1.86 Cc1ncccc1CN(C)[13CH3] 269982a_200011875998_200025704644 [0,1,0,0,0,0|2,0,1]=4 811 B11R1.86 NC(=O)Cc1ccccc1O 271570a_203496583355_200009814924 [0,1,0,0,0,0|2,0,0]=3 812 B11R1.86 NC(=O)Nc1ccccc1O 271570a_203496583355_100000742221 [0,1,0,0,0,0|3,0,0]=4 813 B11R1.86 [13CH3]C(=O)Cc1ccccc1Br 1458a_100000751119_200025704644 [0,1,0,0,0,0|1,0,0]=2 814 B11R1.86 [13CH3]C(=O)Cc1ccccc1Cl 1458a_100000183793_200025704644 [0,1,0,0,0,0|1,0,0]=2 815 B11R1.86 [13CH3]C(=O)Cc1ccccc1F 1458a_100000212012_200025704644 [0,1,0,0,0,0|1,0,0]=2 816 B11R1.86 [13CH3]C(=O)Cc1ccccc1I 1458a_100000036491_200025704644 [0,1,0,0,0,0|1,0,0]=2 817 B11R1.86 [13CH3]C(=O)Cc1ccccc1O 1458a_100000743006_200025704644 [0,1,0,0,0,0|1,0,0]=2 818 B11R1.86 [13CH3]C(=O)Cc1cccnc1Cl 1458a_100000093521_200025704644 [0,1,0,0,0,0|2,0,0]=3 819 B11R1.86 [13CH3]C(=O)Cc1ncccc1Br 1458a_200012357574_200025704644 [0,1,0,0,0,0|2,0,0]=3 820 B11R1.86 [13CH3]C(=O)Cc1ncccc1Cl 1458a_100011998755_200025704644 [0,1,0,0,0,0|2,0,0]=3 821 B11R1.86 [13CH3]C(=O)Cn1ccccc1=O 1458a_100000189665_200025704644 [0,1,0,0,0,0|2,0,0]=3 822 B11R1.86 [13CH3]C(=O)Cn1cccnc1=O 1458a_100000738077_200025704644 [0,1,0,0,0,0|3,0,0]=4 823 B11R1.86 [13CH3]C(=O)Cn1ncccc1=O 1458a_100000238584_200025704644 [0,1,0,0,0,0|3,0,0]=4 824 B11R1.157 CC(=Cc1cc(ccn1)C)C 271570a_100102525489_100000750283 [0,1,0,0,0,0|1,0,2]=4 825 B11R1.157 CC(=Cc1cc(ccn1)Cl)C 271570a_100102525489_100010167805 [0,1,0,0,0,0|1,0,2]=4 826 B11R1.157 CC(=Cc1cc(ccn1)F)C 271570a_100102525489_100009817058 [0,1,0,0,0,0|1,0,2]=4 827 B11R1.157 CC(=Cc1cc(ccn1)N)C 271570a_100102525489_100009814236 [0,1,0,0,0,0|1,0,2]=4 828 B11R1.157 CC(=Cc1cc(ccn1)O)C 271570a_100102525489_100000762945 [0,1,0,0,0,0|1,0,2]=4 829 B11R1.157 CC(=Cc1cc[nH]c(=O)c1)C 271570a_100102525489_100009816521 [0,1,0,0,0,0|1,0,2]=4 830 B11R1.157 CC(=Cc1ccc[n+](c1)C)C 271570a_100102525489_100009996589 [0,1,0,0,0,0|1,0,2]=4 831 B11R1.157 CC(=Cc1ccc[n+](c1)[O-])C 271570a_100102525489_100009815978 [0,1,0,0,0,0|1,0,2]=4 832 B11R1.157 CC(=Cc1cccc(=O)[nH]1)C 271570a_100102525489_100000761760 [0,1,0,0,0,0|1,0,2]=4 833 B11R1.157 CC(=Cc1cccc(c1)Br)C 271570a_100102525489_100000691529 [0,1,0,0,0,0|0,0,2]=3 834 B11R1.157 CC(=Cc1cccc(c1)C)C 271570a_100102525489_100011215228 [0,1,0,0,0,0|0,0,2]=3 835 B11R1.157 CC(=Cc1cccc(c1)Cl)C 271570a_100102525489_100000699651 [0,1,0,0,0,0|0,0,2]=3 836 B11R1.157 CC(=Cc1cccc(c1)F)C 271570a_100102525489_100000685547 [0,1,0,0,0,0|0,0,2]=3 837 B11R1.157 CC(=Cc1cccc(c1)N)C 271570a_100102525489_100000210019 [0,1,0,0,0,0|0,0,2]=3 838 B11R1.157 CC(=Cc1cccc(c1)O)C 271570a_100102525489_100000211634 [0,1,0,0,0,0|0,0,2]=3 839 B11R1.157 CC(=Cc1cccc(c1)[S])C 271570a_100102525489_114929384022 [0,1,0,0,0,0|0,0,2]=3 840 B11R1.157 CC(=Cc1cccc(n1)Br)C 271570a_100102525489_100000684672 [0,1,0,0,0,0|1,0,2]=4 841 B11R1.157 CC(=Cc1cccc(n1)C)C 271570a_100102525489_100000742759 [0,1,0,0,0,0|1,0,2]=4 842 B11R1.157 CC(=Cc1cccc(n1)F)C 271570a_100102525489_100009815982 [0,1,0,0,0,0|1,0,2]=4 843 B11R1.157 CC(=Cc1cccc(n1)N)C 271570a_100102525489_100000740741 [0,1,0,0,0,0|1,0,2]=4 844 B11R1.157 CC(=Cc1ccnc(c1)Br)C 271570a_100102525489_100009814637 [0,1,0,0,0,0|1,0,2]=4 845 B11R1.157 CC(=Cc1ccnc(c1)C)C 271570a_100102525489_100000758586 [0,1,0,0,0,0|1,0,2]=4 846 B11R1.157 CC(=Cc1ccnc(c1)Cl)C 271570a_100102525489_100000035001 [0,1,0,0,0,0|1,0,2]=4 847 B11R1.157 CC(=Cc1ccnc(c1)F)C 271570a_100102525489_100009816116 [0,1,0,0,0,0|1,0,2]=4 848 B11R1.157 CC(=Cc1ccnc(c1)N)C 271570a_100102525489_100000744379 [0,1,0,0,0,0|1,0,2]=4 849 B11R1.157 CC(=Cc1cncc(c1)Br)C 271570a_100102525489_100000728054 [0,1,0,0,0,0|1,0,2]=4 850 B11R1.157 CC(=Cc1cncc(c1)C)C 271570a_100102525489_100000760492 [0,1,0,0,0,0|1,0,2]=4 851 B11R1.157 CC(=Cc1cncc(c1)Cl)C 271570a_100102525489_100000049639 [0,1,0,0,0,0|1,0,2]=4 852 B11R1.157 CC(=Cc1cncc(c1)F)C 271570a_100102525489_100000744099 [0,1,0,0,0,0|1,0,2]=4 853 B11R1.157 CC(=Cc1cncc(c1)N)C 271570a_100102525489_100000687067 [0,1,0,0,0,0|1,0,2]=4 854 B11R1.157 CC(=Cc1cncc(c1)O)C 271570a_100102525489_100000754920 [0,1,0,0,0,0|1,0,2]=4 855 B11R1.157 CC(=O)Cc1cc(ccn1)Br 1458a_100000070787_100010173614 [0,1,0,0,0,0|2,0,0]=3 856 B11R1.157 CC(=O)Cc1cc(ccn1)C 1458a_100000070787_100000718516 [0,1,0,0,0,0|2,0,0]=3 857 B11R1.157 CC(=O)Cc1cc(ccn1)Cl 1458a_100000070787_100016988179 [0,1,0,0,0,0|2,0,0]=3 858 B11R1.157 CC(=O)Cc1cccc(c1)Br 1458a_100000070787_100000211773 [0,1,0,0,0,0|1,0,0]=2 859 B11R1.157 CC(=O)Cc1cccc(c1)Br 1458a_100000747190_200000210301 [0,1,0,0,0,0|1,0,0]=2 860 B11R1.157 CC(=O)Cc1cccc(c1)C 1458a_100000070787_100000211840 [0,1,0,0,0,0|1,0,0]=2 861 B11R1.157 CC(=O)Cc1cccc(c1)C 1458a_100011206899_200000210301 [0,1,0,0,0,0|1,0,0]=2 862 B11R1.157 CC(=O)Cc1cccc(c1)Cl 1458a_100000070787_100000181238 [0,1,0,0,0,0|1,0,0]=2 863 B11R1.157 CC(=O)Cc1cccc(c1)Cl 1458a_100000749307_200000210301 [0,1,0,0,0,0|1,0,0]=2 864 B11R1.157 CC(=O)Cc1cccc(c1)F 1458a_100000070787_100000230114 [0,1,0,0,0,0|1,0,0]=2 865 B11R1.157 CC(=O)Cc1cccc(c1)F 1458a_100000211661_200000210301 [0,1,0,0,0,0|1,0,0]=2 866 B11R1.157 CC(=O)Cc1cccc(c1)I 1458a_100000070787_100011218688 [0,1,0,0,0,0|1,0,0]=2 867 B11R1.157 CC(=O)Cc1cccc(c1)I 1458a_100000238430_200000210301 [0,1,0,0,0,0|1,0,0]=2 868 B11R1.157 CC(=O)Cc1cccc(c1)O 1458a_100000070787_100011660834 [0,1,0,0,0,0|1,0,0]=2 869 B11R1.157 CC(=O)Cc1cccc(c1)O 1458a_100000745134_200000210301 [0,1,0,0,0,0|1,0,0]=2 870 B11R1.157 CC(=O)Cc1cccc(c1)O 271570a_203496583355_100000689217 [0,1,0,0,0,0|1,0,0]=2 871 B11R1.157 CC(=O)Cc1cccc(n1)Br 1458a_100000070787_100009889011 [0,1,0,0,0,0|2,0,0]=3 872 B11R1.157 CC(=O)Cc1cccc(n1)Br 1458a_100010201708_200000210301 [0,1,0,0,0,0|2,0,0]=3 873 B11R1.157 CC(=O)Cc1cccc(n1)C 1458a_100000070787_100000757606 [0,1,0,0,0,0|2,0,0]=3 874 B11R1.157 CC(=O)Cc1cccc(n1)C 1458a_100012001110_200000210301 [0,1,0,0,0,0|2,0,0]=3 875 B11R1.157 CC(=O)Cc1cccc(n1)Cl 1458a_100000070787_100000086093 [0,1,0,0,0,0|2,0,0]=3 876 B11R1.157 CC(=O)Cc1cccc(n1)Cl 1458a_100000090259_200000210301 [0,1,0,0,0,0|2,0,0]=3 877 B11R1.157 CC(=O)Cc1cccc(n1)F 1458a_100000070787_100009819644 [0,1,0,0,0,0|2,0,0]=3 878 B11R1.157 CC(=O)Cc1cccc(n1)F 1458a_100000096803_200000210301 [0,1,0,0,0,0|2,0,0]=3 879 B11R1.157 CC(=O)Cc1ccnc(c1)Br 1458a_100000070787_100010243470 [0,1,0,0,0,0|2,0,0]=3 880 B11R1.157 CC(=O)Cc1ccnc(c1)Br 1458a_100010126891_200000210301 [0,1,0,0,0,0|2,0,0]=3 881 B11R1.157 CC(=O)Cc1ccnc(c1)C 1458a_100000070787_200020672517 [0,1,0,0,0,0|2,0,0]=3 882 B11R1.157 CC(=O)Cc1ccnc(c1)Cl 1458a_100000070787_100000764220 [0,1,0,0,0,0|2,0,0]=3 883 B11R1.157 CC(=O)Cc1ccnc(n1)Cl 1458a_100000070787_100000099655 [0,1,0,0,0,0|3,0,0]=4 884 B11R1.157 CC(=O)Cc1cncc(c1)Br 1458a_100000070787_100011740620 [0,1,0,0,0,0|2,0,0]=3 885 B11R1.157 CC(=O)Cc1cncc(c1)Br 1458a_100000239331_200000210301 [0,1,0,0,0,0|2,0,0]=3 886 B11R1.157 CC(=O)Cc1cncc(c1)C 1458a_100000070787_100000716715 [0,1,0,0,0,0|2,0,0]=3 887 B11R1.157 CC(=O)Cc1cncc(c1)Cl 1458a_100000070787_100016992070 [0,1,0,0,0,0|2,0,0]=3 888 B11R1.157 CC(=O)Cc1cncc(c1)F 1458a_100000070787_100000725299 [0,1,0,0,0,0|2,0,0]=3 889 B11R1.157 CC(=O)Cc1cncc(c1)F 1458a_100011667516_200000210301 [0,1,0,0,0,0|2,0,0]=3 890 B11R1.157 CC(=O)Nc1cc(ccn1)O 271570a_203496583355_100012362434 [0,1,0,0,0,0|3,0,0]=4 891 B11R1.157 CC(=O)Nc1cccc(c1)Br 11a_100000210019_100015343762 [0,1,0,0,0,0|2,0,0]=3 892 B11R1.157 CC(=O)Nc1cccc(c1)Br 1626a_100000210019_100015343762 [0,1,0,0,0,0|2,0,0]=3 893 B11R1.157 CC(=O)Nc1cccc(c1)Br 22a_100000210019_100000070787 [0,1,0,0,0,0|2,0,0]=3 894 B11R1.157 CC(=O)Nc1cccc(c1)Br 527a_100000210019_100103153847 [0,1,0,0,0,0|2,0,0]=3 895 B11R1.157 CC(=O)Nc1cccc(c1)C 11a_100000188690_100015343762 [0,1,0,0,0,0|2,0,0]=3 896 B11R1.157 CC(=O)Nc1cccc(c1)C 1626a_100000188690_100015343762 [0,1,0,0,0,0|2,0,0]=3 897 B11R1.157 CC(=O)Nc1cccc(c1)C 22a_100000188690_100000070787 [0,1,0,0,0,0|2,0,0]=3 898 B11R1.157 CC(=O)Nc1cccc(c1)C 527a_100000188690_100103153847 [0,1,0,0,0,0|2,0,0]=3 899 B11R1.157 CC(=O)Nc1cccc(c1)Cl 11a_100000185859_100015343762 [0,1,0,0,0,0|2,0,0]=3 900 B11R1.157 CC(=O)Nc1cccc(c1)Cl 1626a_100000185859_100015343762 [0,1,0,0,0,0|2,0,0]=3 901 B11R1.157 CC(=O)Nc1cccc(c1)Cl 22a_100000185859_100000070787 [0,1,0,0,0,0|2,0,0]=3 902 B11R1.157 CC(=O)Nc1cccc(c1)F 11a_100000210047_100015343762 [0,1,0,0,0,0|2,0,0]=3 903 B11R1.157 CC(=O)Nc1cccc(c1)F 1626a_100000210047_100015343762 [0,1,0,0,0,0|2,0,0]=3 904 B11R1.157 CC(=O)Nc1cccc(c1)F 22a_100000210047_100000070787 [0,1,0,0,0,0|2,0,0]=3 905 B11R1.157 CC(=O)Nc1cccc(c1)F 527a_100000210047_100103153847 [0,1,0,0,0,0|2,0,0]=3 906 B11R1.157 CC(=O)Nc1cccc(c1)I 11a_100000211102_100015343762 [0,1,0,0,0,0|2,0,0]=3 907 B11R1.157 CC(=O)Nc1cccc(c1)I 1626a_100000211102_100015343762 [0,1,0,0,0,0|2,0,0]=3 908 B11R1.157 CC(=O)Nc1cccc(c1)I 22a_100000211102_100000070787 [0,1,0,0,0,0|2,0,0]=3 909 B11R1.157 CC(=O)Nc1cccc(c1)I 527a_100000211102_100103153847 [0,1,0,0,0,0|2,0,0]=3 910 B11R1.157 CC(=O)Nc1cccc(c1)O 1626a_100000210217_100015343762 [0,1,0,0,0,0|2,0,0]=3 911 B11R1.157 CC(=O)Nc1cccc(c1)O 22a_100000210217_100000070787 [0,1,0,0,0,0|2,0,0]=3 912 B11R1.157 CC(=O)Nc1cccc(c1)O 271570a_203496583355_100000153616 [0,1,0,0,0,0|2,0,0]=3 913 B11R1.157 CC(=O)Nc1cccc(c1)O 527a_100000210217_100103153847 [0,1,0,0,0,0|2,0,0]=3 914 B11R1.157 CC(=O)Nc1cccc(n1)O 271570a_203496583355_200011307899 [0,1,0,0,0,0|3,0,0]=4 915 B11R1.157 CC(=O)Nc1ccnc(c1)O 271570a_203496583355_100000238608 [0,1,0,0,0,0|3,0,0]=4 916 B11R1.157 CC(=O)Nc1cncc(c1)O 271570a_203496583355_100012351681 [0,1,0,0,0,0|3,0,0]=4 917 B11R1.157 CC(=O)Oc1cccc(c1)O 271570a_203496583355_100009811612 [0,1,0,0,0,0|2,0,0]=3 918 B11R1.157 CC(C)Cc1cccc(c1)O 271570a_203496583355_100010883412 [0,1,0,0,0,0|0,0,2]=3 919 B11R1.157 CC(C)Nc1cccc(c1)Br 34a_100000210019_100000210206 [0,1,0,0,0,0|1,0,2]=4 920 B11R1.157 CC(C)Nc1cccc(c1)Cl 34a_100000185859_100000210206 [0,1,0,0,0,0|1,0,2]=4 921 B11R1.157 CC(C)Nc1cccc(c1)F 34a_100000210047_100000210206 [0,1,0,0,0,0|1,0,2]=4 922 B11R1.157 CC(C)Nc1cccc(c1)I 34a_100000211102_100000210206 [0,1,0,0,0,0|1,0,2]=4 923 B11R1.157 CC(C)Nc1cccc(c1)O 271570a_203496583355_100000219649 [0,1,0,0,0,0|1,0,2]=4 924 B11R1.157 CC(C)Nc1cccc(c1)O 34a_100000210217_100000210206 [0,1,0,0,0,0|1,0,2]=4 925 B11R1.157 CC(C)Oc1cccc(c1)Br 34a_100000210342_100000210206 [0,1,0,0,0,0|1,0,2]=4 926 B11R1.157 CC(C)Oc1cccc(c1)Br 7a_100000210342_100000210206 [0,1,0,0,0,0|1,0,2]=4 927 B11R1.157 CC(C)Oc1cccc(c1)Cl 34a_100000210295_100000210206 [0,1,0,0,0,0|1,0,2]=4 928 B11R1.157 CC(C)Oc1cccc(c1)Cl 7a_100000210295_100000210206 [0,1,0,0,0,0|1,0,2]=4 929 B11R1.157 CC(C)Oc1cccc(c1)F 34a_100000210426_100000210206 [0,1,0,0,0,0|1,0,2]=4 930 B11R1.157 CC(C)Oc1cccc(c1)F 7a_100000210426_100000210206 [0,1,0,0,0,0|1,0,2]=4 931 B11R1.157 CC(C)Oc1cccc(c1)I 34a_100000211634_100000210206 [0,1,0,0,0,0|1,0,2]=4 932 B11R1.157 CC(C)Oc1cccc(c1)I 7a_100000211634_100000210206 [0,1,0,0,0,0|1,0,2]=4 933 B11R1.157 CC(C)Oc1cccc(c1)N 34a_100000210217_100000210206 [0,1,0,0,0,0|1,0,2]=4 934 B11R1.157 CC(C)Oc1cccc(c1)O 271570a_203496583355_100000170003 [0,1,0,0,0,0|1,0,2]=4 935 B11R1.157 CC(C)Sc1cccc(c1)Br 62a_100000210206_100000691529 [0,1,0,0,0,0|1,0,2]=4 936 B11R1.157 CC(C)Sc1cccc(c1)Br 62a_100000691529_100000210206 [0,1,0,0,0,0|1,0,2]=4 937 B11R1.157 CC(C)Sc1cccc(c1)Cl 62a_100000210206_100000699651 [0,1,0,0,0,0|1,0,2]=4 938 B11R1.157 CC(C)Sc1cccc(c1)Cl 62a_100000699651_100000210206 [0,1,0,0,0,0|1,0,2]=4 939 B11R1.157 CC(C)Sc1cccc(c1)F 62a_100000210206_100000685547 [0,1,0,0,0,0|1,0,2]=4 940 B11R1.157 CC(C)Sc1cccc(c1)F 62a_100000685547_100000210206 [0,1,0,0,0,0|1,0,2]=4 941 B11R1.157 CC(C)Sc1cccc(c1)N 62a_100000210019_100000210206 [0,1,0,0,0,0|1,0,2]=4 942 B11R1.157 CC(C)Sc1cccc(c1)N 62a_100000210206_100000210019 [0,1,0,0,0,0|1,0,2]=4 943 B11R1.157 CC(C)Sc1cccc(c1)O 271570a_203496583355_100009815759 [0,1,0,0,0,0|1,0,2]=4 944 B11R1.157 CC(C)Sc1cccc(c1)O 62a_100000210206_100000211634 [0,1,0,0,0,0|1,0,2]=4 945 B11R1.157 CC(C)Sc1cccc(c1)[S] 62a_100000210206_114929384022 [0,1,0,0,0,0|1,0,2]=4 946 B11R1.157 CC(C)Sc1cccc(c1)[S] 62a_114929384022_100000210206 [0,1,0,0,0,0|1,0,2]=4 947 B11R1.157 CN(C)Cc1cc(ccn1)Br 2230a_100102631434_100010173614 [0,1,0,0,0,0|2,0,1]=4 948 B11R1.157 CN(C)Cc1cc(ccn1)Br 269982a_100102631434_100010173614 [0,1,0,0,0,0|2,0,1]=4 949 B11R1.157 CN(C)Cc1cc(ccn1)Br 270004a_100102631434_100009818557 [0,1,0,0,0,0|2,0,1]=4 950 B11R1.157 CN(C)Cc1cc(ccn1)Cl 2230a_100102631434_100016988179 [0,1,0,0,0,0|2,0,1]=4 951 B11R1.157 CN(C)Cc1cc(ccn1)Cl 2230a_100102954512_200000210301 [0,1,0,0,0,0|2,0,1]=4 952 B11R1.157 CN(C)Cc1cc(ccn1)Cl 269982a_100102631434_100016988179 [0,1,0,0,0,0|2,0,1]=4 953 B11R1.157 CN(C)Cc1cc(ccn1)Cl 269982a_100102954512_200000210301 [0,1,0,0,0,0|2,0,1]=4 954 B11R1.157 CN(C)Cc1cc(ccn1)Cl 270004a_100102631434_100011998288 [0,1,0,0,0,0|2,0,1]=4 955 B11R1.157 CN(C)Cc1cccc(c1)Br 2230a_100000187585_200000210301 [0,1,0,0,0,0|1,0,1]=3 956 B11R1.157 CN(C)Cc1cccc(c1)Br 2230a_100102631434_100000698116 [0,1,0,0,0,0|1,0,1]=3 957 B11R1.157 CN(C)Cc1cccc(c1)Br 269982a_100000187585_200000210301 [0,1,0,0,0,0|1,0,1]=3 958 B11R1.157 CN(C)Cc1cccc(c1)Br 269982a_100102631434_100000211773 [0,1,0,0,0,0|1,0,1]=3 959 B11R1.157 CN(C)Cc1cccc(c1)Br 270004a_100102631434_100000210085 [0,1,0,0,0,0|1,0,1]=3 960 B11R1.157 CN(C)Cc1cccc(c1)Cl 2230a_100020629429_200000210301 [0,1,0,0,0,0|1,0,1]=3 961 B11R1.157 CN(C)Cc1cccc(c1)Cl 2230a_100102631434_100000181238 [0,1,0,0,0,0|1,0,1]=3 962 B11R1.157 CN(C)Cc1cccc(c1)Cl 269982a_100020629429_200000210301 [0,1,0,0,0,0|1,0,1]=3 963 B11R1.157 CN(C)Cc1cccc(c1)Cl 269982a_100102631434_100000181238 [0,1,0,0,0,0|1,0,1]=3 964 B11R1.157 CN(C)Cc1cccc(c1)Cl 270004a_100102631434_100000210801 [0,1,0,0,0,0|1,0,1]=3 965 B11R1.157 CN(C)Cc1cccc(c1)F 2230a_100000184398_200000210301 [0,1,0,0,0,0|1,0,1]=3 966 B11R1.157 CN(C)Cc1cccc(c1)F 2230a_100102631434_100000230114 [0,1,0,0,0,0|1,0,1]=3 967 B11R1.157 CN(C)Cc1cccc(c1)F 269982a_100000184398_200000210301 [0,1,0,0,0,0|1,0,1]=3 968 B11R1.157 CN(C)Cc1cccc(c1)F 269982a_100102631434_100000230114 [0,1,0,0,0,0|1,0,1]=3 969 B11R1.157 CN(C)Cc1cccc(c1)F 270004a_100102631434_100000210812 [0,1,0,0,0,0|1,0,1]=3 970 B11R1.157 CN(C)Cc1cccc(c1)F 34a_100000184398_200000210301 [0,1,0,0,0,0|1,0,1]=3 971 B11R1.157 CN(C)Cc1cccc(c1)I 2230a_100102631434_100011218688 [0,1,0,0,0,0|1,0,1]=3 972 B11R1.157 CN(C)Cc1cccc(c1)I 269982a_100102631434_100011218688 [0,1,0,0,0,0|1,0,1]=3 973 B11R1.157 CN(C)Cc1cccc(c1)I 270004a_100102631434_100000014684 [0,1,0,0,0,0|1,0,1]=3 974 B11R1.157 CN(C)Cc1cccc(c1)O 2230a_100000207540_200000210301 [0,1,0,0,0,0|1,0,1]=3 975 B11R1.157 CN(C)Cc1cccc(c1)O 2230a_100102631434_100011660834 [0,1,0,0,0,0|1,0,1]=3 976 B11R1.157 CN(C)Cc1cccc(c1)O 269982a_100000207540_200000210301 [0,1,0,0,0,0|1,0,1]=3 977 B11R1.157 CN(C)Cc1cccc(c1)O 269982a_100102631434_100000084143 [0,1,0,0,0,0|1,0,1]=3 978 B11R1.157 CN(C)Cc1cccc(c1)O 270004a_100102631434_100000188321 [0,1,0,0,0,0|1,0,1]=3 979 B11R1.157 CN(C)Cc1cccc(c1)O 271570a_203496583355_100000174759 [0,1,0,0,0,0|1,0,1]=3 980 B11R1.157 CN(C)Cc1cccc(n1)Br 2230a_100102631434_100009889011 [0,1,0,0,0,0|2,0,1]=4 981 B11R1.157 CN(C)Cc1cccc(n1)Br 2230a_106354212997_200000210301 [0,1,0,0,0,0|2,0,1]=4 982 B11R1.157 CN(C)Cc1cccc(n1)Br 269982a_100102631434_100009889011 [0,1,0,0,0,0|2,0,1]=4 983 B11R1.157 CN(C)Cc1cccc(n1)Br 269982a_106354212997_200000210301 [0,1,0,0,0,0|2,0,1]=4 984 B11R1.157 CN(C)Cc1cccc(n1)Br 270004a_100102631434_100000688028 [0,1,0,0,0,0|2,0,1]=4 985 B11R1.157 CN(C)Cc1cccc(n1)Cl 2230a_100102631434_100000086093 [0,1,0,0,0,0|2,0,1]=4 986 B11R1.157 CN(C)Cc1cccc(n1)Cl 269982a_100102631434_100000086093 [0,1,0,0,0,0|2,0,1]=4 987 B11R1.157 CN(C)Cc1cccc(n1)Cl 270004a_100102631434_100011361687 [0,1,0,0,0,0|2,0,1]=4 988 B11R1.157 CN(C)Cc1cccc(n1)F 2230a_100102631434_100009819644 [0,1,0,0,0,0|2,0,1]=4 989 B11R1.157 CN(C)Cc1cccc(n1)F 269982a_100102631434_100009819644 [0,1,0,0,0,0|2,0,1]=4 990 B11R1.157 CN(C)Cc1cccc(n1)F 270004a_100102631434_100000050434 [0,1,0,0,0,0|2,0,1]=4 991 B11R1.157 CN(C)Cc1ccnc(c1)Br 2230a_100102631434_100010243470 [0,1,0,0,0,0|2,0,1]=4 992 B11R1.157 CN(C)Cc1ccnc(c1)Br 269982a_100102631434_100010254460 [0,1,0,0,0,0|2,0,1]=4 993 B11R1.157 CN(C)Cc1ccnc(c1)Br 270004a_100102631434_100009814634 [0,1,0,0,0,0|2,0,1]=4 994 B11R1.157 CN(C)Cc1ccnc(c1)Cl 2230a_100102631434_100000764220 [0,1,0,0,0,0|2,0,1]=4 995 B11R1.157 CN(C)Cc1ccnc(c1)Cl 269982a_100102631434_100000764220 [0,1,0,0,0,0|2,0,1]=4 996 B11R1.157 CN(C)Cc1ccnc(c1)Cl 270004a_100102631434_100011290808 [0,1,0,0,0,0|2,0,1]=4 997 B11R1.157 CN(C)Cc1ccnc(c1)F 270004a_100102631434_100000068331 [0,1,0,0,0,0|2,0,1]=4 998 B11R1.157 CN(C)Cc1cncc(c1)Br 2230a_100102631434_100000738771 [0,1,0,0,0,0|2,0,1]=4 999 B11R1.157 CN(C)Cc1cncc(c1)Br 2230a_103549770560_200000210301 [0,1,0,0,0,0|2,0,1]=4 1000 B11R1.157 CN(C)Cc1cncc(c1)Br 269982a_100102631434_100000738771 [0,1,0,0,0,0|2,0,1]=4 1001 B11R1.157 CN(C)Cc1cncc(c1)Br 269982a_103549770560_200000210301 [0,1,0,0,0,0|2,0,1]=4 1002 B11R1.157 CN(C)Cc1cncc(c1)Br 270004a_100102631434_100000687066 [0,1,0,0,0,0|2,0,1]=4 1003 B11R1.157 CN(C)Cc1cncc(c1)Cl 2230a_100102631434_100016992070 [0,1,0,0,0,0|2,0,1]=4 1004 B11R1.157 CN(C)Cc1cncc(c1)Cl 269982a_100102631434_100016992070 [0,1,0,0,0,0|2,0,1]=4 1005 B11R1.157 CN(C)Cc1cncc(c1)Cl 270004a_100102631434_100000088910 [0,1,0,0,0,0|2,0,1]=4 1006 B11R1.157 CN(C)Cc1cncc(c1)F 2230a_100102631434_100000725299 [0,1,0,0,0,0|2,0,1]=4 1007 B11R1.157 CN(C)Cc1cncc(c1)F 269982a_100102631434_100000725299 [0,1,0,0,0,0|2,0,1]=4 1008 B11R1.157 CN(C)Cc1cncc(c1)F 270004a_100102631434_100011361476 [0,1,0,0,0,0|2,0,1]=4 1009 B11R1.157 CN(C)Cc1cncc(c1)O 270004a_100102631434_100012187055 [0,1,0,0,0,0|2,0,1]=4 1010 B11R1.157 CN([13CH3])Cc1cc(ccn1)Cl 2230a_100102954512_200025704644 [0,1,0,0,0,0|2,0,1]=4 1011 B11R1.157 CN([13CH3])Cc1cc(ccn1)Cl 269982a_100102954512_200025704644 [0,1,0,0,0,0|2,0,1]=4 1012 B11R1.157 CN([13CH3])Cc1cccc(c1)Br 2230a_100000187585_200025704644 [0,1,0,0,0,0|1,0,1]=3 1013 B11R1.157 CN([13CH3])Cc1cccc(c1)Br 269982a_100000187585_200025704644 [0,1,0,0,0,0|1,0,1]=3 1014 B11R1.157 CN([13CH3])Cc1cccc(c1)Cl 2230a_100020629429_200025704644 [0,1,0,0,0,0|1,0,1]=3 1015 B11R1.157 CN([13CH3])Cc1cccc(c1)Cl 269982a_100020629429_200025704644 [0,1,0,0,0,0|1,0,1]=3 1016 B11R1.157 CN([13CH3])Cc1cccc(c1)F 2230a_100000184398_200025704644 [0,1,0,0,0,0|1,0,1]=3 1017 B11R1.157 CN([13CH3])Cc1cccc(c1)F 269982a_100000184398_200025704644 [0,1,0,0,0,0|1,0,1]=3 1018 B11R1.157 CN([13CH3])Cc1cccc(c1)F 34a_100000184398_200025704644 [0,1,0,0,0,0|1,0,1]=3 1019 B11R1.157 CN([13CH3])Cc1cccc(c1)O 2230a_100000207540_200025704644 [0,1,0,0,0,0|1,0,1]=3 1020 B11R1.157 CN([13CH3])Cc1cccc(c1)O 269982a_100000207540_200025704644 [0,1,0,0,0,0|1,0,1]=3 1021 B11R1.157 CN([13CH3])Cc1cccc(n1)Br 2230a_106354212997_200025704644 [0,1,0,0,0,0|2,0,1]=4 1022 B11R1.157 CN([13CH3])Cc1cccc(n1)Br 269982a_106354212997_200025704644 [0,1,0,0,0,0|2,0,1]=4 1023 B11R1.157 CN([13CH3])Cc1cncc(c1)Br 2230a_103549770560_200025704644 [0,1,0,0,0,0|2,0,1]=4 1024 B11R1.157 CN([13CH3])Cc1cncc(c1)Br 269982a_103549770560_200025704644 [0,1,0,0,0,0|2,0,1]=4 1025 B11R1.157 Cc1cc(ccn1)CN(C)C 2230a_100102631434_200020672517 [0,1,0,0,0,0|2,0,1]=4 1026 B11R1.157 Cc1cc(ccn1)CN(C)C 269982a_100102631434_200020672517 [0,1,0,0,0,0|2,0,1]=4 1027 B11R1.157 Cc1cc(ccn1)CN(C)C 270004a_100102631434_100011361630 [0,1,0,0,0,0|2,0,1]=4 1028 B11R1.157 Cc1cccc(c1)CC(=O)[13CH3] 1458a_100011206899_200025704644 [0,1,0,0,0,0|1,0,0]=2 1029 B11R1.157 Cc1cccc(c1)CN(C)C 2230a_100102631434_100000211840 [0,1,0,0,0,0|1,0,1]=3 1030 B11R1.157 Cc1cccc(c1)CN(C)C 2230a_102495364743_200000210301 [0,1,0,0,0,0|1,0,1]=3 1031 B11R1.157 Cc1cccc(c1)CN(C)C 269982a_100102631434_100000211840 [0,1,0,0,0,0|1,0,1]=3 1032 B11R1.157 Cc1cccc(c1)CN(C)C 269982a_102495364743_200000210301 [0,1,0,0,0,0|1,0,1]=3 1033 B11R1.157 Cc1cccc(c1)CN(C)C 270004a_100102631434_100000211157 [0,1,0,0,0,0|1,0,1]=3 1034 B11R1.157 Cc1cccc(c1)CN(C)C 34a_102495364743_200000210301 [0,1,0,0,0,0|1,0,1]=3 1035 B11R1.157 Cc1cccc(c1)CN(C)[13CH3] 2230a_102495364743_200025704644 [0,1,0,0,0,0|1,0,1]=3 1036 B11R1.157 Cc1cccc(c1)CN(C)[13CH3] 269982a_102495364743_200025704644 [0,1,0,0,0,0|1,0,1]=3 1037 B11R1.157 Cc1cccc(c1)CN(C)[13CH3] 34a_102495364743_200025704644 [0,1,0,0,0,0|1,0,1]=3 1038 B11R1.157 Cc1cccc(c1)NC(C)C 2230a_100000188690_100000210206 [0,1,0,0,0,0|1,0,2]=4 1039 B11R1.157 Cc1cccc(c1)NC(C)C 34a_100000188690_100000210206 [0,1,0,0,0,0|1,0,2]=4 1040 B11R1.157 Cc1cccc(c1)OC(C)C 34a_100000210337_100000210206 [0,1,0,0,0,0|1,0,2]=4 1041 B11R1.157 Cc1cccc(c1)OC(C)C 7a_100000210337_100000210206 [0,1,0,0,0,0|1,0,2]=4 1042 B11R1.157 Cc1cccc(c1)SC(C)C 62a_100000210206_100011215228 [0,1,0,0,0,0|1,0,2]=4 1043 B11R1.157 Cc1cccc(c1)SC(C)C 62a_100011215228_100000210206 [0,1,0,0,0,0|1,0,2]=4 1044 B11R1.157 Cc1cccc(n1)CC(=O)[13CH3] 1458a_100012001110_200025704644 [0,1,0,0,0,0|2,0,0]=3 1045 B11R1.157 Cc1cccc(n1)CN(C)C 2230a_100000687132_200000210301 [0,1,0,0,0,0|2,0,1]=4 1046 B11R1.157 Cc1cccc(n1)CN(C)C 2230a_100102631434_100000757606 [0,1,0,0,0,0|2,0,1]=4 1047 B11R1.157 Cc1cccc(n1)CN(C)C 269982a_100000687132_200000210301 [0,1,0,0,0,0|2,0,1]=4 1048 B11R1.157 Cc1cccc(n1)CN(C)C 269982a_100102631434_100000757606 [0,1,0,0,0,0|2,0,1]=4 1049 B11R1.157 Cc1cccc(n1)CN(C)C 270004a_100102631434_100011215050 [0,1,0,0,0,0|2,0,1]=4 1050 B11R1.157 Cc1cccc(n1)CN(C)[13CH3] 2230a_100000687132_200025704644 [0,1,0,0,0,0|2,0,1]=4 1051 B11R1.157 Cc1cccc(n1)CN(C)[13CH3] 269982a_100000687132_200025704644 [0,1,0,0,0,0|2,0,1]=4 1052 B11R1.157 Cc1ccnc(c1)CN(C)C 2230a_100102631434_100000718516 [0,1,0,0,0,0|2,0,1]=4 1053 B11R1.157 Cc1ccnc(c1)CN(C)C 2230a_106354213154_200000210301 [0,1,0,0,0,0|2,0,1]=4 1054 B11R1.157 Cc1ccnc(c1)CN(C)C 269982a_100102631434_100000718516 [0,1,0,0,0,0|2,0,1]=4 1055 B11R1.157 Cc1ccnc(c1)CN(C)C 269982a_106354213154_200000210301 [0,1,0,0,0,0|2,0,1]=4 1056 B11R1.157 Cc1ccnc(c1)CN(C)C 270004a_100102631434_100011361488 [0,1,0,0,0,0|2,0,1]=4 1057 B11R1.157 Cc1ccnc(c1)CN(C)[13CH3] 2230a_106354213154_200025704644 [0,1,0,0,0,0|2,0,1]=4 1058 B11R1.157 Cc1ccnc(c1)CN(C)[13CH3] 269982a_106354213154_200025704644 [0,1,0,0,0,0|2,0,1]=4 1059 B11R1.157 Cc1cncc(c1)CN(C)C 2230a_100102631434_100000716715 [0,1,0,0,0,0|2,0,1]=4 1060 B11R1.157 Cc1cncc(c1)CN(C)C 269982a_100102631434_100000716715 [0,1,0,0,0,0|2,0,1]=4 1061 B11R1.157 Cc1cncc(c1)CN(C)C 270004a_100102631434_100011998712 [0,1,0,0,0,0|2,0,1]=4 1062 B11R1.157 NC(=O)Cc1cccc(c1)O 271570a_203496583355_100011586816 [0,1,0,0,0,0|2,0,0]=3 1063 B11R1.157 NC(=O)Nc1cccc(c1)O 271570a_203496583355_100000238923 [0,1,0,0,0,0|3,0,0]=4 1064 B11R1.157 [13CH3]C(=O)Cc1cccc(c1)Br 1458a_100000747190_200025704644 [0,1,0,0,0,0|1,0,0]=2 1065 B11R1.157 [13CH3]C(=O)Cc1cccc(c1)Cl 1458a_100000749307_200025704644 [0,1,0,0,0,0|1,0,0]=2 1066 B11R1.157 [13CH3]C(=O)Cc1cccc(c1)F 1458a_100000211661_200025704644 [0,1,0,0,0,0|1,0,0]=2 1067 B11R1.157 [13CH3]C(=O)Cc1cccc(c1)I 1458a_100000238430_200025704644 [0,1,0,0,0,0|1,0,0]=2 1068 B11R1.157 [13CH3]C(=O)Cc1cccc(c1)O 1458a_100000745134_200025704644 [0,1,0,0,0,0|1,0,0]=2 1069 B11R1.157 [13CH3]C(=O)Cc1cccc(n1)Br 1458a_100010201708_200025704644 [0,1,0,0,0,0|2,0,0]=3 1070 B11R1.157 [13CH3]C(=O)Cc1cccc(n1)Cl 1458a_100000090259_200025704644 [0,1,0,0,0,0|2,0,0]=3 1071 B11R1.157 [13CH3]C(=O)Cc1cccc(n1)F 1458a_100000096803_200025704644 [0,1,0,0,0,0|2,0,0]=3 1072 B11R1.157 [13CH3]C(=O)Cc1ccnc(c1)Br 1458a_100010126891_200025704644 [0,1,0,0,0,0|2,0,0]=3 1073 B11R1.157 [13CH3]C(=O)Cc1cncc(c1)Br 1458a_100000239331_200025704644 [0,1,0,0,0,0|2,0,0]=3 1074 B11R1.157 [13CH3]C(=O)Cc1cncc(c1)F 1458a_100011667516_200025704644 [0,1,0,0,0,0|2,0,0]=3 1075 B11R1.509 CC(C)(C)Nc1ccccc1 34a_100000106764_100000210625 [0,1,0,0,0,0|1,0,2]=4 1076 B11R1.509 CC(C)(C)Oc1ccccc1 34a_100000210340_100000210625 [0,1,0,0,0,0|1,0,2]=4 1077 B11R1.509 CC(C)(C)Sc1ccccc1 62a_100000211941_100000041952 [0,1,0,0,0,0|1,0,2]=4 1078 B11R1.509 CC(C)(C)Sc1ccccc1 62a_100000719477_100000211941 [0,1,0,0,0,0|1,0,2]=4 1079 B9R0.4 C=C(C)CC(=O)C=CCC 1458a_100000212282_100000748629 [0,0,1,0,0,0|1,0,2]=4 1080 B9R0.4 C=C(C)CC(=O)C=COC 1458a_100016268678_100000748629 [0,0,1,0,0,0|2,0,1]=4 1081 B9R0.4 C=C(C)CC(=O)CC=CC 1458a_100121576822_100000748629 [0,0,1,0,0,0|1,0,2]=4 1082 B9R0.4 C=CC=CC(=O)CC(=C)C 1458a_100016291481_100000748629 [0,0,1,0,0,0|1,0,0]=2 1083 B9R0.4 C=CC=CC(=O)CC(=C)F 1458a_100016291481_100009893438 [0,0,1,0,0,0|2,0,0]=3 1084 B9R0.4 C=CC=CC(=O)CC(=O)N 1458a_100016291481_100000187820 [0,0,1,0,0,0|3,0,0]=4 1085 B9R0.4 C=CC=CC(=O)CC(=O)[O-] 1458a_100016291481_100020667443 [0,0,1,0,0,0|3,0,0]=4 1086 B9R0.4 C=CC=CC(=O)CC(C)C 1458a_100016291481_100000210624 [0,0,1,0,0,0|1,0,2]=4 1087 B9R0.4 C=CC=CC(=O)CC(C)O 1458a_100016291481_100011218427 [0,0,1,0,0,0|2,0,1]=4 1088 B9R0.4 C=CCCC(=O)CC(=C)C 1458a_100000749702_100000748629 [0,0,1,0,0,0|1,0,2]=4 1089 B11R2.10 CN1Cc2ccccc2C1 2230a_100000752595_200000210301 [0,0,0,1,0,0|1,0,1]=3 1090 B11R2.10 CN1Cc2ccccc2C1 269982a_100000752595_200000210301 [0,0,0,1,0,0|1,0,1]=3 1091 B11R2.10 CN1Cc2ccccc2C1 34a_100000752595_200000210301 [0,0,0,1,0,0|1,0,1]=3 1092 B11R2.10 CN1Cc2cccnc2C1 269982a_100000726175_200000210301 [0,0,0,1,0,0|2,0,1]=4 1093 B11R2.10 CN1Cc2ccncc2C1 2230a_100000730608_200000210301 [0,0,0,1,0,0|2,0,1]=4 1094 B11R2.10 CN1Cc2ccncc2C1 269982a_100000730608_200000210301 [0,0,0,1,0,0|2,0,1]=4 1095 B11R2.10 Oc1cc2ccccc2[nH]1 271570a_203496583355_100010232065 [0,0,0,1,0,0|2,0,0]=3 1096 B11R2.10 Oc1cc2ccccc2o1 271570a_203496583355_100010159458 [0,0,0,1,0,0|2,0,0]=3 1097 B11R2.10 Oc1cc2ccccc2s1 271570a_203496583355_100009816949 [0,0,0,1,0,0|2,0,0]=3 1098 B11R2.10 Oc1cc2cccnc2[nH]1 271570a_203496583355_100010079843 [0,0,0,1,0,0|3,0,0]=4 1099 B11R2.10 Oc1cn2ccccc2n1 271570a_203496583355_100009819586 [0,0,0,1,0,0|3,0,0]=4 1100 B11R2.10 Oc1nc2ccccc2[nH]1 271570a_203496583355_100009814255 [0,0,0,1,0,0|3,0,0]=4 1101 B11R2.10 Oc1nc2ccccc2s1 271570a_203496583355_100000751744 [0,0,0,1,0,0|3,0,0]=4 1102 B11R2.10 [13CH3]N1Cc2ccccc2C1 2230a_100000752595_200025704644 [0,0,0,1,0,0|1,0,1]=3 1103 B11R2.10 [13CH3]N1Cc2ccccc2C1 269982a_100000752595_200025704644 [0,0,0,1,0,0|1,0,1]=3 1104 B11R2.10 [13CH3]N1Cc2ccccc2C1 34a_100000752595_200025704644 [0,0,0,1,0,0|1,0,1]=3 1105 B11R2.10 [13CH3]N1Cc2cccnc2C1 269982a_100000726175_200025704644 [0,0,0,1,0,0|2,0,1]=4 1106 B11R2.10 [13CH3]N1Cc2ccncc2C1 2230a_100000730608_200025704644 [0,0,0,1,0,0|2,0,1]=4 1107 B11R2.10 [13CH3]N1Cc2ccncc2C1 269982a_100000730608_200025704644 [0,0,0,1,0,0|2,0,1]=4 1108 B11R2.238 c1ccc(cc1)NC2CC2 34a_100000106764_100000211595 [0,0,0,1,0,0|1,0,2]=4 1109 B11R2.238 c1ccc(cc1)OC2CC2 34a_100000210340_100000211595 [0,0,0,1,0,0|1,0,2]=4 1110 B11R2.238 c1ccc(cc1)SC2CC2 62a_100000719477_100000211595 [0,0,0,1,0,0|1,0,2]=4 1111 B9R1.6 C=C(C)c1ccccc1 271570a_100000694244_100000210277 [0,0,0,0,1,0|0,0,0]=1 1112 B9R1.6 C=C(C)c1ccccn1 271570a_100000694244_100011216584 [0,0,0,0,1,0|1,0,0]=2 1113 B9R1.6 C=C(C)c1cccnc1 271570a_100000694244_100000752921 [0,0,0,0,1,0|1,0,0]=2 1114 B9R1.6 C=C(C)c1cccnn1 271570a_100000694244_100016991348 [0,0,0,0,1,0|2,0,0]=3 1115 B9R1.6 C=C(C)c1ccncc1 271570a_100000694244_100000035832 [0,0,0,0,1,0|1,0,0]=2 1116 B9R1.6 C=C(C)c1ccncn1 271570a_100000694244_100000703185 [0,0,0,0,1,0|2,0,0]=3 1117 B9R1.6 C=C(C)c1ccnnc1 271570a_100000694244_100000732662 [0,0,0,0,1,0|2,0,0]=3 1118 B9R1.6 C=C(C)c1cnccn1 271570a_100000694244_100000758340 [0,0,0,0,1,0|2,0,0]=3 1119 B9R1.6 C=C(C)c1cncnc1 271570a_100000694244_100011206942 [0,0,0,0,1,0|2,0,0]=3 1120 B9R1.6 C=C(C)c1cnnnc1 271570a_100000694244_100009846058 [0,0,0,0,1,0|3,0,0]=4 1121 B9R1.6 C=C(C)c1ncccn1 271570a_100000694244_100000211032 [0,0,0,0,1,0|2,0,0]=3 1122 B9R1.6 CC(=O)c1ccccc1 1458a_100000185807_200000210301 [0,0,0,0,1,0|1,0,0]=2 1123 B9R1.6 CN(C)c1ccccc1 2230a_100000210012_200000210301 [0,0,0,0,1,0|1,0,1]=3 1124 B9R1.6 CN(C)c1ccccc1 269982a_100000210012_200000210301 [0,0,0,0,1,0|1,0,1]=3 1125 B9R1.6 CN(C)c1ccccc1 34a_100000210012_200000210301 [0,0,0,0,1,0|1,0,1]=3 1126 B9R1.6 CN([13CH3])c1ccccc1 2230a_100000210012_200025704644 [0,0,0,0,1,0|1,0,1]=3 1127 B9R1.6 CN([13CH3])c1ccccc1 269982a_100000210012_200025704644 [0,0,0,0,1,0|1,0,1]=3 1128 B9R1.6 CN([13CH3])c1ccccc1 34a_100000210012_200025704644 [0,0,0,0,1,0|1,0,1]=3 1129 B9R1.6 [13CH3]C(=O)c1ccccc1 1458a_100000185807_200025704644 [0,0,0,0,1,0|1,0,0]=2 1130 B9R1.13 C=C(C)CN1CC=CC1 269982a_100015195280_100000748629 [0,0,0,0,1,0|1,0,2]=4 1131 B9R1.13 CC(=Cc1ccco1)C 271570a_100102525489_100009814098 [0,0,0,0,1,0|1,0,2]=4 1132 B9R1.13 CC(=Cc1cccs1)C 271570a_100102525489_100011215356 [0,0,0,0,1,0|1,0,2]=4 1133 B9R1.13 CC(=Cc1ccoc1)C 271570a_100102525489_100011215275 [0,0,0,0,1,0|1,0,2]=4 1134 B9R1.13 CC(=Cc1ccsc1)C 271570a_100102525489_100000738268 [0,0,0,0,1,0|1,0,2]=4 1135 B9R1.13 CC(=O)Cc1c[nH]cn1 1458a_100000070787_100000707719 [0,0,0,0,1,0|3,0,0]=4 1136 B9R1.13 CC(=O)Cc1c[nH]cn1 1458a_100015291406_200000210301 [0,0,0,0,1,0|3,0,0]=4 1137 B9R1.13 CC(=O)Cc1ccc[nH]1 1458a_100000238377_200000210301 [0,0,0,0,1,0|2,0,0]=3 1138 B9R1.13 CC(=O)Cc1ccco1 1458a_100011217309_200000210301 [0,0,0,0,1,0|2,0,0]=3 1139 B9R1.13 CC(=O)Cc1cccs1 1458a_100000210189_200000210301 [0,0,0,0,1,0|2,0,0]=3 1140 B9R1.13 CC(=O)Cc1ccn[nH]1 1458a_100000070787_100000728653 [0,0,0,0,1,0|3,0,0]=4 1141 B9R1.13 CC(=O)Cc1ccn[nH]1 1458a_100000752941_200000210301 [0,0,0,0,1,0|3,0,0]=4 1142 B9R1.13 CC(=O)Cc1ccoc1 1458a_100000684892_200000210301 [0,0,0,0,1,0|2,0,0]=3 1143 B9R1.13 CC(=O)Cc1ccon1 1458a_100000070787_100000234950 [0,0,0,0,1,0|3,0,0]=4 1144 B9R1.13 CC(=O)Cc1ccsc1 1458a_100000070787_100011233845 [0,0,0,0,1,0|2,0,0]=3 1145 B9R1.13 CC(=O)Cc1ccsc1 1458a_100000184062_200000210301 [0,0,0,0,1,0|2,0,0]=3 1146 B9R1.13 CC(=O)Cc1cncs1 1458a_100000070787_100015185245 [0,0,0,0,1,0|3,0,0]=4 1147 B9R1.13 CC(=O)Cc1cscn1 1458a_100000070787_100000205941 [0,0,0,0,1,0|3,0,0]=4 1148 B9R1.13 CC(=O)Cc1cscn1 1458a_100011438297_200000210301 [0,0,0,0,1,0|3,0,0]=4 1149 B9R1.13 CC(=O)Cc1ncco1 1458a_100000070787_103436540062 [0,0,0,0,1,0|3,0,0]=4 1150 B9R1.13 CC(=O)Cc1nccs1 1458a_100000070787_100015184050 [0,0,0,0,1,0|3,0,0]=4 1151 B9R1.13 CC(=O)Cn1cccc1 1458a_100011196272_200000210301 [0,0,0,0,1,0|2,0,0]=3 1152 B9R1.13 CC(=O)Cn1cccn1 1458a_100000233772_200000210301 [0,0,0,0,1,0|3,0,0]=4 1153 B9R1.13 CC(=O)Cn1ccnc1 1458a_100000739072_200000210301 [0,0,0,0,1,0|3,0,0]=4 1154 B9R1.13 CN(C)Cc1ccco1 2230a_100000185268_200000210301 [0,0,0,0,1,0|2,0,1]=4 1155 B9R1.13 CN(C)Cc1ccco1 269982a_100000185268_200000210301 [0,0,0,0,1,0|2,0,1]=4 1156 B9R1.13 CN(C)Cc1ccco1 270004a_100102631434_100000186105 [0,0,0,0,1,0|2,0,1]=4 1157 B9R1.13 CN(C)Cc1cccs1 2230a_100000184426_200000210301 [0,0,0,0,1,0|2,0,1]=4 1158 B9R1.13 CN(C)Cc1cccs1 269982a_100000184426_200000210301 [0,0,0,0,1,0|2,0,1]=4 1159 B9R1.13 CN(C)Cc1cccs1 270004a_100102631434_100000209959 [0,0,0,0,1,0|2,0,1]=4 1160 B9R1.13 CN(C)Cc1ccoc1 270004a_100102631434_100011215517 [0,0,0,0,1,0|2,0,1]=4 1161 B9R1.13 CN(C)Cc1ccsc1 2230a_100020654213_200000210301 [0,0,0,0,1,0|2,0,1]=4 1162 B9R1.13 CN(C)Cc1ccsc1 2230a_100102631434_100011261437 [0,0,0,0,1,0|2,0,1]=4 1163 B9R1.13 CN(C)Cc1ccsc1 269982a_100020654213_200000210301 [0,0,0,0,1,0|2,0,1]=4 1164 B9R1.13 CN(C)Cc1ccsc1 269982a_100102631434_100011233845 [0,0,0,0,1,0|2,0,1]=4 1165 B9R1.13 CN(C)Cc1ccsc1 270004a_100102631434_100000188534 [0,0,0,0,1,0|2,0,1]=4 1166 B9R1.13 CN([13CH3])Cc1ccco1 2230a_100000185268_200025704644 [0,0,0,0,1,0|2,0,1]=4 1167 B9R1.13 CN([13CH3])Cc1ccco1 269982a_100000185268_200025704644 [0,0,0,0,1,0|2,0,1]=4 1168 B9R1.13 CN([13CH3])Cc1cccs1 2230a_100000184426_200025704644 [0,0,0,0,1,0|2,0,1]=4 1169 B9R1.13 CN([13CH3])Cc1cccs1 269982a_100000184426_200025704644 [0,0,0,0,1,0|2,0,1]=4 1170 B9R1.13 CN([13CH3])Cc1ccsc1 2230a_100020654213_200025704644 [0,0,0,0,1,0|2,0,1]=4 1171 B9R1.13 CN([13CH3])Cc1ccsc1 269982a_100020654213_200025704644 [0,0,0,0,1,0|2,0,1]=4 1172 B9R1.13 [13CH3]C(=O)Cc1c[nH]cn1 1458a_100015291406_200025704644 [0,0,0,0,1,0|3,0,0]=4 1173 B9R1.13 [13CH3]C(=O)Cc1ccc[nH]1 1458a_100000238377_200025704644 [0,0,0,0,1,0|2,0,0]=3 1174 B9R1.13 [13CH3]C(=O)Cc1ccco1 1458a_100011217309_200025704644 [0,0,0,0,1,0|2,0,0]=3 1175 B9R1.13 [13CH3]C(=O)Cc1cccs1 1458a_100000210189_200025704644 [0,0,0,0,1,0|2,0,0]=3 1176 B9R1.13 [13CH3]C(=O)Cc1ccn[nH]1 1458a_100000752941_200025704644 [0,0,0,0,1,0|3,0,0]=4 1177 B9R1.13 [13CH3]C(=O)Cc1ccoc1 1458a_100000684892_200025704644 [0,0,0,0,1,0|2,0,0]=3 1178 B9R1.13 [13CH3]C(=O)Cc1ccsc1 1458a_100000184062_200025704644 [0,0,0,0,1,0|2,0,0]=3 1179 B9R1.13 [13CH3]C(=O)Cc1cscn1 1458a_100011438297_200025704644 [0,0,0,0,1,0|3,0,0]=4 1180 B9R1.13 [13CH3]C(=O)Cn1cccc1 1458a_100011196272_200025704644 [0,0,0,0,1,0|2,0,0]=3 1181 B9R1.13 [13CH3]C(=O)Cn1cccn1 1458a_100000233772_200025704644 [0,0,0,0,1,0|3,0,0]=4 1182 B9R1.13 [13CH3]C(=O)Cn1ccnc1 1458a_100000739072_200025704644 [0,0,0,0,1,0|3,0,0]=4 1183 B11R1.91 C=C(C)CNc1ccccc1 34a_100000106764_100000748629 [0,0,0,0,0,1|0,0,0]=1 1184 B11R1.91 C=C(C)CNc1cccnn1 27a_100000765925_100016991348 [0,0,0,0,0,1|2,0,0]=3 1185 B11R1.91 C=C(C)CNc1ccncn1 27a_100000765925_100000703185 [0,0,0,0,0,1|2,0,0]=3 1186 B11R1.91 C=C(C)CNc1cnccn1 27a_100000765925_100000211759 [0,0,0,0,0,1|2,0,0]=3 1187 B11R1.91 C=C(C)CNc1ncccn1 27a_100000765925_100000211032 [0,0,0,0,0,1|2,0,0]=3 1188 B11R1.91 C=C(C)COc1ccccc1 34a_100000210340_100000748629 [0,0,0,0,0,1|0,0,0]=1 1189 B11R1.91 C=C(C)COc1ccccc1 7a_100000210340_100000748629 [0,0,0,0,0,1|0,0,0]=1 1190 B11R1.91 C=C(C)COc1cccnc1 34a_100000210849_100000748629 [0,0,0,0,0,1|1,0,0]=2 1191 B11R1.91 C=C(C)COc1cccnc1 7a_100000210849_100000748629 [0,0,0,0,0,1|1,0,0]=2 1192 B11R1.91 C=C(C)COc1ccncc1 34a_100000212176_100000748629 [0,0,0,0,0,1|1,0,0]=2 1193 B11R1.91 C=C(C)COc1ccnnc1 34a_100015204005_100000748629 [0,0,0,0,0,1|2,0,0]=3 1194 B11R1.91 C=C(C)COc1cncnc1 7a_100000754086_100000748629 [0,0,0,0,0,1|2,0,0]=3 1195 B11R1.91 C=C(C)CSc1ccccc1 62a_100000719477_100000211660 [0,0,0,0,0,1|0,0,0]=1 1196 B11R1.91 C=C(C)CSc1ccccc1 62a_100000748629_100000041952 [0,0,0,0,0,1|0,0,0]=1 1197 B11R1.91 C=C(C)CSc1ccccn1 62a_100000748629_100011216584 [0,0,0,0,0,1|1,0,0]=2 1198 B11R1.91 C=C(C)CSc1ccccn1 62a_100011216584_100000211660 [0,0,0,0,0,1|1,0,0]=2 1199 B11R1.91 C=C(C)CSc1cccnc1 62a_100000210063_100000211660 [0,0,0,0,0,1|1,0,0]=2 1200 B11R1.91 C=C(C)CSc1cccnc1 62a_100000748629_100000210063 [0,0,0,0,0,1|1,0,0]=2 1201 B11R1.91 C=C(C)CSc1cccnn1 62a_100000748629_100016991348 [0,0,0,0,0,1|2,0,0]=3 1202 B11R1.91 C=C(C)CSc1cccnn1 62a_100016991348_100000211660 [0,0,0,0,0,1|2,0,0]=3 1203 B11R1.91 C=C(C)CSc1ccncc1 62a_100000728582_100000211660 [0,0,0,0,0,1|1,0,0]=2 1204 B11R1.91 C=C(C)CSc1ccncc1 62a_100000748629_100000728582 [0,0,0,0,0,1|1,0,0]=2 1205 B11R1.91 C=C(C)CSc1ccncn1 62a_100000703185_100000211660 [0,0,0,0,0,1|2,0,0]=3 1206 B11R1.91 C=C(C)CSc1ccncn1 62a_100000748629_100000703185 [0,0,0,0,0,1|2,0,0]=3 1207 B11R1.91 C=C(C)CSc1ccnnc1 62a_100000732662_100000211660 [0,0,0,0,0,1|2,0,0]=3 1208 B11R1.91 C=C(C)CSc1ccnnc1 62a_100000748629_100000732662 [0,0,0,0,0,1|2,0,0]=3 1209 B11R1.91 C=C(C)CSc1cnccn1 62a_100000211759_100000211660 [0,0,0,0,0,1|2,0,0]=3 1210 B11R1.91 C=C(C)CSc1cnccn1 62a_100000748629_100000211759 [0,0,0,0,0,1|2,0,0]=3 1211 B11R1.91 C=C(C)CSc1cncnc1 62a_100000748629_100011206942 [0,0,0,0,0,1|2,0,0]=3 1212 B11R1.91 C=C(C)CSc1cncnc1 62a_100011206942_100000211660 [0,0,0,0,0,1|2,0,0]=3 1213 B11R1.91 C=C(C)CSc1cnnnc1 62a_100000748629_100009846058 [0,0,0,0,0,1|3,0,0]=4 1214 B11R1.91 C=C(C)CSc1cnnnc1 62a_100009846058_100000211660 [0,0,0,0,0,1|3,0,0]=4 1215 B11R1.91 C=C(C)CSc1ncccn1 62a_100000211032_100000211660 [0,0,0,0,0,1|2,0,0]=3 1216 B11R1.91 C=C(C)CSc1ncccn1 62a_100000748629_100000211032 [0,0,0,0,0,1|2,0,0]=3 1217 B11R1.91 C=C(F)CNc1ccccc1 34a_100000106764_100009893438 [0,0,0,0,0,1|1,0,0]=2 1218 B11R1.91 C=C(F)COc1ccccc1 34a_100000210340_100009893438 [0,0,0,0,0,1|1,0,0]=2 1219 B11R1.91 C=C(F)COc1ccccc1 7a_100000210340_100000042424 [0,0,0,0,0,1|1,0,0]=2 1220 B11R1.91 C=C(F)COc1cccnc1 34a_100000210849_100009893438 [0,0,0,0,0,1|2,0,0]=3 1221 B11R1.91 C=C(F)COc1cccnc1 7a_100000210849_100000042424 [0,0,0,0,0,1|2,0,0]=3 1222 B11R1.91 C=C(F)COc1ccncc1 34a_100000212176_100009893438 [0,0,0,0,0,1|2,0,0]=3 1223 B11R1.91 C=C(F)COc1ccnnc1 34a_100015204005_100009893438 [0,0,0,0,0,1|3,0,0]=4 1224 B11R1.91 C=C(F)COc1cncnc1 7a_100000754086_100000042424 [0,0,0,0,0,1|3,0,0]=4 1225 B11R1.91 C=C(F)CSc1ccccc1 62a_100000042424_100000041952 [0,0,0,0,0,1|1,0,0]=2 1226 B11R1.91 C=C(F)CSc1ccccc1 62a_100000719477_100000042424 [0,0,0,0,0,1|1,0,0]=2 1227 B11R1.91 C=C(F)CSc1ccccn1 62a_100000042424_100011216584 [0,0,0,0,0,1|2,0,0]=3 1228 B11R1.91 C=C(F)CSc1ccccn1 62a_100011216584_100000042424 [0,0,0,0,0,1|2,0,0]=3 1229 B11R1.91 C=C(F)CSc1cccnc1 62a_100000042424_100000210063 [0,0,0,0,0,1|2,0,0]=3 1230 B11R1.91 C=C(F)CSc1cccnc1 62a_100000210063_100000042424 [0,0,0,0,0,1|2,0,0]=3 1231 B11R1.91 C=C(F)CSc1cccnn1 62a_100000042424_100016991348 [0,0,0,0,0,1|3,0,0]=4 1232 B11R1.91 C=C(F)CSc1cccnn1 62a_100016991348_100000042424 [0,0,0,0,0,1|3,0,0]=4 1233 B11R1.91 C=C(F)CSc1ccncc1 62a_100000042424_100000728582 [0,0,0,0,0,1|2,0,0]=3 1234 B11R1.91 C=C(F)CSc1ccncc1 62a_100000728582_100000042424 [0,0,0,0,0,1|2,0,0]=3 1235 B11R1.91 C=C(F)CSc1ccncn1 62a_100000042424_100000703185 [0,0,0,0,0,1|3,0,0]=4 1236 B11R1.91 C=C(F)CSc1ccncn1 62a_100000703185_100000042424 [0,0,0,0,0,1|3,0,0]=4 1237 B11R1.91 C=C(F)CSc1ccnnc1 62a_100000042424_100000732662 [0,0,0,0,0,1|3,0,0]=4 1238 B11R1.91 C=C(F)CSc1ccnnc1 62a_100000732662_100000042424 [0,0,0,0,0,1|3,0,0]=4 1239 B11R1.91 C=C(F)CSc1cnccn1 62a_100000042424_100000211759 [0,0,0,0,0,1|3,0,0]=4 1240 B11R1.91 C=C(F)CSc1cnccn1 62a_100000211759_100000042424 [0,0,0,0,0,1|3,0,0]=4 1241 B11R1.91 C=C(F)CSc1cncnc1 62a_100000042424_100011206942 [0,0,0,0,0,1|3,0,0]=4 1242 B11R1.91 C=C(F)CSc1cncnc1 62a_100011206942_100000042424 [0,0,0,0,0,1|3,0,0]=4 1243 B11R1.91 C=C(F)CSc1ncccn1 62a_100000042424_100000211032 [0,0,0,0,0,1|3,0,0]=4 1244 B11R1.91 C=C(F)CSc1ncccn1 62a_100000211032_100000042424 [0,0,0,0,0,1|3,0,0]=4 1245 B11R1.91 CC(=O)C#Cc1ccccc1 1458a_100000736102_200000210301 [0,0,0,0,0,1|1,0,1]=3 1246 B11R1.91 CC(=O)C#Cc1ccccn1 1458a_102125277312_200000210301 [0,0,0,0,0,1|2,0,1]=4 1247 B11R1.91 CC(=O)C=Cc1ccccc1 1458a_100000210462_200000210301 [0,0,0,0,0,1|1,0,1]=3 1248 B11R1.91 CC(=O)C=Cc1ccccn1 1458a_100000740811_200000210301 [0,0,0,0,0,1|2,0,1]=4 1249 B11R1.91 CC(=O)C=Cc1cccnc1 1458a_100000735890_200000210301 [0,0,0,0,0,1|2,0,1]=4 1250 B11R1.91 CC(=O)C=Cc1ccncc1 1458a_100000682801_200000210301 [0,0,0,0,0,1|2,0,1]=4 1251 B11R1.91 CC(=O)CCc1ccccc1 1458a_100000070787_100000765856 [0,0,0,0,0,1|1,0,0]=2 1252 B11R1.91 CC(=O)CCc1ccccc1 1458a_100000185753_200000210301 [0,0,0,0,0,1|1,0,0]=2 1253 B11R1.91 CC(=O)CCc1ccccn1 1458a_100000070787_100015183660 [0,0,0,0,0,1|2,0,0]=3 1254 B11R1.91 CC(=O)CCc1ccccn1 1458a_100015195070_200000210301 [0,0,0,0,0,1|2,0,0]=3 1255 B11R1.91 CC(=O)CCc1cccnc1 1458a_100000070787_200011713674 [0,0,0,0,0,1|2,0,0]=3 1256 B11R1.91 CC(=O)CCc1cccnc1 1458a_100000198484_200000210301 [0,0,0,0,0,1|2,0,0]=3 1257 B11R1.91 CC(=O)CCc1ccncc1 1458a_100000070787_100000723409 [0,0,0,0,0,1|2,0,0]=3 1258 B11R1.91 CC(=O)CCc1ccncc1 1458a_100011225043_200000210301 [0,0,0,0,0,1|2,0,0]=3 1259 B11R1.91 CC(=O)COc1ccccc1 1458a_100000186222_200000210301 [0,0,0,0,0,1|1,0,0]=2 1260 B11R1.91 CC(=O)COc1ccccn1 1458a_100102699861_200000210301 [0,0,0,0,0,1|2,0,0]=3 1261 B11R1.91 CC(=O)COc1cccnc1 1458a_100015207166_200000210301 [0,0,0,0,0,1|2,0,0]=3 1262 B11R1.91 CC(=O)CSc1ccccc1 1458a_100000211596_200000210301 [0,0,0,0,0,1|1,0,0]=2 1263 B11R1.91 CC(=O)CSc1ccccn1 1458a_100000156281_200000210301 [0,0,0,0,0,1|2,0,0]=3 1264 B11R1.91 CC(=O)CSc1ccncc1 1458a_100000211328_200000210301 [0,0,0,0,0,1|2,0,0]=3 1265 B11R1.91 CC(=O)NCc1ccccc1 11a_100015324214_100015343762 [0,0,0,0,0,1|1,0,0]=2 1266 B11R1.91 CC(=O)NCc1ccccc1 1626a_100015324214_100015343762 [0,0,0,0,0,1|1,0,0]=2 1267 B11R1.91 CC(=O)NCc1ccccc1 240690a_100015324214_100015343762 [0,0,0,0,0,1|1,0,0]=2 1268 B11R1.91 CC(=O)NCc1ccccc1 527a_100015324214_100103153847 [0,0,0,0,0,1|1,0,0]=2 1269 B11R1.91 CC(=O)NCc1ccccn1 11a_100000210449_100015343762 [0,0,0,0,0,1|2,0,0]=3 1270 B11R1.91 CC(=O)NCc1ccccn1 1626a_100000210449_100015343762 [0,0,0,0,0,1|2,0,0]=3 1271 B11R1.91 CC(=O)NCc1ccccn1 240690a_100000210449_100015343762 [0,0,0,0,0,1|2,0,0]=3 1272 B11R1.91 CC(=O)NCc1ccccn1 527a_100000210449_100103153847 [0,0,0,0,0,1|2,0,0]=3 1273 B11R1.91 CC(=O)NCc1cccnc1 11a_100000210453_100015343762 [0,0,0,0,0,1|2,0,0]=3 1274 B11R1.91 CC(=O)NCc1cccnc1 240690a_100000210453_100015343762 [0,0,0,0,0,1|2,0,0]=3 1275 B11R1.91 CC(=O)NCc1cccnc1 527a_100000210453_100103153847 [0,0,0,0,0,1|2,0,0]=3 1276 B11R1.91 CC(=O)NCc1cccnn1 11a_100159270163_100015343762 [0,0,0,0,0,1|3,0,0]=4 1277 B11R1.91 CC(=O)NCc1cccnn1 240690a_100159270163_100015343762 [0,0,0,0,0,1|3,0,0]=4 1278 B11R1.91 CC(=O)NCc1cccnn1 527a_100159270163_100103153847 [0,0,0,0,0,1|3,0,0]=4 1279 B11R1.91 CC(=O)NCc1ccncc1 11a_100000210450_100015343762 [0,0,0,0,0,1|2,0,0]=3 1280 B11R1.91 CC(=O)NCc1ccncc1 1626a_100000210450_100015343762 [0,0,0,0,0,1|2,0,0]=3 1281 B11R1.91 CC(=O)NCc1ccncc1 240690a_100000210450_100015343762 [0,0,0,0,0,1|2,0,0]=3 1282 B11R1.91 CC(=O)NCc1ccncc1 527a_100000210450_100103153847 [0,0,0,0,0,1|2,0,0]=3 1283 B11R1.91 CC(=O)NCc1ccncn1 11a_100000736019_100015343762 [0,0,0,0,0,1|3,0,0]=4 1284 B11R1.91 CC(=O)NCc1ccncn1 240690a_100000736019_100015343762 [0,0,0,0,0,1|3,0,0]=4 1285 B11R1.91 CC(=O)NCc1ccncn1 527a_100000736019_100103153847 [0,0,0,0,0,1|3,0,0]=4 1286 B11R1.91 CC(=O)NCc1cnccn1 11a_100000737960_100015343762 [0,0,0,0,0,1|3,0,0]=4 1287 B11R1.91 CC(=O)NCc1cnccn1 240690a_100000737960_100015343762 [0,0,0,0,0,1|3,0,0]=4 1288 B11R1.91 CC(=O)NCc1cnccn1 527a_100000737960_100103153847 [0,0,0,0,0,1|3,0,0]=4 1289 B11R1.91 CC(=O)NCc1cncnc1 11a_100011243677_100015343762 [0,0,0,0,0,1|3,0,0]=4 1290 B11R1.91 CC(=O)NCc1cncnc1 240690a_100011243677_100015343762 [0,0,0,0,0,1|3,0,0]=4 1291 B11R1.91 CC(=O)NCc1cncnc1 527a_100011243677_100103153847 [0,0,0,0,0,1|3,0,0]=4 1292 B11R1.91 CC(=O)NCc1ncccn1 11a_100015189908_100015343762 [0,0,0,0,0,1|3,0,0]=4 1293 B11R1.91 CC(=O)NCc1ncccn1 240690a_100015189908_100015343762 [0,0,0,0,0,1|3,0,0]=4 1294 B11R1.91 CC(=O)NCc1ncccn1 527a_100015189908_100103153847 [0,0,0,0,0,1|3,0,0]=4 1295 B11R1.91 CC(=O)NNc1ccccc1 22a_100015195140_100000070787 [0,0,0,0,0,1|2,0,0]=3 1296 B11R1.91 CC(=O)NNc1ccccn1 22a_100000183288_100000070787 [0,0,0,0,0,1|3,0,0]=4 1297 B11R1.91 CC(=O)NNc1cccnc1 22a_100000728903_100000070787 [0,0,0,0,0,1|3,0,0]=4 1298 B11R1.91 CC(=O)NNc1ccncc1 22a_100000698918_100000070787 [0,0,0,0,0,1|3,0,0]=4 1299 B11R1.91 CC(C)C=Cc1ccccc1 271570a_100016257149_100000210277 [0,0,0,0,0,1|0,0,3]=4 1300 B11R1.91 CC(C)CNc1ccccc1 34a_100000106764_100000210624 [0,0,0,0,0,1|0,0,2]=3 1301 B11R1.91 CC(C)COc1ccccc1 34a_100000210340_100000210624 [0,0,0,0,0,1|0,0,2]=3 1302 B11R1.91 CC(C)COc1ccccc1 7a_100000210340_100000210760 [0,0,0,0,0,1|0,0,2]=3 1303 B11R1.91 CC(C)COc1cccnc1 34a_100000210849_100000210624 [0,0,0,0,0,1|1,0,2]=4 1304 B11R1.91 CC(C)COc1cccnc1 7a_100000210849_100000210760 [0,0,0,0,0,1|1,0,2]=4 1305 B11R1.91 CC(C)COc1ccncc1 34a_100000212176_100000210624 [0,0,0,0,0,1|1,0,2]=4 1306 B11R1.91 CC(C)CSc1ccccc1 62a_100000210624_100000041952 [0,0,0,0,0,1|0,0,2]=3 1307 B11R1.91 CC(C)CSc1ccccc1 62a_100000719477_100000210760 [0,0,0,0,0,1|0,0,2]=3 1308 B11R1.91 CC(C)CSc1ccccn1 62a_100000210624_100011216584 [0,0,0,0,0,1|1,0,2]=4 1309 B11R1.91 CC(C)CSc1ccccn1 62a_100011216584_100000210760 [0,0,0,0,0,1|1,0,2]=4 1310 B11R1.91 CC(C)CSc1cccnc1 62a_100000210063_100000210760 [0,0,0,0,0,1|1,0,2]=4 1311 B11R1.91 CC(C)CSc1cccnc1 62a_100000210624_100000210063 [0,0,0,0,0,1|1,0,2]=4 1312 B11R1.91 CC(C)CSc1ccncc1 62a_100000210624_100000728582 [0,0,0,0,0,1|1,0,2]=4 1313 B11R1.91 CC(C)CSc1ccncc1 62a_100000728582_100000210760 [0,0,0,0,0,1|1,0,2]=4 1314 B11R1.91 CC(C)NCc1ccccc1 207a_100138425928_100015611070 [0,0,0,0,0,1|0,0,2]=3 1315 B11R1.91 CC(C)NCc1ccccc1 2230a_100015324214_100000210206 [0,0,0,0,0,1|0,0,2]=3 1316 B11R1.91 CC(C)NCc1ccccc1 2230a_100138425928_100015291786 [0,0,0,0,0,1|0,0,2]=3 1317 B11R1.91 CC(C)NCc1ccccc1 34a_100015324214_100000210206 [0,0,0,0,0,1|0,0,2]=3 1318 B11R1.91 CC(C)NCc1ccccc1 34a_100138425928_100015291786 [0,0,0,0,0,1|0,0,2]=3 1319 B11R1.91 CC(C)NCc1ccccn1 207a_100138425928_100000209966 [0,0,0,0,0,1|1,0,2]=4 1320 B11R1.91 CC(C)NCc1ccccn1 2230a_100138425928_100000721315 [0,0,0,0,0,1|1,0,2]=4 1321 B11R1.91 CC(C)NCc1ccccn1 34a_100138425928_100000721315 [0,0,0,0,0,1|1,0,2]=4 1322 B11R1.91 CC(C)NCc1cccnc1 207a_100138425928_100000209961 [0,0,0,0,0,1|1,0,2]=4 1323 B11R1.91 CC(C)NCc1cccnc1 2230a_100138425928_100000741622 [0,0,0,0,0,1|1,0,2]=4 1324 B11R1.91 CC(C)NCc1cccnc1 34a_100138425928_100000733263 [0,0,0,0,0,1|1,0,2]=4 1325 B11R1.91 CC(C)NCc1ccncc1 207a_100138425928_100000186114 [0,0,0,0,0,1|1,0,2]=4 1326 B11R1.91 CC(C)NCc1ccncc1 2230a_100138425928_100015193705 [0,0,0,0,0,1|1,0,2]=4 1327 B11R1.91 CC(C)OCc1ccccc1 34a_100000210790_100000210206 [0,0,0,0,0,1|0,0,2]=3 1328 B11R1.91 CC(C)OCc1ccccc1 34a_100000212225_100015291786 [0,0,0,0,0,1|0,0,2]=3 1329 B11R1.91 CC(C)OCc1ccccc1 7a_100000210790_100000210206 [0,0,0,0,0,1|0,0,2]=3 1330 B11R1.91 CC(C)OCc1ccccn1 34a_100000212225_100000721315 [0,0,0,0,0,1|1,0,2]=4 1331 B11R1.91 CC(C)OCc1cccnc1 34a_100000212225_100000733263 [0,0,0,0,0,1|1,0,2]=4 1332 B11R1.91 CC(C)SCc1ccccc1 62a_100000210206_100015291786 [0,0,0,0,0,1|0,0,2]=3 1333 B11R1.91 CC(C)SCc1ccccc1 62a_100000211182_100000210206 [0,0,0,0,0,1|0,0,2]=3 1334 B11R1.91 CC(C)SCc1ccccn1 62a_100000210206_100000721315 [0,0,0,0,0,1|1,0,2]=4 1335 B11R1.91 CC(C)SCc1ccccn1 62a_100000721315_100000210206 [0,0,0,0,0,1|1,0,2]=4 1336 B11R1.91 CC(C)SCc1cccnc1 62a_100000210206_100000741622 [0,0,0,0,0,1|1,0,2]=4 1337 B11R1.91 CC(C)SCc1cccnc1 62a_100000741622_100000210206 [0,0,0,0,0,1|1,0,2]=4 1338 B11R1.91 CC(C)SCc1ccncc1 62a_100000210206_100015193705 [0,0,0,0,0,1|1,0,2]=4 1339 B11R1.91 CC(C)SCc1ccncc1 62a_100015193705_100000210206 [0,0,0,0,0,1|1,0,2]=4 1340 B11R1.91 CC(O)C=Cc1ccccc1 271570a_200011019289_100000210277 [0,0,0,0,0,1|1,0,2]=4 1341 B11R1.91 CC(O)CNc1ccccc1 34a_100000106764_100011218427 [0,0,0,0,0,1|1,0,1]=3 1342 B11R1.91 CC(O)COc1ccccc1 34a_100000210340_100011218427 [0,0,0,0,0,1|1,0,1]=3 1343 B11R1.91 CC(O)COc1ccccc1 7a_100000210340_100011218427 [0,0,0,0,0,1|1,0,1]=3 1344 B11R1.91 CC(O)COc1cccnc1 34a_100000210849_100011218427 [0,0,0,0,0,1|2,0,1]=4 1345 B11R1.91 CC(O)COc1cccnc1 7a_100000210849_100011218427 [0,0,0,0,0,1|2,0,1]=4 1346 B11R1.91 CC(O)COc1ccncc1 34a_100000212176_100011218427 [0,0,0,0,0,1|2,0,1]=4 1347 B11R1.91 CC(O)CSc1ccccc1 62a_100000719477_100011218427 [0,0,0,0,0,1|1,0,1]=3 1348 B11R1.91 CC(O)CSc1ccccc1 62a_100011218427_100000041952 [0,0,0,0,0,1|1,0,1]=3 1349 B11R1.91 CC(O)CSc1ccccn1 62a_100011216584_100011218427 [0,0,0,0,0,1|2,0,1]=4 1350 B11R1.91 CC(O)CSc1ccccn1 62a_100011218427_100011216584 [0,0,0,0,0,1|2,0,1]=4 1351 B11R1.91 CC(O)CSc1cccnc1 62a_100000210063_100011218427 [0,0,0,0,0,1|2,0,1]=4 1352 B11R1.91 CC(O)CSc1cccnc1 62a_100011218427_100000210063 [0,0,0,0,0,1|2,0,1]=4 1353 B11R1.91 CC(O)CSc1ccncc1 62a_100000728582_100011218427 [0,0,0,0,0,1|2,0,1]=4 1354 B11R1.91 CC(O)CSc1ccncc1 62a_100011218427_100000728582 [0,0,0,0,0,1|2,0,1]=4 1355 B11R1.91 CN(C)CCc1ccccc1 2230a_100000207497_200000210301 [0,0,0,0,0,1|1,0,1]=3 1356 B11R1.91 CN(C)CCc1ccccc1 2230a_100102631434_100000765856 [0,0,0,0,0,1|1,0,1]=3 1357 B11R1.91 CN(C)CCc1ccccc1 269982a_100000207497_200000210301 [0,0,0,0,0,1|1,0,1]=3 1358 B11R1.91 CN(C)CCc1ccccc1 269982a_100102631434_100000765856 [0,0,0,0,0,1|1,0,1]=3 1359 B11R1.91 CN(C)CCc1ccccn1 2230a_100000737206_200000210301 [0,0,0,0,0,1|2,0,1]=4 1360 B11R1.91 CN(C)CCc1ccccn1 2230a_100102631434_100015183660 [0,0,0,0,0,1|2,0,1]=4 1361 B11R1.91 CN(C)CCc1ccccn1 269982a_100000737206_200000210301 [0,0,0,0,0,1|2,0,1]=4 1362 B11R1.91 CN(C)CCc1ccccn1 269982a_100102631434_100015183660 [0,0,0,0,0,1|2,0,1]=4 1363 B11R1.91 CN(C)CCc1cccnc1 2230a_100000763209_200000210301 [0,0,0,0,0,1|2,0,1]=4 1364 B11R1.91 CN(C)CCc1cccnc1 2230a_100102631434_200011713674 [0,0,0,0,0,1|2,0,1]=4 1365 B11R1.91 CN(C)CCc1cccnc1 269982a_100000763209_200000210301 [0,0,0,0,0,1|2,0,1]=4 1366 B11R1.91 CN(C)CCc1cccnc1 269982a_100102631434_200011713674 [0,0,0,0,0,1|2,0,1]=4 1367 B11R1.91 CN(C)CCc1ccncc1 2230a_100000742850_200000210301 [0,0,0,0,0,1|2,0,1]=4 1368 B11R1.91 CN(C)CCc1ccncc1 2230a_100102631434_100000723409 [0,0,0,0,0,1|2,0,1]=4 1369 B11R1.91 CN(C)CCc1ccncc1 269982a_100000742850_200000210301 [0,0,0,0,0,1|2,0,1]=4 1370 B11R1.91 CN(C)CCc1ccncc1 269982a_100102631434_100000723409 [0,0,0,0,0,1|2,0,1]=4 1371 B11R1.91 CN(C)CSc1ccccc1 2230a_100102631434_100011218342 [0,0,0,0,0,1|1,0,1]=3 1372 B11R1.91 CN(C)CSc1ccccc1 269982a_100102631434_100011218342 [0,0,0,0,0,1|1,0,1]=3 1373 B11R1.91 CN([13CH3])CCc1ccccc1 2230a_100000207497_200025704644 [0,0,0,0,0,1|1,0,1]=3 1374 B11R1.91 CN([13CH3])CCc1ccccc1 269982a_100000207497_200025704644 [0,0,0,0,0,1|1,0,1]=3 1375 B11R1.91 CN([13CH3])CCc1ccccn1 2230a_100000737206_200025704644 [0,0,0,0,0,1|2,0,1]=4 1376 B11R1.91 CN([13CH3])CCc1ccccn1 269982a_100000737206_200025704644 [0,0,0,0,0,1|2,0,1]=4 1377 B11R1.91 CN([13CH3])CCc1cccnc1 2230a_100000763209_200025704644 [0,0,0,0,0,1|2,0,1]=4 1378 B11R1.91 CN([13CH3])CCc1cccnc1 269982a_100000763209_200025704644 [0,0,0,0,0,1|2,0,1]=4 1379 B11R1.91 CN([13CH3])CCc1ccncc1 2230a_100000742850_200025704644 [0,0,0,0,0,1|2,0,1]=4 1380 B11R1.91 CN([13CH3])CCc1ccncc1 269982a_100000742850_200025704644 [0,0,0,0,0,1|2,0,1]=4 1381 B11R1.91 C[C@@H](O)CNc1ccccc1 34a_100000106764_100009817552 [0,0,0,0,0,1|1,0,1]=3 1382 B11R1.91 C[C@@H](O)COc1ccccc1 34a_100000210340_100009817552 [0,0,0,0,0,1|1,0,1]=3 1383 B11R1.91 C[C@@H](O)COc1ccccc1 7a_100000210340_100009817552 [0,0,0,0,0,1|1,0,1]=3 1384 B11R1.91 C[C@@H](O)COc1cccnc1 34a_100000210849_100009817552 [0,0,0,0,0,1|2,0,1]=4 1385 B11R1.91 C[C@@H](O)COc1cccnc1 7a_100000210849_100009817552 [0,0,0,0,0,1|2,0,1]=4 1386 B11R1.91 C[C@@H](O)COc1ccncc1 34a_100000212176_100009817552 [0,0,0,0,0,1|2,0,1]=4 1387 B11R1.91 C[C@@H](O)CSc1ccccc1 62a_100000719477_100009817552 [0,0,0,0,0,1|1,0,1]=3 1388 B11R1.91 C[C@@H](O)CSc1ccccc1 62a_100009817552_100000041952 [0,0,0,0,0,1|1,0,1]=3 1389 B11R1.91 C[C@@H](O)CSc1ccccn1 62a_100009817552_100011216584 [0,0,0,0,0,1|2,0,1]=4 1390 B11R1.91 C[C@@H](O)CSc1ccccn1 62a_100011216584_100009817552 [0,0,0,0,0,1|2,0,1]=4 1391 B11R1.91 C[C@@H](O)CSc1cccnc1 62a_100000210063_100009817552 [0,0,0,0,0,1|2,0,1]=4 1392 B11R1.91 C[C@@H](O)CSc1cccnc1 62a_100009817552_100000210063 [0,0,0,0,0,1|2,0,1]=4 1393 B11R1.91 C[C@@H](O)CSc1ccncc1 62a_100000728582_100009817552 [0,0,0,0,0,1|2,0,1]=4 1394 B11R1.91 C[C@@H](O)CSc1ccncc1 62a_100009817552_100000728582 [0,0,0,0,0,1|2,0,1]=4 1395 B11R1.91 FC(F)CNc1ccccc1 34a_100000106764_100011934356 [0,0,0,0,0,1|2,0,1]=4 1396 B11R1.91 FC(F)COc1ccccc1 34a_100000210340_100011934356 [0,0,0,0,0,1|2,0,1]=4 1397 B11R1.91 FC(F)COc1ccccc1 7a_100000210340_100011934356 [0,0,0,0,0,1|2,0,1]=4 1398 B11R1.91 FC(F)CSc1ccccc1 62a_100000719477_100011934356 [0,0,0,0,0,1|2,0,1]=4 1399 B11R1.91 FC(F)CSc1ccccc1 62a_100011934356_100000041952 [0,0,0,0,0,1|2,0,1]=4 1400 B11R1.91 NC(=O)CNc1ccccc1 34a_100000106764_100000187820 [0,0,0,0,0,1|2,0,0]=3 1401 B11R1.91 NC(=O)COc1ccccc1 34a_100000210340_100000187820 [0,0,0,0,0,1|2,0,0]=3 1402 B11R1.91 NC(=O)COc1ccccc1 7a_100000210340_100000187820 [0,0,0,0,0,1|2,0,0]=3 1403 B11R1.91 NC(=O)COc1cccnc1 34a_100000210849_100000187820 [0,0,0,0,0,1|3,0,0]=4 1404 B11R1.91 NC(=O)COc1cccnc1 7a_100000210849_100000187820 [0,0,0,0,0,1|3,0,0]=4 1405 B11R1.91 NC(=O)COc1ccncc1 34a_100000212176_100000187820 [0,0,0,0,0,1|3,0,0]=4 1406 B11R1.91 NC(=O)CSc1ccccc1 62a_100000719477_100000747473 [0,0,0,0,0,1|2,0,0]=3 1407 B11R1.91 NC(=O)CSc1ccccc1 62a_100000747473_100000041952 [0,0,0,0,0,1|2,0,0]=3 1408 B11R1.91 NC(=O)CSc1ccccn1 62a_100000747473_100011216584 [0,0,0,0,0,1|3,0,0]=4 1409 B11R1.91 NC(=O)CSc1ccccn1 62a_100011216584_100000747473 [0,0,0,0,0,1|3,0,0]=4 1410 B11R1.91 NC(=O)CSc1cccnc1 62a_100000210063_100000747473 [0,0,0,0,0,1|3,0,0]=4 1411 B11R1.91 NC(=O)CSc1cccnc1 62a_100000747473_100000210063 [0,0,0,0,0,1|3,0,0]=4 1412 B11R1.91 NC(=O)CSc1ccncc1 62a_100000728582_100000747473 [0,0,0,0,0,1|3,0,0]=4 1413 B11R1.91 NC(=O)CSc1ccncc1 62a_100000747473_100000728582 [0,0,0,0,0,1|3,0,0]=4 1414 B11R1.91 O=C([O-])CNc1ccccc1 34a_100000106764_100020667443 [0,0,0,0,0,1|2,0,0]=3 1415 B11R1.91 O=C([O-])COc1ccccc1 34a_100000210340_100020667443 [0,0,0,0,0,1|2,0,0]=3 1416 B11R1.91 O=C([O-])COc1cccnc1 34a_100000210849_100020667443 [0,0,0,0,0,1|3,0,0]=4 1417 B11R1.91 O=C([O-])COc1ccncc1 34a_100000212176_100020667443 [0,0,0,0,0,1|3,0,0]=4 1418 B11R1.91 O=C([O-])CSc1ccccc1 62a_100000719477_100020667443 [0,0,0,0,0,1|2,0,0]=3 1419 B11R1.91 O=C([O-])CSc1ccccc1 62a_100020667443_100000041952 [0,0,0,0,0,1|2,0,0]=3 1420 B11R1.91 O=C([O-])CSc1ccccn1 62a_100011216584_100020667443 [0,0,0,0,0,1|3,0,0]=4 1421 B11R1.91 O=C([O-])CSc1ccccn1 62a_100020667443_100011216584 [0,0,0,0,0,1|3,0,0]=4 1422 B11R1.91 O=C([O-])CSc1cccnc1 62a_100000210063_100020667443 [0,0,0,0,0,1|3,0,0]=4 1423 B11R1.91 O=C([O-])CSc1cccnc1 62a_100020667443_100000210063 [0,0,0,0,0,1|3,0,0]=4 1424 B11R1.91 O=C([O-])CSc1ccncc1 62a_100000728582_100020667443 [0,0,0,0,0,1|3,0,0]=4 1425 B11R1.91 O=C([O-])CSc1ccncc1 62a_100020667443_100000728582 [0,0,0,0,0,1|3,0,0]=4 1426 B11R1.91 O=[N+]([O-])CNc1ccccc1 34a_100000106764_100000761209 [0,0,0,0,0,1|3,0,0]=4 1427 B11R1.91 O=[N+]([O-])COc1ccccc1 34a_100000210340_100000761209 [0,0,0,0,0,1|3,0,0]=4 1428 B11R1.91 O=[N+]([O-])CSc1ccccc1 62a_100000719477_100000761209 [0,0,0,0,0,1|3,0,0]=4 1429 B11R1.91 [13CH3]C(=O)C#Cc1ccccc1 1458a_100000736102_200025704644 [0,0,0,0,0,1|1,0,1]=3 1430 B11R1.91 [13CH3]C(=O)C#Cc1ccccn1 1458a_102125277312_200025704644 [0,0,0,0,0,1|2,0,1]=4 1431 B11R1.91 [13CH3]C(=O)C=Cc1ccccc1 1458a_100000210462_200025704644 [0,0,0,0,0,1|1,0,1]=3 1432 B11R1.91 [13CH3]C(=O)C=Cc1ccccn1 1458a_100000740811_200025704644 [0,0,0,0,0,1|2,0,1]=4 1433 B11R1.91 [13CH3]C(=O)C=Cc1cccnc1 1458a_100000735890_200025704644 [0,0,0,0,0,1|2,0,1]=4 1434 B11R1.91 [13CH3]C(=O)C=Cc1ccncc1 1458a_100000682801_200025704644 [0,0,0,0,0,1|2,0,1]=4 1435 B11R1.91 [13CH3]C(=O)CCc1ccccc1 1458a_100000185753_200025704644 [0,0,0,0,0,1|1,0,0]=2 1436 B11R1.91 [13CH3]C(=O)CCc1ccccn1 1458a_100015195070_200025704644 [0,0,0,0,0,1|2,0,0]=3 1437 B11R1.91 [13CH3]C(=O)CCc1cccnc1 1458a_100000198484_200025704644 [0,0,0,0,0,1|2,0,0]=3 1438 B11R1.91 [13CH3]C(=O)CCc1ccncc1 1458a_100011225043_200025704644 [0,0,0,0,0,1|2,0,0]=3 1439 B11R1.91 [13CH3]C(=O)COc1ccccc1 1458a_100000186222_200025704644 [0,0,0,0,0,1|1,0,0]=2 1440 B11R1.91 [13CH3]C(=O)COc1ccccn1 1458a_100102699861_200025704644 [0,0,0,0,0,1|2,0,0]=3 1441 B11R1.91 [13CH3]C(=O)COc1cccnc1 1458a_100015207166_200025704644 [0,0,0,0,0,1|2,0,0]=3 1442 B11R1.91 [13CH3]C(=O)CSc1ccccc1 1458a_100000211596_200025704644 [0,0,0,0,0,1|1,0,0]=2 1443 B11R1.91 [13CH3]C(=O)CSc1ccccn1 1458a_100000156281_200025704644 [0,0,0,0,0,1|2,0,0]=3 1444 B11R1.91 [13CH3]C(=O)CSc1ccncc1 1458a_100000211328_200025704644 [0,0,0,0,0,1|2,0,0]=3 1445 B8R0.1 C=CC=CC(=O)CC=C 1458a_100016291481_100000210623 [1,0,1,0,0,0|1,0,0]=3 1446 B8R0.1 C=CC=CC(=O)CCC 1458a_100016291481_100000210303 [1,0,1,0,0,0|1,0,1]=4 1447 B8R0.5 C=C(C)CC(=O)C=CBr 1458a_100016273825_100000748629 [1,0,1,0,0,0|2,0,0]=4 1448 B8R0.5 C=C(C)CC(=O)C=CC 1458a_100000210699_100000748629 [1,0,1,0,0,0|1,0,1]=4 1449 B8R0.5 C=C(C)CC(=O)C=CCl 1458a_200016279998_100000748629 [1,0,1,0,0,0|2,0,0]=4 1450 B8R0.5 C=C(C)CC(=O)C=CI 1458a_100016256311_100000748629 [1,0,1,0,0,0|2,0,0]=4 1451 B8R0.5 C=CCC(=O)CC(=C)C 1458a_100000210193_100000748629 [1,0,1,0,0,0|1,0,1]=4 1452 B8R1.2 C=Cc1ccccc1 271570a_100011290941_100000210277 [2,0,0,0,0,0|0,0,0]=2 1453 B8R1.2 C=Cc1ccccn1 271570a_100011290941_100011216584 [2,0,0,0,0,0|1,0,0]=3 1454 B8R1.2 C=Cc1cccnc1 271570a_100011290941_100000752921 [2,0,0,0,0,0|1,0,0]=3 1455 B8R1.2 C=Cc1cccnn1 271570a_100011290941_100016991348 [2,0,0,0,0,0|2,0,0]=4 1456 B8R1.2 C=Cc1ccncc1 271570a_100011290941_100000035832 [2,0,0,0,0,0|1,0,0]=3 1457 B8R1.2 C=Cc1ccncn1 271570a_100011290941_100000703185 [2,0,0,0,0,0|2,0,0]=4 1458 B8R1.2 C=Cc1ccnnc1 271570a_100011290941_100000732662 [2,0,0,0,0,0|2,0,0]=4 1459 B8R1.2 C=Cc1cnccn1 271570a_100011290941_100000758340 [2,0,0,0,0,0|2,0,0]=4 1460 B8R1.2 C=Cc1cncnc1 271570a_100011290941_100011206942 [2,0,0,0,0,0|2,0,0]=4 1461 B8R1.2 C=Cc1ncccn1 271570a_100011290941_100000211032 [2,0,0,0,0,0|2,0,0]=4 1462 B8R1.2 CNc1ccccc1 34a_100000106764_200000210301 [2,0,0,0,0,0|1,0,0]=3 1463 B8R1.2 COc1ccccc1 34a_100000210340_200000210301 [2,0,0,0,0,0|1,0,0]=3 1464 B8R1.2 COc1ccccc1 7a_100000210340_200000210301 [2,0,0,0,0,0|1,0,0]=3 1465 B8R1.2 COc1cccnc1 34a_100000210849_200000210301 [2,0,0,0,0,0|2,0,0]=4 1466 B8R1.2 COc1cccnc1 7a_100000210849_200000210301 [2,0,0,0,0,0|2,0,0]=4 1467 B8R1.2 COc1ccncc1 34a_100000212176_200000210301 [2,0,0,0,0,0|2,0,0]=4 1468 B8R1.2 CSc1ccccc1 62a_100000719477_200000210301 [2,0,0,0,0,0|1,0,0]=3 1469 B8R1.2 CSc1ccccc1 62a_200000210301_100000041952 [2,0,0,0,0,0|1,0,0]=3 1470 B8R1.2 CSc1ccccn1 62a_100011216584_200000210301 [2,0,0,0,0,0|2,0,0]=4 1471 B8R1.2 CSc1ccccn1 62a_200000210301_100011216584 [2,0,0,0,0,0|2,0,0]=4 1472 B8R1.2 CSc1cccnc1 62a_100000210063_200000210301 [2,0,0,0,0,0|2,0,0]=4 1473 B8R1.2 CSc1cccnc1 62a_200000210301_100000210063 [2,0,0,0,0,0|2,0,0]=4 1474 B8R1.2 CSc1ccncc1 62a_100000728582_200000210301 [2,0,0,0,0,0|2,0,0]=4 1475 B8R1.2 CSc1ccncc1 62a_200000210301_100000728582 [2,0,0,0,0,0|2,0,0]=4 1476 B8R1.2 [13CH3]Nc1ccccc1 34a_100000106764_200025704644 [2,0,0,0,0,0|1,0,0]=3 1477 B8R1.2 [13CH3]Oc1ccccc1 34a_100000210340_200025704644 [2,0,0,0,0,0|1,0,0]=3 1478 B8R1.2 [13CH3]Oc1ccccc1 7a_100000210340_200025704644 [2,0,0,0,0,0|1,0,0]=3 1479 B8R1.2 [13CH3]Oc1cccnc1 34a_100000210849_200025704644 [2,0,0,0,0,0|2,0,0]=4 1480 B8R1.2 [13CH3]Oc1cccnc1 7a_100000210849_200025704644 [2,0,0,0,0,0|2,0,0]=4 1481 B8R1.2 [13CH3]Oc1ccncc1 34a_100000212176_200025704644 [2,0,0,0,0,0|2,0,0]=4 1482 B8R1.2 [13CH3]Sc1ccccc1 62a_100000719477_200025704644 [2,0,0,0,0,0|1,0,0]=3 1483 B8R1.2 [13CH3]Sc1ccccc1 62a_200025704644_100000041952 [2,0,0,0,0,0|1,0,0]=3 1484 B8R1.2 [13CH3]Sc1ccccn1 62a_100011216584_200025704644 [2,0,0,0,0,0|2,0,0]=4 1485 B8R1.2 [13CH3]Sc1ccccn1 62a_200025704644_100011216584 [2,0,0,0,0,0|2,0,0]=4 1486 B8R1.2 [13CH3]Sc1cccnc1 62a_100000210063_200025704644 [2,0,0,0,0,0|2,0,0]=4 1487 B8R1.2 [13CH3]Sc1cccnc1 62a_200025704644_100000210063 [2,0,0,0,0,0|2,0,0]=4 1488 B8R1.2 [13CH3]Sc1ccncc1 62a_100000728582_200025704644 [2,0,0,0,0,0|2,0,0]=4 1489 B8R1.2 [13CH3]Sc1ccncc1 62a_200025704644_100000728582 [2,0,0,0,0,0|2,0,0]=4 1490 B10R0.4 C=C(C)COC/C=C/C=C/C 34a_100016283227_100000748629 [0,1,1,0,0,0|0,0,2]=4 1491 B10R0.6 C=C(C)CC(=O)C=C/C=C/C 1458a_100000185730_100000748629 [0,1,1,0,0,0|0,0,1]=3 1492 B10R0.6 C=C(F)CC(=O)C=C/C=C/C 1458a_100000185730_100009893438 [0,1,1,0,0,0|1,0,1]=4 1493 B10R0.78 C=CC=CC(=O)CCC(=C)C 1458a_100016291481_100000730704 [0,1,1,0,0,0|0,0,1]=3 1494 B10R0.78 C=CC=CC(=O)NCC(=C)C 1626a_100000765925_100016291481 [0,1,1,0,0,0|1,0,0]=3 1495 B10R0.18 C=CC=CC(=O)CC(=C)C#N 1458a_100016291481_100000694840 [0,1,1,0,0,0|1,0,1]=4 1496 B10R0.18 C=CC=CC(=O)CC(=O)CC 1458a_100016291481_100000747405 [0,1,1,0,0,0|2,0,0]=4 1497 B10R0.18 C=CC=CC(=O)CC(=O)NC 1458a_100016291481_100000183359 [0,1,1,0,0,0|2,0,0]=4 1498 B10R0.18 C=CC=CC(=O)CC(=O)OC 1458a_100016291481_100000747449 [0,1,1,0,0,0|2,0,0]=4 1499 B10R0.81 C=CC=CC(=O)C(C)C(=O)C 1458a_100016291481_100000179758 [0,1,1,0,0,0|2,0,0]=4 1500 B10R0.79 C=CCN(CC=C)CC(=C)C 2230a_100000210471_100000748629 [0,1,1,0,0,0|1,0,1]=4 1501 B10R0.79 C=CCN(CC=C)CC(=C)C 269982a_100000210471_100000748629 [0,1,1,0,0,0|1,0,1]=4 1502 B10R1.1 C/C=C/c1ccc(cc1)O 271570a_203496583355_100016259036 [1,1,0,0,0,0|0,0,1]=3 1503 B10R1.1 C=C=Cc1ccc(cc1)Br 271570a_100015277604_100000752885 [1,1,0,0,0,0|0,0,2]=4 1504 B10R1.1 C=C=Cc1ccc(cc1)C 271570a_100015277604_100000186775 [1,1,0,0,0,0|0,0,2]=4 1505 B10R1.1 C=C=Cc1ccc(cc1)Cl 271570a_100015277604_100000755918 [1,1,0,0,0,0|0,0,2]=4 1506 B10R1.1 C=C=Cc1ccc(cc1)F 271570a_100015277604_100000211213 [1,1,0,0,0,0|0,0,2]=4 1507 B10R1.1 C=C=Cc1ccc(cc1)N 271570a_100015277604_100000185761 [1,1,0,0,0,0|0,0,2]=4 1508 B10R1.1 C=C=Cc1ccc(cc1)O 271570a_100015277604_100000185759 [1,1,0,0,0,0|0,0,2]=4 1509 B10R1.1 CC=Cc1cc[n+](cc1)[O-] 271570a_100016259895_100000039755 [1,1,0,0,0,0|1,0,1]=4 1510 B10R1.1 CC=Cc1ccc(=O)[nH]c1 271570a_100016259895_100000212171 [1,1,0,0,0,0|1,0,1]=4 1511 B10R1.1 CC=Cc1ccc(cc1)Br 271570a_100016259895_100000752885 [1,1,0,0,0,0|0,0,1]=3 1512 B10R1.1 CC=Cc1ccc(cc1)C 271570a_100016259895_100000186775 [1,1,0,0,0,0|0,0,1]=3 1513 B10R1.1 CC=Cc1ccc(cc1)Cl 271570a_100016259895_100000755918 [1,1,0,0,0,0|0,0,1]=3 1514 B10R1.1 CC=Cc1ccc(cc1)F 271570a_100016259895_100000211213 [1,1,0,0,0,0|0,0,1]=3 1515 B10R1.1 CC=Cc1ccc(cc1)N 271570a_100016259895_100000185761 [1,1,0,0,0,0|0,0,1]=3 1516 B10R1.1 CC=Cc1ccc(cc1)O 271570a_100016259895_100000185759 [1,1,0,0,0,0|0,0,1]=3 1517 B10R1.1 CC=Cc1ccc(cn1)Br 271570a_100016259895_100000686858 [1,1,0,0,0,0|1,0,1]=4 1518 B10R1.1 CC=Cc1ccc(cn1)C 271570a_100016259895_100000754016 [1,1,0,0,0,0|1,0,1]=4 1519 B10R1.1 CC=Cc1ccc(cn1)Cl 271570a_100016259895_100011356976 [1,1,0,0,0,0|1,0,1]=4 1520 B10R1.1 CC=Cc1ccc(cn1)F 271570a_100016259895_100000744514 [1,1,0,0,0,0|1,0,1]=4 1521 B10R1.1 CC=Cc1ccc(cn1)N 271570a_100016259895_100000744251 [1,1,0,0,0,0|1,0,1]=4 1522 B10R1.1 CC=Cc1ccc(cn1)O 271570a_100016259895_100000685995 [1,1,0,0,0,0|1,0,1]=4 1523 B10R1.1 CC=Cc1ccc(nc1)Br 271570a_100016259895_100009814638 [1,1,0,0,0,0|1,0,1]=4 1524 B10R1.1 CC=Cc1ccc(nc1)C 271570a_100016259895_100000751577 [1,1,0,0,0,0|1,0,1]=4 1525 B10R1.1 CC=Cc1ccc(nc1)Cl 271570a_100016259895_100000034144 [1,1,0,0,0,0|1,0,1]=4 1526 B10R1.1 CC=Cc1ccc(nc1)F 271570a_100016259895_100000748661 [1,1,0,0,0,0|1,0,1]=4 1527 B10R1.1 CC=Cc1ccc(nc1)N 271570a_100016259895_100000187370 [1,1,0,0,0,0|1,0,1]=4 1528 B10R1.1 CCCc1ccc(cc1)O 271570a_203496583355_100000750032 [1,1,0,0,0,0|0,0,1]=3 1529 B10R1.1 CCNc1ccc(cc1)Br 2230a_100000210018_100000210202 [1,1,0,0,0,0|1,0,1]=4 1530 B10R1.1 CCNc1ccc(cc1)Br 34a_100000210018_100000210202 [1,1,0,0,0,0|1,0,1]=4 1531 B10R1.1 CCNc1ccc(cc1)C 34a_100000124888_100000210202 [1,1,0,0,0,0|1,0,1]=4 1532 B10R1.1 CCNc1ccc(cc1)Cl 2230a_100000210052_100000210202 [1,1,0,0,0,0|1,0,1]=4 1533 B10R1.1 CCNc1ccc(cc1)Cl 34a_100000210052_100000210202 [1,1,0,0,0,0|1,0,1]=4 1534 B10R1.1 CCNc1ccc(cc1)F 34a_100000185862_100000210202 [1,1,0,0,0,0|1,0,1]=4 1535 B10R1.1 CCNc1ccc(cc1)I 34a_100000185761_100000210202 [1,1,0,0,0,0|1,0,1]=4 1536 B10R1.1 CCNc1ccc(cc1)O 271570a_203496583355_100000219632 [1,1,0,0,0,0|1,0,1]=4 1537 B10R1.1 CCNc1ccc(cc1)O 34a_100000185829_100000210202 [1,1,0,0,0,0|1,0,1]=4 1538 B10R1.1 CCOc1ccc(cc1)Br 34a_100000185759_100000210202 [1,1,0,0,0,0|1,0,1]=4 1539 B10R1.1 CCOc1ccc(cc1)Br 7a_100000185759_100000210202 [1,1,0,0,0,0|1,0,1]=4 1540 B10R1.1 CCOc1ccc(cc1)C 34a_100000210336_100000210202 [1,1,0,0,0,0|1,0,1]=4 1541 B10R1.1 CCOc1ccc(cc1)C 7a_100000210336_100000210202 [1,1,0,0,0,0|1,0,1]=4 1542 B10R1.1 CCOc1ccc(cc1)Cl 34a_100000210216_100000210202 [1,1,0,0,0,0|1,0,1]=4 1543 B10R1.1 CCOc1ccc(cc1)Cl 7a_100000210216_100000210202 [1,1,0,0,0,0|1,0,1]=4 1544 B10R1.1 CCOc1ccc(cc1)F 34a_100000210339_100000210202 [1,1,0,0,0,0|1,0,1]=4 1545 B10R1.1 CCOc1ccc(cc1)I 34a_100000212066_100000210202 [1,1,0,0,0,0|1,0,1]=4 1546 B10R1.1 CCOc1ccc(cc1)I 7a_100000212066_100000210202 [1,1,0,0,0,0|1,0,1]=4 1547 B10R1.1 CCOc1ccc(cc1)N 34a_100000185829_100000210202 [1,1,0,0,0,0|1,0,1]=4 1548 B10R1.1 CCOc1ccc(cc1)O 271570a_203496583355_100000169946 [1,1,0,0,0,0|1,0,1]=4 1549 B10R1.1 CCSc1ccc(cc1)Br 62a_100000210202_100000752885 [1,1,0,0,0,0|1,0,1]=4 1550 B10R1.1 CCSc1ccc(cc1)Br 62a_100000752885_100000210202 [1,1,0,0,0,0|1,0,1]=4 1551 B10R1.1 CCSc1ccc(cc1)C 62a_100000186775_100000210202 [1,1,0,0,0,0|1,0,1]=4 1552 B10R1.1 CCSc1ccc(cc1)C 62a_100000210202_100000186775 [1,1,0,0,0,0|1,0,1]=4 1553 B10R1.1 CCSc1ccc(cc1)Cl 62a_100000210202_100000755918 [1,1,0,0,0,0|1,0,1]=4 1554 B10R1.1 CCSc1ccc(cc1)Cl 62a_100000755918_100000210202 [1,1,0,0,0,0|1,0,1]=4 1555 B10R1.1 CCSc1ccc(cc1)F 62a_100000210202_100000211213 [1,1,0,0,0,0|1,0,1]=4 1556 B10R1.1 CCSc1ccc(cc1)F 62a_100000211213_100000210202 [1,1,0,0,0,0|1,0,1]=4 1557 B10R1.1 CCSc1ccc(cc1)N 62a_100000185761_100000210202 [1,1,0,0,0,0|1,0,1]=4 1558 B10R1.1 CCSc1ccc(cc1)N 62a_100000210202_100000185761 [1,1,0,0,0,0|1,0,1]=4 1559 B10R1.1 CCSc1ccc(cc1)O 271570a_203496583355_200009811893 [1,1,0,0,0,0|1,0,1]=4 1560 B10R1.1 CCSc1ccc(cc1)O 62a_100000210202_100000185759 [1,1,0,0,0,0|1,0,1]=4 1561 B10R1.1 CNCc1ccc(cc1)Br 207a_100102657272_100000186029 [1,1,0,0,0,0|1,0,0]=3 1562 B10R1.1 CNCc1ccc(cc1)Br 2230a_100000174875_200000210301 [1,1,0,0,0,0|1,0,0]=3 1563 B10R1.1 CNCc1ccc(cc1)Br 2230a_106832991635_100011217064 [1,1,0,0,0,0|1,0,0]=3 1564 B10R1.1 CNCc1ccc(cc1)Br 26a_100102657272_100000185759 [1,1,0,0,0,0|1,0,0]=3 1565 B10R1.1 CNCc1ccc(cc1)Br 270004a_106832991635_100000186029 [1,1,0,0,0,0|1,0,0]=3 1566 B10R1.1 CNCc1ccc(cc1)Br 34a_100000174875_200000210301 [1,1,0,0,0,0|1,0,0]=3 1567 B10R1.1 CNCc1ccc(cc1)Br 34a_100102657272_100000189115 [1,1,0,0,0,0|1,0,0]=3 1568 B10R1.1 CNCc1ccc(cc1)Br 7a_106832991635_100011217064 [1,1,0,0,0,0|1,0,0]=3 1569 B10R1.1 CNCc1ccc(cc1)C 207a_100102657272_100000211033 [1,1,0,0,0,0|1,0,0]=3 1570 B10R1.1 CNCc1ccc(cc1)C 2230a_100000174908_200000210301 [1,1,0,0,0,0|1,0,0]=3 1571 B10R1.1 CNCc1ccc(cc1)C 2230a_106832991635_100000210814 [1,1,0,0,0,0|1,0,0]=3 1572 B10R1.1 CNCc1ccc(cc1)C 26a_100102657272_200020625495 [1,1,0,0,0,0|1,0,0]=3 1573 B10R1.1 CNCc1ccc(cc1)C 270004a_106832991635_100000211033 [1,1,0,0,0,0|1,0,0]=3 1574 B10R1.1 CNCc1ccc(cc1)C 34a_100000174908_200000210301 [1,1,0,0,0,0|1,0,0]=3 1575 B10R1.1 CNCc1ccc(cc1)C 34a_100102657272_100000210814 [1,1,0,0,0,0|1,0,0]=3 1576 B10R1.1 CNCc1ccc(cc1)C 7a_106832991635_100000210814 [1,1,0,0,0,0|1,0,0]=3 1577 B10R1.1 CNCc1ccc(cc1)Cl 207a_100102657272_100000189385 [1,1,0,0,0,0|1,0,0]=3 1578 B10R1.1 CNCc1ccc(cc1)Cl 2230a_100000174871_200000210301 [1,1,0,0,0,0|1,0,0]=3 1579 B10R1.1 CNCc1ccc(cc1)Cl 2230a_106832991635_100000694040 [1,1,0,0,0,0|1,0,0]=3 1580 B10R1.1 CNCc1ccc(cc1)Cl 270004a_106832991635_100000189385 [1,1,0,0,0,0|1,0,0]=3 1581 B10R1.1 CNCc1ccc(cc1)Cl 34a_100000174871_200000210301 [1,1,0,0,0,0|1,0,0]=3 1582 B10R1.1 CNCc1ccc(cc1)Cl 34a_100102657272_100000694040 [1,1,0,0,0,0|1,0,0]=3 1583 B10R1.1 CNCc1ccc(cc1)Cl 7a_106832991635_100000187161 [1,1,0,0,0,0|1,0,0]=3 1584 B10R1.1 CNCc1ccc(cc1)F 207a_100102657272_100000210084 [1,1,0,0,0,0|1,0,0]=3 1585 B10R1.1 CNCc1ccc(cc1)F 2230a_100000174882_200000210301 [1,1,0,0,0,0|1,0,0]=3 1586 B10R1.1 CNCc1ccc(cc1)F 2230a_106832991635_100000198546 [1,1,0,0,0,0|1,0,0]=3 1587 B10R1.1 CNCc1ccc(cc1)F 270004a_106832991635_100000210084 [1,1,0,0,0,0|1,0,0]=3 1588 B10R1.1 CNCc1ccc(cc1)F 34a_100000174882_200000210301 [1,1,0,0,0,0|1,0,0]=3 1589 B10R1.1 CNCc1ccc(cc1)F 34a_100102657272_100000198546 [1,1,0,0,0,0|1,0,0]=3 1590 B10R1.1 CNCc1ccc(cc1)F 7a_106832991635_100000198546 [1,1,0,0,0,0|1,0,0]=3 1591 B10R1.1 CNCc1ccc(cc1)I 207a_100102657272_100000188517 [1,1,0,0,0,0|1,0,0]=3 1592 B10R1.1 CNCc1ccc(cc1)I 2230a_100016989417_200000210301 [1,1,0,0,0,0|1,0,0]=3 1593 B10R1.1 CNCc1ccc(cc1)I 2230a_106832991635_100000189116 [1,1,0,0,0,0|1,0,0]=3 1594 B10R1.1 CNCc1ccc(cc1)I 34a_100016989417_200000210301 [1,1,0,0,0,0|1,0,0]=3 1595 B10R1.1 CNCc1ccc(cc1)I 34a_100102657272_100000189116 [1,1,0,0,0,0|1,0,0]=3 1596 B10R1.1 CNCc1ccc(cc1)I 7a_106832991635_100000189116 [1,1,0,0,0,0|1,0,0]=3 1597 B10R1.1 CNCc1ccc(cc1)O 271570a_203496583355_100000180866 [1,1,0,0,0,0|1,0,0]=3 1598 B10R1.1 CNCc1ccc(cc1)O 34a_100000185549_200000210301 [1,1,0,0,0,0|1,0,0]=3 1599 B10R1.1 CNCc1ccc(cn1)Br 207a_100102657272_100000754260 [1,1,0,0,0,0|2,0,0]=4 1600 B10R1.1 CNCc1ccc(cn1)Br 2230a_106832991635_100000702658 [1,1,0,0,0,0|2,0,0]=4 1601 B10R1.1 CNCc1ccc(cn1)Br 270004a_106832991635_100000754260 [1,1,0,0,0,0|2,0,0]=4 1602 B10R1.1 CNCc1ccc(cn1)Br 34a_100015188789_200000210301 [1,1,0,0,0,0|2,0,0]=4 1603 B10R1.1 CNCc1ccc(cn1)Br 34a_100102657272_100000702658 [1,1,0,0,0,0|2,0,0]=4 1604 B10R1.1 CNCc1ccc(cn1)Br 7a_106832991635_100000702658 [1,1,0,0,0,0|2,0,0]=4 1605 B10R1.1 CNCc1ccc(cn1)C 207a_100102657272_100000050478 [1,1,0,0,0,0|2,0,0]=4 1606 B10R1.1 CNCc1ccc(cn1)C 2230a_106832991635_100000691093 [1,1,0,0,0,0|2,0,0]=4 1607 B10R1.1 CNCc1ccc(cn1)C 270004a_106832991635_100000050478 [1,1,0,0,0,0|2,0,0]=4 1608 B10R1.1 CNCc1ccc(cn1)C 34a_100015187455_200000210301 [1,1,0,0,0,0|2,0,0]=4 1609 B10R1.1 CNCc1ccc(cn1)C 34a_100102657272_100000691093 [1,1,0,0,0,0|2,0,0]=4 1610 B10R1.1 CNCc1ccc(cn1)C 7a_106832991635_100000691093 [1,1,0,0,0,0|2,0,0]=4 1611 B10R1.1 CNCc1ccc(cn1)Cl 207a_100102657272_100011361569 [1,1,0,0,0,0|2,0,0]=4 1612 B10R1.1 CNCc1ccc(cn1)Cl 2230a_106832991635_100012066911 [1,1,0,0,0,0|2,0,0]=4 1613 B10R1.1 CNCc1ccc(cn1)Cl 270004a_106832991635_100011361569 [1,1,0,0,0,0|2,0,0]=4 1614 B10R1.1 CNCc1ccc(cn1)Cl 34a_100000697193_200000210301 [1,1,0,0,0,0|2,0,0]=4 1615 B10R1.1 CNCc1ccc(cn1)Cl 34a_100102657272_100012066911 [1,1,0,0,0,0|2,0,0]=4 1616 B10R1.1 CNCc1ccc(cn1)Cl 7a_106832991635_100012066911 [1,1,0,0,0,0|2,0,0]=4 1617 B10R1.1 CNCc1ccc(cn1)F 207a_100102657272_100011934744 [1,1,0,0,0,0|2,0,0]=4 1618 B10R1.1 CNCc1ccc(cn1)F 2230a_106832991635_100000703193 [1,1,0,0,0,0|2,0,0]=4 1619 B10R1.1 CNCc1ccc(cn1)F 270004a_106832991635_100011934744 [1,1,0,0,0,0|2,0,0]=4 1620 B10R1.1 CNCc1ccc(cn1)F 34a_100020620131_200000210301 [1,1,0,0,0,0|2,0,0]=4 1621 B10R1.1 CNCc1ccc(cn1)F 34a_100102657272_100000703193 [1,1,0,0,0,0|2,0,0]=4 1622 B10R1.1 CNCc1ccc(cn1)F 7a_106832991635_100000703193 [1,1,0,0,0,0|2,0,0]=4 1623 B10R1.1 CNCc1ccc(nc1)Br 2230a_100009817727_200000210301 [1,1,0,0,0,0|2,0,0]=4 1624 B10R1.1 CNCc1ccc(nc1)Br 2230a_106832991635_100009831999 [1,1,0,0,0,0|2,0,0]=4 1625 B10R1.1 CNCc1ccc(nc1)Br 34a_100009817727_200000210301 [1,1,0,0,0,0|2,0,0]=4 1626 B10R1.1 CNCc1ccc(nc1)Br 34a_100102657272_100009831999 [1,1,0,0,0,0|2,0,0]=4 1627 B10R1.1 CNCc1ccc(nc1)Br 7a_106832991635_100009831999 [1,1,0,0,0,0|2,0,0]=4 1628 B10R1.1 CNCc1ccc(nc1)C 2230a_106832991635_100016987292 [1,1,0,0,0,0|2,0,0]=4 1629 B10R1.1 CNCc1ccc(nc1)C 270004a_106832991635_100000743784 [1,1,0,0,0,0|2,0,0]=4 1630 B10R1.1 CNCc1ccc(nc1)C 34a_100000740942_200000210301 [1,1,0,0,0,0|2,0,0]=4 1631 B10R1.1 CNCc1ccc(nc1)C 34a_100102657272_100016987292 [1,1,0,0,0,0|2,0,0]=4 1632 B10R1.1 CNCc1ccc(nc1)C 7a_106832991635_100016987292 [1,1,0,0,0,0|2,0,0]=4 1633 B10R1.1 CNCc1ccc(nc1)Cl 2230a_100000735879_200000210301 [1,1,0,0,0,0|2,0,0]=4 1634 B10R1.1 CNCc1ccc(nc1)Cl 2230a_106832991635_100000735431 [1,1,0,0,0,0|2,0,0]=4 1635 B10R1.1 CNCc1ccc(nc1)Cl 34a_100000735879_200000210301 [1,1,0,0,0,0|2,0,0]=4 1636 B10R1.1 CNCc1ccc(nc1)Cl 34a_100102657272_100000735431 [1,1,0,0,0,0|2,0,0]=4 1637 B10R1.1 CNCc1ccc(nc1)Cl 7a_106832991635_100000735431 [1,1,0,0,0,0|2,0,0]=4 1638 B10R1.1 CNCc1ccc(nc1)F 2230a_100000101913_200000210301 [1,1,0,0,0,0|2,0,0]=4 1639 B10R1.1 CNCc1ccc(nc1)F 2230a_106832991635_100009820150 [1,1,0,0,0,0|2,0,0]=4 1640 B10R1.1 CNCc1ccc(nc1)F 34a_100000101913_200000210301 [1,1,0,0,0,0|2,0,0]=4 1641 B10R1.1 CNCc1ccc(nc1)F 34a_100102657272_100000099788 [1,1,0,0,0,0|2,0,0]=4 1642 B10R1.1 CNCc1ccc(nc1)F 7a_106832991635_100009820150 [1,1,0,0,0,0|2,0,0]=4 1643 B10R1.1 CNCc1ccc(nc1)O 207a_100102657272_100011361521 [1,1,0,0,0,0|2,0,0]=4 1644 B10R1.1 CNCc1ccc(nc1)O 2230a_100000757128_200000210301 [1,1,0,0,0,0|2,0,0]=4 1645 B10R1.1 CNCc1ccc(nc1)O 271570a_203496583355_100000026953 [1,1,0,0,0,0|2,0,0]=4 1646 B10R1.1 COCc1cc[n+](cc1)C 34a_100009831711_200000210301 [1,1,0,0,0,0|2,0,0]=4 1647 B10R1.1 COCc1cc[n+](cc1)[O-] 34a_100000031831_200000210301 [1,1,0,0,0,0|2,0,0]=4 1648 B10R1.1 COCc1cc[n+](cc1)[O-] 7a_100000031831_200000210301 [1,1,0,0,0,0|2,0,0]=4 1649 B10R1.1 COCc1ccc(=O)[nH]c1 34a_100011999846_200000210301 [1,1,0,0,0,0|2,0,0]=4 1650 B10R1.1 COCc1ccc(cc1)Br 34a_100000695286_200000210301 [1,1,0,0,0,0|1,0,0]=3 1651 B10R1.1 COCc1ccc(cc1)Br 34a_100138415774_100000189115 [1,1,0,0,0,0|1,0,0]=3 1652 B10R1.1 COCc1ccc(cc1)C 34a_100011215236_200000210301 [1,1,0,0,0,0|1,0,0]=3 1653 B10R1.1 COCc1ccc(cc1)C 34a_100138415774_100000210814 [1,1,0,0,0,0|1,0,0]=3 1654 B10R1.1 COCc1ccc(cc1)C 7a_100011215236_200000210301 [1,1,0,0,0,0|1,0,0]=3 1655 B10R1.1 COCc1ccc(cc1)Cl 34a_100000211118_200000210301 [1,1,0,0,0,0|1,0,0]=3 1656 B10R1.1 COCc1ccc(cc1)Cl 34a_100138415774_100000694040 [1,1,0,0,0,0|1,0,0]=3 1657 B10R1.1 COCc1ccc(cc1)Cl 7a_100000211118_200000210301 [1,1,0,0,0,0|1,0,0]=3 1658 B10R1.1 COCc1ccc(cc1)F 34a_100000210977_200000210301 [1,1,0,0,0,0|1,0,0]=3 1659 B10R1.1 COCc1ccc(cc1)F 34a_100138415774_100000198546 [1,1,0,0,0,0|1,0,0]=3 1660 B10R1.1 COCc1ccc(cc1)F 7a_100000210977_200000210301 [1,1,0,0,0,0|1,0,0]=3 1661 B10R1.1 COCc1ccc(cc1)I 34a_100000690907_200000210301 [1,1,0,0,0,0|1,0,0]=3 1662 B10R1.1 COCc1ccc(cc1)I 34a_100138415774_100000189116 [1,1,0,0,0,0|1,0,0]=3 1663 B10R1.1 COCc1ccc(cc1)I 7a_100000690907_200000210301 [1,1,0,0,0,0|1,0,0]=3 1664 B10R1.1 COCc1ccc(cc1)N 34a_100011215238_200000210301 [1,1,0,0,0,0|1,0,0]=3 1665 B10R1.1 COCc1ccc(cc1)O 271570a_203496583355_100011493685 [1,1,0,0,0,0|1,0,0]=3 1666 B10R1.1 COCc1ccc(cn1)Br 34a_100000754261_200000210301 [1,1,0,0,0,0|2,0,0]=4 1667 B10R1.1 COCc1ccc(cn1)Br 34a_100138415774_100000702658 [1,1,0,0,0,0|2,0,0]=4 1668 B10R1.1 COCc1ccc(cn1)C 34a_100012001401_200000210301 [1,1,0,0,0,0|2,0,0]=4 1669 B10R1.1 COCc1ccc(cn1)C 34a_100138415774_100000691093 [1,1,0,0,0,0|2,0,0]=4 1670 B10R1.1 COCc1ccc(cn1)Cl 34a_100000703999_200000210301 [1,1,0,0,0,0|2,0,0]=4 1671 B10R1.1 COCc1ccc(cn1)Cl 34a_100138415774_100012066911 [1,1,0,0,0,0|2,0,0]=4 1672 B10R1.1 COCc1ccc(cn1)F 34a_100011999454_200000210301 [1,1,0,0,0,0|2,0,0]=4 1673 B10R1.1 COCc1ccc(cn1)F 34a_100138415774_100000703193 [1,1,0,0,0,0|2,0,0]=4 1674 B10R1.1 COCc1ccc(cn1)N 34a_100011998161_200000210301 [1,1,0,0,0,0|2,0,0]=4 1675 B10R1.1 COCc1ccc(nc1)Br 34a_100009816760_200000210301 [1,1,0,0,0,0|2,0,0]=4 1676 B10R1.1 COCc1ccc(nc1)Br 34a_100138415774_100009831999 [1,1,0,0,0,0|2,0,0]=4 1677 B10R1.1 COCc1ccc(nc1)Br 7a_100009816760_200000210301 [1,1,0,0,0,0|2,0,0]=4 1678 B10R1.1 COCc1ccc(nc1)C 34a_100011248133_200000210301 [1,1,0,0,0,0|2,0,0]=4 1679 B10R1.1 COCc1ccc(nc1)C 34a_100138415774_100016987292 [1,1,0,0,0,0|2,0,0]=4 1680 B10R1.1 COCc1ccc(nc1)Cl 34a_100000755211_200000210301 [1,1,0,0,0,0|2,0,0]=4 1681 B10R1.1 COCc1ccc(nc1)Cl 34a_100138415774_100000735431 [1,1,0,0,0,0|2,0,0]=4 1682 B10R1.1 COCc1ccc(nc1)Cl 7a_100000755211_200000210301 [1,1,0,0,0,0|2,0,0]=4 1683 B10R1.1 COCc1ccc(nc1)F 34a_100000079959_200000210301 [1,1,0,0,0,0|2,0,0]=4 1684 B10R1.1 COCc1ccc(nc1)F 34a_100138415774_100000099788 [1,1,0,0,0,0|2,0,0]=4 1685 B10R1.1 COCc1ccc(nc1)N 34a_100000704267_200000210301 [1,1,0,0,0,0|2,0,0]=4 1686 B10R1.1 CSCc1ccc(cc1)Br 62a_100000189115_200000210301 [1,1,0,0,0,0|1,0,0]=3 1687 B10R1.1 CSCc1ccc(cc1)Br 62a_200000210301_100000189115 [1,1,0,0,0,0|1,0,0]=3 1688 B10R1.1 CSCc1ccc(cc1)C 62a_100000210814_200000210301 [1,1,0,0,0,0|1,0,0]=3 1689 B10R1.1 CSCc1ccc(cc1)C 62a_200000210301_100000210814 [1,1,0,0,0,0|1,0,0]=3 1690 B10R1.1 CSCc1ccc(cc1)Cl 62a_100000187161_200000210301 [1,1,0,0,0,0|1,0,0]=3 1691 B10R1.1 CSCc1ccc(cc1)Cl 62a_200000210301_100000187161 [1,1,0,0,0,0|1,0,0]=3 1692 B10R1.1 CSCc1ccc(cc1)F 62a_100000198546_200000210301 [1,1,0,0,0,0|1,0,0]=3 1693 B10R1.1 CSCc1ccc(cc1)F 62a_200000210301_100000187164 [1,1,0,0,0,0|1,0,0]=3 1694 B10R1.1 CSCc1ccc(cc1)I 62a_100000189116_200000210301 [1,1,0,0,0,0|1,0,0]=3 1695 B10R1.1 CSCc1ccc(cc1)I 62a_200000210301_100000189116 [1,1,0,0,0,0|1,0,0]=3 1696 B10R1.1 CSCc1ccc(cn1)Br 62a_100000702658_200000210301 [1,1,0,0,0,0|2,0,0]=4 1697 B10R1.1 CSCc1ccc(cn1)Br 62a_200000210301_100000702658 [1,1,0,0,0,0|2,0,0]=4 1698 B10R1.1 CSCc1ccc(cn1)C 62a_100000691093_200000210301 [1,1,0,0,0,0|2,0,0]=4 1699 B10R1.1 CSCc1ccc(cn1)C 62a_200000210301_100000691093 [1,1,0,0,0,0|2,0,0]=4 1700 B10R1.1 CSCc1ccc(cn1)Cl 62a_100012066911_200000210301 [1,1,0,0,0,0|2,0,0]=4 1701 B10R1.1 CSCc1ccc(cn1)Cl 62a_200000210301_100000697101 [1,1,0,0,0,0|2,0,0]=4 1702 B10R1.1 CSCc1ccc(cn1)F 62a_100000703193_200000210301 [1,1,0,0,0,0|2,0,0]=4 1703 B10R1.1 CSCc1ccc(cn1)F 62a_200000210301_100000703193 [1,1,0,0,0,0|2,0,0]=4 1704 B10R1.1 CSCc1ccc(nc1)Br 62a_100009831999_200000210301 [1,1,0,0,0,0|2,0,0]=4 1705 B10R1.1 CSCc1ccc(nc1)Br 62a_200000210301_100009831999 [1,1,0,0,0,0|2,0,0]=4 1706 B10R1.1 CSCc1ccc(nc1)C 62a_100016987292_200000210301 [1,1,0,0,0,0|2,0,0]=4 1707 B10R1.1 CSCc1ccc(nc1)C 62a_200000210301_100016987292 [1,1,0,0,0,0|2,0,0]=4 1708 B10R1.1 CSCc1ccc(nc1)Cl 62a_100000735431_200000210301 [1,1,0,0,0,0|2,0,0]=4 1709 B10R1.1 CSCc1ccc(nc1)Cl 62a_200000210301_100000735431 [1,1,0,0,0,0|2,0,0]=4 1710 B10R1.1 CSCc1ccc(nc1)F 62a_100009820150_200000210301 [1,1,0,0,0,0|2,0,0]=4 1711 B10R1.1 CSCc1ccc(nc1)F 62a_200000210301_100000099788 [1,1,0,0,0,0|2,0,0]=4 1712 B10R1.1 CSCc1ccc(nc1)O 271570a_203496583355_100000753673 [1,1,0,0,0,0|2,0,0]=4 1713 B10R1.1 C[n+]1ccc(cc1)CO[13CH3] 34a_100009831711_200025704644 [1,1,0,0,0,0|2,0,0]=4 1714 B10R1.1 Cc1ccc(cc1)CN[13CH3] 2230a_100000174908_200025704644 [1,1,0,0,0,0|1,0,0]=3 1715 B10R1.1 Cc1ccc(cc1)CN[13CH3] 34a_100000174908_200025704644 [1,1,0,0,0,0|1,0,0]=3 1716 B10R1.1 Cc1ccc(cc1)CO[13CH3] 34a_100011215236_200025704644 [1,1,0,0,0,0|1,0,0]=3 1717 B10R1.1 Cc1ccc(cc1)CO[13CH3] 7a_100011215236_200025704644 [1,1,0,0,0,0|1,0,0]=3 1718 B10R1.1 Cc1ccc(cc1)CS[13CH3] 62a_100000210814_200025704644 [1,1,0,0,0,0|1,0,0]=3 1719 B10R1.1 Cc1ccc(cc1)CS[13CH3] 62a_200025704644_100000210814 [1,1,0,0,0,0|1,0,0]=3 1720 B10R1.1 Cc1ccc(cn1)CN[13CH3] 34a_100000740942_200025704644 [1,1,0,0,0,0|2,0,0]=4 1721 B10R1.1 Cc1ccc(cn1)CO[13CH3] 34a_100011248133_200025704644 [1,1,0,0,0,0|2,0,0]=4 1722 B10R1.1 Cc1ccc(cn1)CS[13CH3] 62a_100016987292_200025704644 [1,1,0,0,0,0|2,0,0]=4 1723 B10R1.1 Cc1ccc(cn1)CS[13CH3] 62a_200025704644_100016987292 [1,1,0,0,0,0|2,0,0]=4 1724 B10R1.1 Cc1ccc(nc1)CN[13CH3] 34a_100015187455_200025704644 [1,1,0,0,0,0|2,0,0]=4 1725 B10R1.1 Cc1ccc(nc1)CO[13CH3] 34a_100012001401_200025704644 [1,1,0,0,0,0|2,0,0]=4 1726 B10R1.1 Cc1ccc(nc1)CS[13CH3] 62a_100000691093_200025704644 [1,1,0,0,0,0|2,0,0]=4 1727 B10R1.1 Cc1ccc(nc1)CS[13CH3] 62a_200025704644_100000691093 [1,1,0,0,0,0|2,0,0]=4 1728 B10R1.1 N#CCc1ccc(cc1)O 271570a_203496583355_100011217881 [1,1,0,0,0,0|1,0,1]=4 1729 B10R1.1 NCCc1ccc(cc1)O 271570a_203496583355_100000755846 [1,1,0,0,0,0|1,0,1]=4 1730 B10R1.1 NNCc1ccc(cc1)O 271570a_203496583355_100016993955 [1,1,0,0,0,0|2,0,0]=4 1731 B10R1.1 O=CCc1ccc(cc1)O 271570a_203496583355_100011361690 [1,1,0,0,0,0|1,0,0]=3 1732 B10R1.1 OCCc1ccc(cc1)O 271570a_203496583355_100000766406 [1,1,0,0,0,0|1,0,1]=4 1733 B10R1.1 Oc1ccc(cc1)/C=C/Br 271570a_203496583355_200016255901 [1,1,0,0,0,0|1,0,1]=4 1734 B10R1.1 [13CH3]NCc1ccc(cc1)Br 2230a_100000174875_200025704644 [1,1,0,0,0,0|1,0,0]=3 1735 B10R1.1 [13CH3]NCc1ccc(cc1)Br 34a_100000174875_200025704644 [1,1,0,0,0,0|1,0,0]=3 1736 B10R1.1 [13CH3]NCc1ccc(cc1)Cl 2230a_100000174871_200025704644 [1,1,0,0,0,0|1,0,0]=3 1737 B10R1.1 [13CH3]NCc1ccc(cc1)Cl 34a_100000174871_200025704644 [1,1,0,0,0,0|1,0,0]=3 1738 B10R1.1 [13CH3]NCc1ccc(cc1)F 2230a_100000174882_200025704644 [1,1,0,0,0,0|1,0,0]=3 1739 B10R1.1 [13CH3]NCc1ccc(cc1)F 34a_100000174882_200025704644 [1,1,0,0,0,0|1,0,0]=3 1740 B10R1.1 [13CH3]NCc1ccc(cc1)I 2230a_100016989417_200025704644 [1,1,0,0,0,0|1,0,0]=3 1741 B10R1.1 [13CH3]NCc1ccc(cc1)I 34a_100016989417_200025704644 [1,1,0,0,0,0|1,0,0]=3 1742 B10R1.1 [13CH3]NCc1ccc(cc1)O 34a_100000185549_200025704644 [1,1,0,0,0,0|1,0,0]=3 1743 B10R1.1 [13CH3]NCc1ccc(cn1)Br 34a_100015188789_200025704644 [1,1,0,0,0,0|2,0,0]=4 1744 B10R1.1 [13CH3]NCc1ccc(cn1)Cl 34a_100000697193_200025704644 [1,1,0,0,0,0|2,0,0]=4 1745 B10R1.1 [13CH3]NCc1ccc(cn1)F 34a_100020620131_200025704644 [1,1,0,0,0,0|2,0,0]=4 1746 B10R1.1 [13CH3]NCc1ccc(nc1)Br 2230a_100009817727_200025704644 [1,1,0,0,0,0|2,0,0]=4 1747 B10R1.1 [13CH3]NCc1ccc(nc1)Br 34a_100009817727_200025704644 [1,1,0,0,0,0|2,0,0]=4 1748 B10R1.1 [13CH3]NCc1ccc(nc1)Cl 2230a_100000735879_200025704644 [1,1,0,0,0,0|2,0,0]=4 1749 B10R1.1 [13CH3]NCc1ccc(nc1)Cl 34a_100000735879_200025704644 [1,1,0,0,0,0|2,0,0]=4 1750 B10R1.1 [13CH3]NCc1ccc(nc1)F 2230a_100000101913_200025704644 [1,1,0,0,0,0|2,0,0]=4 1751 B10R1.1 [13CH3]NCc1ccc(nc1)F 34a_100000101913_200025704644 [1,1,0,0,0,0|2,0,0]=4 1752 B10R1.1 [13CH3]NCc1ccc(nc1)O 2230a_100000757128_200025704644 [1,1,0,0,0,0|2,0,0]=4 1753 B10R1.1 [13CH3]OCc1cc[n+](cc1)[O-] 34a_100000031831_200025704644 [1,1,0,0,0,0|2,0,0]=4 1754 B10R1.1 [13CH3]OCc1cc[n+](cc1)[O-] 7a_100000031831_200025704644 [1,1,0,0,0,0|2,0,0]=4 1755 B10R1.1 [13CH3]OCc1ccc(=O)[nH]c1 34a_100011999846_200025704644 [1,1,0,0,0,0|2,0,0]=4 1756 B10R1.1 [13CH3]OCc1ccc(cc1)Br 34a_100000695286_200025704644 [1,1,0,0,0,0|1,0,0]=3 1757 B10R1.1 [13CH3]OCc1ccc(cc1)Cl 34a_100000211118_200025704644 [1,1,0,0,0,0|1,0,0]=3 1758 B10R1.1 [13CH3]OCc1ccc(cc1)Cl 7a_100000211118_200025704644 [1,1,0,0,0,0|1,0,0]=3 1759 B10R1.1 [13CH3]OCc1ccc(cc1)F 34a_100000210977_200025704644 [1,1,0,0,0,0|1,0,0]=3 1760 B10R1.1 [13CH3]OCc1ccc(cc1)F 7a_100000210977_200025704644 [1,1,0,0,0,0|1,0,0]=3 1761 B10R1.1 [13CH3]OCc1ccc(cc1)I 34a_100000690907_200025704644 [1,1,0,0,0,0|1,0,0]=3 1762 B10R1.1 [13CH3]OCc1ccc(cc1)I 7a_100000690907_200025704644 [1,1,0,0,0,0|1,0,0]=3 1763 B10R1.1 [13CH3]OCc1ccc(cc1)N 34a_100011215238_200025704644 [1,1,0,0,0,0|1,0,0]=3 1764 B10R1.1 [13CH3]OCc1ccc(cn1)Br 34a_100000754261_200025704644 [1,1,0,0,0,0|2,0,0]=4 1765 B10R1.1 [13CH3]OCc1ccc(cn1)Cl 34a_100000703999_200025704644 [1,1,0,0,0,0|2,0,0]=4 1766 B10R1.1 [13CH3]OCc1ccc(cn1)F 34a_100011999454_200025704644 [1,1,0,0,0,0|2,0,0]=4 1767 B10R1.1 [13CH3]OCc1ccc(cn1)N 34a_100011998161_200025704644 [1,1,0,0,0,0|2,0,0]=4 1768 B10R1.1 [13CH3]OCc1ccc(nc1)Br 34a_100009816760_200025704644 [1,1,0,0,0,0|2,0,0]=4 1769 B10R1.1 [13CH3]OCc1ccc(nc1)Br 7a_100009816760_200025704644 [1,1,0,0,0,0|2,0,0]=4 1770 B10R1.1 [13CH3]OCc1ccc(nc1)Cl 34a_100000755211_200025704644 [1,1,0,0,0,0|2,0,0]=4 1771 B10R1.1 [13CH3]OCc1ccc(nc1)Cl 7a_100000755211_200025704644 [1,1,0,0,0,0|2,0,0]=4 1772 B10R1.1 [13CH3]OCc1ccc(nc1)F 34a_100000079959_200025704644 [1,1,0,0,0,0|2,0,0]=4 1773 B10R1.1 [13CH3]OCc1ccc(nc1)N 34a_100000704267_200025704644 [1,1,0,0,0,0|2,0,0]=4 1774 B10R1.1 [13CH3]SCc1ccc(cc1)Br 62a_100000189115_200025704644 [1,1,0,0,0,0|1,0,0]=3 1775 B10R1.1 [13CH3]SCc1ccc(cc1)Br 62a_200025704644_100000189115 [1,1,0,0,0,0|1,0,0]=3 1776 B10R1.1 [13CH3]SCc1ccc(cc1)Cl 62a_100000187161_200025704644 [1,1,0,0,0,0|1,0,0]=3 1777 B10R1.1 [13CH3]SCc1ccc(cc1)Cl 62a_200025704644_100000187161 [1,1,0,0,0,0|1,0,0]=3 1778 B10R1.1 [13CH3]SCc1ccc(cc1)F 62a_100000198546_200025704644 [1,1,0,0,0,0|1,0,0]=3 1779 B10R1.1 [13CH3]SCc1ccc(cc1)F 62a_200025704644_100000187164 [1,1,0,0,0,0|1,0,0]=3 1780 B10R1.1 [13CH3]SCc1ccc(cc1)I 62a_100000189116_200025704644 [1,1,0,0,0,0|1,0,0]=3 1781 B10R1.1 [13CH3]SCc1ccc(cc1)I 62a_200025704644_100000189116 [1,1,0,0,0,0|1,0,0]=3 1782 B10R1.1 [13CH3]SCc1ccc(cn1)Br 62a_100000702658_200025704644 [1,1,0,0,0,0|2,0,0]=4 1783 B10R1.1 [13CH3]SCc1ccc(cn1)Br 62a_200025704644_100000702658 [1,1,0,0,0,0|2,0,0]=4 1784 B10R1.1 [13CH3]SCc1ccc(cn1)Cl 62a_100012066911_200025704644 [1,1,0,0,0,0|2,0,0]=4 1785 B10R1.1 [13CH3]SCc1ccc(cn1)Cl 62a_200025704644_100000697101 [1,1,0,0,0,0|2,0,0]=4 1786 B10R1.1 [13CH3]SCc1ccc(cn1)F 62a_100000703193_200025704644 [1,1,0,0,0,0|2,0,0]=4 1787 B10R1.1 [13CH3]SCc1ccc(cn1)F 62a_200025704644_100000703193 [1,1,0,0,0,0|2,0,0]=4 1788 B10R1.1 [13CH3]SCc1ccc(nc1)Br 62a_100009831999_200025704644 [1,1,0,0,0,0|2,0,0]=4 1789 B10R1.1 [13CH3]SCc1ccc(nc1)Br 62a_200025704644_100009831999 [1,1,0,0,0,0|2,0,0]=4 1790 B10R1.1 [13CH3]SCc1ccc(nc1)Cl 62a_100000735431_200025704644 [1,1,0,0,0,0|2,0,0]=4 1791 B10R1.1 [13CH3]SCc1ccc(nc1)Cl 62a_200025704644_100000735431 [1,1,0,0,0,0|2,0,0]=4 1792 B10R1.1 [13CH3]SCc1ccc(nc1)F 62a_100009820150_200025704644 [1,1,0,0,0,0|2,0,0]=4 1793 B10R1.1 [13CH3]SCc1ccc(nc1)F 62a_200025704644_100000099788 [1,1,0,0,0,0|2,0,0]=4 1794 B10R1.4 C=C=Cc1ccccc1Br 271570a_100015277604_100000695589 [1,1,0,0,0,0|0,0,2]=4 1795 B10R1.4 C=C=Cc1ccccc1C 271570a_100015277604_100000210755 [1,1,0,0,0,0|0,0,2]=4 1796 B10R1.4 C=C=Cc1ccccc1Cl 271570a_100015277604_100000764095 [1,1,0,0,0,0|0,0,2]=4 1797 B10R1.4 C=C=Cc1ccccc1F 271570a_100015277604_100011215700 [1,1,0,0,0,0|0,0,2]=4 1798 B10R1.4 C=C=Cc1ccccc1N 271570a_100015277604_100000210017 [1,1,0,0,0,0|0,0,2]=4 1799 B10R1.4 C=C=Cc1ccccc1O 271570a_100015277604_100000739446 [1,1,0,0,0,0|0,0,2]=4 1800 B10R1.4 C=CCc1ccccc1O 271570a_203496583355_100009828059 [1,1,0,0,0,0|0,0,0]=2 1801 B10R1.4 CC=Cc1c[nH]ccc1=O 271570a_100016259895_100009998708 [1,1,0,0,0,0|1,0,1]=4 1802 B10R1.4 CC=Cc1c[nH]ccc1=S 271570a_100016259895_200012280681 [1,1,0,0,0,0|1,0,1]=4 1803 B10R1.4 CC=Cc1ccc[nH]c1=O 271570a_100016259895_100000050042 [1,1,0,0,0,0|1,0,1]=4 1804 B10R1.4 CC=Cc1cccc[n+]1C 271570a_100016259895_100000212160 [1,1,0,0,0,0|1,0,1]=4 1805 B10R1.4 CC=Cc1cccc[n+]1[O-] 271570a_100016259895_200000042595 [1,1,0,0,0,0|1,0,1]=4 1806 B10R1.4 CC=Cc1ccccc1Br 271570a_100016259895_100000695589 [1,1,0,0,0,0|0,0,1]=3 1807 B10R1.4 CC=Cc1ccccc1C 271570a_100016259895_100000210755 [1,1,0,0,0,0|0,0,1]=3 1808 B10R1.4 CC=Cc1ccccc1Cl 271570a_100016259895_100000764095 [1,1,0,0,0,0|0,0,1]=3 1809 B10R1.4 CC=Cc1ccccc1F 271570a_100016259895_100011215700 [1,1,0,0,0,0|0,0,1]=3 1810 B10R1.4 CC=Cc1ccccc1N 271570a_100016259895_100000210017 [1,1,0,0,0,0|0,0,1]=3 1811 B10R1.4 CC=Cc1ccccc1O 271570a_100016259895_100000739446 [1,1,0,0,0,0|0,0,1]=3 1812 B10R1.4 CC=Cc1cccnc1Br 271570a_100016259895_100010202626 [1,1,0,0,0,0|1,0,1]=4 1813 B10R1.4 CC=Cc1cccnc1C 271570a_100016259895_100000751574 [1,1,0,0,0,0|1,0,1]=4 1814 B10R1.4 CC=Cc1cccnc1Cl 271570a_100016259895_100000036424 [1,1,0,0,0,0|1,0,1]=4 1815 B10R1.4 CC=Cc1cccnc1F 271570a_100016259895_100009816115 [1,1,0,0,0,0|1,0,1]=4 1816 B10R1.4 CC=Cc1cccnc1N 271570a_100016259895_100000045569 [1,1,0,0,0,0|1,0,1]=4 1817 B10R1.4 CC=Cc1ccncc1Br 271570a_100016259895_100000726257 [1,1,0,0,0,0|1,0,1]=4 1818 B10R1.4 CC=Cc1ccncc1C 271570a_100016259895_100015191297 [1,1,0,0,0,0|1,0,1]=4 1819 B10R1.4 CC=Cc1ccncc1Cl 271570a_100016259895_100000708259 [1,1,0,0,0,0|1,0,1]=4 1820 B10R1.4 CC=Cc1ccncc1F 271570a_100016259895_100000047030 [1,1,0,0,0,0|1,0,1]=4 1821 B10R1.4 CC=Cc1ccncc1N 271570a_100016259895_100009815883 [1,1,0,0,0,0|1,0,1]=4 1822 B10R1.4 CC=Cc1ccncc1O 271570a_100016259895_100009817591 [1,1,0,0,0,0|1,0,1]=4 1823 B10R1.4 CC=Cc1cnccc1Br 271570a_100016259895_100010138639 [1,1,0,0,0,0|1,0,1]=4 1824 B10R1.4 CC=Cc1cnccc1C 271570a_100016259895_100000761580 [1,1,0,0,0,0|1,0,1]=4 1825 B10R1.4 CC=Cc1cnccc1Cl 271570a_100016259895_100009995489 [1,1,0,0,0,0|1,0,1]=4 1826 B10R1.4 CC=Cc1cnccc1F 271570a_100016259895_100009820683 [1,1,0,0,0,0|1,0,1]=4 1827 B10R1.4 CC=Cc1cnccc1N 271570a_100016259895_100000047001 [1,1,0,0,0,0|1,0,1]=4 1828 B10R1.4 CC=Cc1ncccc1Br 271570a_100016259895_100000696092 [1,1,0,0,0,0|1,0,1]=4 1829 B10R1.4 CC=Cc1ncccc1C 271570a_100016259895_100000751373 [1,1,0,0,0,0|1,0,1]=4 1830 B10R1.4 CC=Cc1ncccc1Cl 271570a_100016259895_100011356963 [1,1,0,0,0,0|1,0,1]=4 1831 B10R1.4 CC=Cc1ncccc1F 271570a_100016259895_100000685392 [1,1,0,0,0,0|1,0,1]=4 1832 B10R1.4 CC=Cc1ncccc1N 271570a_100016259895_100000688686 [1,1,0,0,0,0|1,0,1]=4 1833 B10R1.4 CC=Cc1ncccc1O 271570a_100016259895_100000034122 [1,1,0,0,0,0|1,0,1]=4 1834 B10R1.4 CCNc1ccccc1Br 34a_100000210017_100000210202 [1,1,0,0,0,0|1,0,1]=4 1835 B10R1.4 CCNc1ccccc1C 34a_100015192222_100000210202 [1,1,0,0,0,0|1,0,1]=4 1836 B10R1.4 CCNc1ccccc1Cl 34a_100000185783_100000210202 [1,1,0,0,0,0|1,0,1]=4 1837 B10R1.4 CCNc1ccccc1F 34a_100000210422_100000210202 [1,1,0,0,0,0|1,0,1]=4 1838 B10R1.4 CCNc1ccccc1I 34a_100000210053_100000210202 [1,1,0,0,0,0|1,0,1]=4 1839 B10R1.4 CCNc1ccccc1O 271570a_203496583355_114873767003 [1,1,0,0,0,0|1,0,1]=4 1840 B10R1.4 CCNc1ccccc1O 34a_100000185747_100000210202 [1,1,0,0,0,0|1,0,1]=4 1841 B10R1.4 CCOc1ccccc1Br 34a_100000181306_100000210202 [1,1,0,0,0,0|1,0,1]=4 1842 B10R1.4 CCOc1ccccc1Br 7a_100000181306_100000210202 [1,1,0,0,0,0|1,0,1]=4 1843 B10R1.4 CCOc1ccccc1C 34a_100000210338_100000210202 [1,1,0,0,0,0|1,0,1]=4 1844 B10R1.4 CCOc1ccccc1C 7a_100000210338_100000210202 [1,1,0,0,0,0|1,0,1]=4 1845 B10R1.4 CCOc1ccccc1Cl 34a_100000210172_100000210202 [1,1,0,0,0,0|1,0,1]=4 1846 B10R1.4 CCOc1ccccc1Cl 7a_100000210172_100000210202 [1,1,0,0,0,0|1,0,1]=4 1847 B10R1.4 CCOc1ccccc1F 34a_100000210171_100000210202 [1,1,0,0,0,0|1,0,1]=4 1848 B10R1.4 CCOc1ccccc1F 7a_100000210171_100000210202 [1,1,0,0,0,0|1,0,1]=4 1849 B10R1.4 CCOc1ccccc1I 34a_100000739446_100000210202 [1,1,0,0,0,0|1,0,1]=4 1850 B10R1.4 CCOc1ccccc1I 7a_100000739446_100000210202 [1,1,0,0,0,0|1,0,1]=4 1851 B10R1.4 CCOc1ccccc1N 34a_100000185747_100000210202 [1,1,0,0,0,0|1,0,1]=4 1852 B10R1.4 CCOc1ccccc1N 7a_100000185747_100000210202 [1,1,0,0,0,0|1,0,1]=4 1853 B10R1.4 CCOc1ccccc1O 271570a_203496583355_100000230754 [1,1,0,0,0,0|1,0,1]=4 1854 B10R1.4 CCSc1ccccc1Br 62a_100000210202_100000695589 [1,1,0,0,0,0|1,0,1]=4 1855 B10R1.4 CCSc1ccccc1Br 62a_100000695589_100000210202 [1,1,0,0,0,0|1,0,1]=4 1856 B10R1.4 CCSc1ccccc1C 62a_100000210202_100000210755 [1,1,0,0,0,0|1,0,1]=4 1857 B10R1.4 CCSc1ccccc1C 62a_100000210755_100000210202 [1,1,0,0,0,0|1,0,1]=4 1858 B10R1.4 CCSc1ccccc1Cl 62a_100000210202_100000764095 [1,1,0,0,0,0|1,0,1]=4 1859 B10R1.4 CCSc1ccccc1Cl 62a_100000764095_100000210202 [1,1,0,0,0,0|1,0,1]=4 1860 B10R1.4 CCSc1ccccc1F 62a_100000210202_100011215700 [1,1,0,0,0,0|1,0,1]=4 1861 B10R1.4 CCSc1ccccc1F 62a_100011215700_100000210202 [1,1,0,0,0,0|1,0,1]=4 1862 B10R1.4 CCSc1ccccc1N 62a_100000210017_100000210202 [1,1,0,0,0,0|1,0,1]=4 1863 B10R1.4 CCSc1ccccc1N 62a_100000210202_100000210017 [1,1,0,0,0,0|1,0,1]=4 1864 B10R1.4 CCSc1ccccc1O 271570a_203496583355_100000230856 [1,1,0,0,0,0|1,0,1]=4 1865 B10R1.4 CCSc1ccccc1O 62a_100000210202_100000739446 [1,1,0,0,0,0|1,0,1]=4 1866 B10R1.4 CCSc1ccccc1O 62a_100000739446_100000210202 [1,1,0,0,0,0|1,0,1]=4 1867 B10R1.4 CNCc1ccccc1Br 207a_100102657272_100000211189 [1,1,0,0,0,0|1,0,0]=3 1868 B10R1.4 CNCc1ccccc1Br 2230a_100000689332_200000210301 [1,1,0,0,0,0|1,0,0]=3 1869 B10R1.4 CNCc1ccccc1Br 2230a_106832991635_100000184730 [1,1,0,0,0,0|1,0,0]=3 1870 B10R1.4 CNCc1ccccc1Br 26a_100102657272_100000181306 [1,1,0,0,0,0|1,0,0]=3 1871 B10R1.4 CNCc1ccccc1Br 270004a_106832991635_100000211189 [1,1,0,0,0,0|1,0,0]=3 1872 B10R1.4 CNCc1ccccc1Br 34a_100000689332_200000210301 [1,1,0,0,0,0|1,0,0]=3 1873 B10R1.4 CNCc1ccccc1Br 34a_100102657272_100000184730 [1,1,0,0,0,0|1,0,0]=3 1874 B10R1.4 CNCc1ccccc1Br 7a_106832991635_100000184730 [1,1,0,0,0,0|1,0,0]=3 1875 B10R1.4 CNCc1ccccc1C 207a_100102657272_100000211143 [1,1,0,0,0,0|1,0,0]=3 1876 B10R1.4 CNCc1ccccc1C 2230a_106832991635_100000211839 [1,1,0,0,0,0|1,0,0]=3 1877 B10R1.4 CNCc1ccccc1C 270004a_106832991635_100000211143 [1,1,0,0,0,0|1,0,0]=3 1878 B10R1.4 CNCc1ccccc1C 34a_100000174972_200000210301 [1,1,0,0,0,0|1,0,0]=3 1879 B10R1.4 CNCc1ccccc1C 34a_100102657272_100000211839 [1,1,0,0,0,0|1,0,0]=3 1880 B10R1.4 CNCc1ccccc1C 7a_106832991635_100000211839 [1,1,0,0,0,0|1,0,0]=3 1881 B10R1.4 CNCc1ccccc1Cl 207a_100102657272_100000210073 [1,1,0,0,0,0|1,0,0]=3 1882 B10R1.4 CNCc1ccccc1Cl 2230a_100000174879_200000210301 [1,1,0,0,0,0|1,0,0]=3 1883 B10R1.4 CNCc1ccccc1Cl 2230a_106832991635_100000187162 [1,1,0,0,0,0|1,0,0]=3 1884 B10R1.4 CNCc1ccccc1Cl 26a_100102657272_100000210172 [1,1,0,0,0,0|1,0,0]=3 1885 B10R1.4 CNCc1ccccc1Cl 270004a_106832991635_100000210073 [1,1,0,0,0,0|1,0,0]=3 1886 B10R1.4 CNCc1ccccc1Cl 34a_100000174879_200000210301 [1,1,0,0,0,0|1,0,0]=3 1887 B10R1.4 CNCc1ccccc1Cl 34a_100102657272_100000187162 [1,1,0,0,0,0|1,0,0]=3 1888 B10R1.4 CNCc1ccccc1Cl 7a_106832991635_100000187162 [1,1,0,0,0,0|1,0,0]=3 1889 B10R1.4 CNCc1ccccc1F 207a_100102657272_100000210811 [1,1,0,0,0,0|1,0,0]=3 1890 B10R1.4 CNCc1ccccc1F 2230a_106832991635_100000211605 [1,1,0,0,0,0|1,0,0]=3 1891 B10R1.4 CNCc1ccccc1F 270004a_106832991635_100000210811 [1,1,0,0,0,0|1,0,0]=3 1892 B10R1.4 CNCc1ccccc1F 34a_100000174869_200000210301 [1,1,0,0,0,0|1,0,0]=3 1893 B10R1.4 CNCc1ccccc1F 34a_100102657272_100000211605 [1,1,0,0,0,0|1,0,0]=3 1894 B10R1.4 CNCc1ccccc1F 7a_106832991635_100000211605 [1,1,0,0,0,0|1,0,0]=3 1895 B10R1.4 CNCc1ccccc1I 207a_100102657272_100000010305 [1,1,0,0,0,0|1,0,0]=3 1896 B10R1.4 CNCc1ccccc1I 2230a_106832991635_100011215278 [1,1,0,0,0,0|1,0,0]=3 1897 B10R1.4 CNCc1ccccc1I 270004a_106832991635_100000010305 [1,1,0,0,0,0|1,0,0]=3 1898 B10R1.4 CNCc1ccccc1I 34a_100102657272_100011215278 [1,1,0,0,0,0|1,0,0]=3 1899 B10R1.4 CNCc1ccccc1I 7a_106832991635_100011215278 [1,1,0,0,0,0|1,0,0]=3 1900 B10R1.4 CNCc1ccccc1O 271570a_203496583355_100000184654 [1,1,0,0,0,0|1,0,0]=3 1901 B10R1.4 CNCc1ccccc1O 34a_100000185550_200000210301 [1,1,0,0,0,0|1,0,0]=3 1902 B10R1.4 CNCc1cccnc1Br 2230a_100009818023_200000210301 [1,1,0,0,0,0|2,0,0]=4 1903 B10R1.4 CNCc1cccnc1Br 2230a_106832991635_100010140945 [1,1,0,0,0,0|2,0,0]=4 1904 B10R1.4 CNCc1cccnc1Br 34a_100009818023_200000210301 [1,1,0,0,0,0|2,0,0]=4 1905 B10R1.4 CNCc1cccnc1Br 34a_100102657272_100010140945 [1,1,0,0,0,0|2,0,0]=4 1906 B10R1.4 CNCc1cccnc1Br 7a_106832991635_100010140945 [1,1,0,0,0,0|2,0,0]=4 1907 B10R1.4 CNCc1cccnc1C 207a_100102657272_100000751968 [1,1,0,0,0,0|2,0,0]=4 1908 B10R1.4 CNCc1cccnc1C 2230a_106832991635_100000732876 [1,1,0,0,0,0|2,0,0]=4 1909 B10R1.4 CNCc1cccnc1C 270004a_106832991635_100000751968 [1,1,0,0,0,0|2,0,0]=4 1910 B10R1.4 CNCc1cccnc1C 34a_100102657272_100000732876 [1,1,0,0,0,0|2,0,0]=4 1911 B10R1.4 CNCc1cccnc1C 7a_106832991635_100000732876 [1,1,0,0,0,0|2,0,0]=4 1912 B10R1.4 CNCc1cccnc1Cl 2230a_100015189234_200000210301 [1,1,0,0,0,0|2,0,0]=4 1913 B10R1.4 CNCc1cccnc1Cl 2230a_106832991635_100000045678 [1,1,0,0,0,0|2,0,0]=4 1914 B10R1.4 CNCc1cccnc1Cl 34a_100015189234_200000210301 [1,1,0,0,0,0|2,0,0]=4 1915 B10R1.4 CNCc1cccnc1Cl 34a_100102657272_100000045678 [1,1,0,0,0,0|2,0,0]=4 1916 B10R1.4 CNCc1cccnc1Cl 7a_106832991635_100000045678 [1,1,0,0,0,0|2,0,0]=4 1917 B10R1.4 CNCc1cccnc1F 2230a_106832991635_100000099810 [1,1,0,0,0,0|2,0,0]=4 1918 B10R1.4 CNCc1cccnc1F 34a_100000724633_200000210301 [1,1,0,0,0,0|2,0,0]=4 1919 B10R1.4 CNCc1cccnc1F 34a_100102657272_100000099810 [1,1,0,0,0,0|2,0,0]=4 1920 B10R1.4 CNCc1cccnc1F 7a_106832991635_100000099810 [1,1,0,0,0,0|2,0,0]=4 1921 B10R1.4 CNCc1cccnc1O 207a_100102657272_100011998315 [1,1,0,0,0,0|2,0,0]=4 1922 B10R1.4 CNCc1cccnc1O 270004a_106832991635_100011998315 [1,1,0,0,0,0|2,0,0]=4 1923 B10R1.4 CNCc1cccnc1O 271570a_203496583355_103496529121 [1,1,0,0,0,0|2,0,0]=4 1924 B10R1.4 CNCc1ccncc1Br 270004a_106832991635_100000755692 [1,1,0,0,0,0|2,0,0]=4 1925 B10R1.4 CNCc1ccncc1C 2230a_106832991635_100020672808 [1,1,0,0,0,0|2,0,0]=4 1926 B10R1.4 CNCc1ccncc1C 34a_100102657272_100020672809 [1,1,0,0,0,0|2,0,0]=4 1927 B10R1.4 CNCc1ccncc1C 7a_106832991635_100020672808 [1,1,0,0,0,0|2,0,0]=4 1928 B10R1.4 CNCc1ccncc1Cl 207a_100102657272_100011934409 [1,1,0,0,0,0|2,0,0]=4 1929 B10R1.4 CNCc1ccncc1Cl 2230a_106832991635_100000763264 [1,1,0,0,0,0|2,0,0]=4 1930 B10R1.4 CNCc1ccncc1Cl 270004a_106832991635_100011934409 [1,1,0,0,0,0|2,0,0]=4 1931 B10R1.4 CNCc1ccncc1Cl 7a_106832991635_100000763264 [1,1,0,0,0,0|2,0,0]=4 1932 B10R1.4 CNCc1ccncc1F 34a_100011935246_200000210301 [1,1,0,0,0,0|2,0,0]=4 1933 B10R1.4 CNCc1cnccc1Br 270004a_106832991635_100009816821 [1,1,0,0,0,0|2,0,0]=4 1934 B10R1.4 CNCc1cnccc1C 207a_100102657272_100000685662 [1,1,0,0,0,0|2,0,0]=4 1935 B10R1.4 CNCc1cnccc1C 2230a_106832991635_100000690890 [1,1,0,0,0,0|2,0,0]=4 1936 B10R1.4 CNCc1cnccc1C 270004a_106832991635_100000685662 [1,1,0,0,0,0|2,0,0]=4 1937 B10R1.4 CNCc1cnccc1C 34a_100102657272_100000690890 [1,1,0,0,0,0|2,0,0]=4 1938 B10R1.4 CNCc1cnccc1C 7a_106832991635_100000690890 [1,1,0,0,0,0|2,0,0]=4 1939 B10R1.4 CNCc1cnccc1Cl 270004a_106832991635_100000050567 [1,1,0,0,0,0|2,0,0]=4 1940 B10R1.4 CNCc1ncccc1Br 207a_100102657272_100011934733 [1,1,0,0,0,0|2,0,0]=4 1941 B10R1.4 CNCc1ncccc1Br 2230a_106832991635_100025702911 [1,1,0,0,0,0|2,0,0]=4 1942 B10R1.4 CNCc1ncccc1Br 270004a_106832991635_100011934733 [1,1,0,0,0,0|2,0,0]=4 1943 B10R1.4 CNCc1ncccc1Br 34a_100102657272_100025702911 [1,1,0,0,0,0|2,0,0]=4 1944 B10R1.4 CNCc1ncccc1Br 7a_106832991635_100025702911 [1,1,0,0,0,0|2,0,0]=4 1945 B10R1.4 CNCc1ncccc1C 207a_100102657272_100000698913 [1,1,0,0,0,0|2,0,0]=4 1946 B10R1.4 CNCc1ncccc1C 2230a_106832991635_100000696600 [1,1,0,0,0,0|2,0,0]=4 1947 B10R1.4 CNCc1ncccc1C 270004a_106832991635_100000698913 [1,1,0,0,0,0|2,0,0]=4 1948 B10R1.4 CNCc1ncccc1C 34a_100011223789_200000210301 [1,1,0,0,0,0|2,0,0]=4 1949 B10R1.4 CNCc1ncccc1C 34a_100102657272_100000696600 [1,1,0,0,0,0|2,0,0]=4 1950 B10R1.4 CNCc1ncccc1C 7a_106832991635_100000696600 [1,1,0,0,0,0|2,0,0]=4 1951 B10R1.4 CNCc1ncccc1Cl 207a_100102657272_100012001307 [1,1,0,0,0,0|2,0,0]=4 1952 B10R1.4 CNCc1ncccc1Cl 2230a_100015189233_200000210301 [1,1,0,0,0,0|2,0,0]=4 1953 B10R1.4 CNCc1ncccc1Cl 2230a_106832991635_100000099807 [1,1,0,0,0,0|2,0,0]=4 1954 B10R1.4 CNCc1ncccc1Cl 270004a_106832991635_100012001307 [1,1,0,0,0,0|2,0,0]=4 1955 B10R1.4 CNCc1ncccc1Cl 7a_106832991635_100000099807 [1,1,0,0,0,0|2,0,0]=4 1956 B10R1.4 CNCc1ncccc1F 207a_100102657272_100011934734 [1,1,0,0,0,0|2,0,0]=4 1957 B10R1.4 CNCc1ncccc1F 2230a_106832991635_100000104219 [1,1,0,0,0,0|2,0,0]=4 1958 B10R1.4 CNCc1ncccc1F 270004a_106832991635_100011934734 [1,1,0,0,0,0|2,0,0]=4 1959 B10R1.4 CNCc1ncccc1F 34a_100000690088_200000210301 [1,1,0,0,0,0|2,0,0]=4 1960 B10R1.4 CNCc1ncccc1F 34a_100102657272_100000104219 [1,1,0,0,0,0|2,0,0]=4 1961 B10R1.4 CNCc1ncccc1F 7a_106832991635_100000104219 [1,1,0,0,0,0|2,0,0]=4 1962 B10R1.4 CNCc1ncccc1O 34a_100102657272_200020655725 [1,1,0,0,0,0|2,0,0]=4 1963 B10R1.4 CNCc1ncccc1O 7a_106832991635_200020655725 [1,1,0,0,0,0|2,0,0]=4 1964 B10R1.4 COCc1ccccc1Br 34a_100000756307_200000210301 [1,1,0,0,0,0|1,0,0]=3 1965 B10R1.4 COCc1ccccc1Br 34a_100138415774_100000184730 [1,1,0,0,0,0|1,0,0]=3 1966 B10R1.4 COCc1ccccc1Br 7a_100000756307_200000210301 [1,1,0,0,0,0|1,0,0]=3 1967 B10R1.4 COCc1ccccc1C 34a_100000698903_200000210301 [1,1,0,0,0,0|1,0,0]=3 1968 B10R1.4 COCc1ccccc1C 34a_100138415774_100000211839 [1,1,0,0,0,0|1,0,0]=3 1969 B10R1.4 COCc1ccccc1C 7a_100000698903_200000210301 [1,1,0,0,0,0|1,0,0]=3 1970 B10R1.4 COCc1ccccc1Cl 34a_100000210847_200000210301 [1,1,0,0,0,0|1,0,0]=3 1971 B10R1.4 COCc1ccccc1Cl 34a_100138415774_100000187162 [1,1,0,0,0,0|1,0,0]=3 1972 B10R1.4 COCc1ccccc1Cl 7a_100000210847_200000210301 [1,1,0,0,0,0|1,0,0]=3 1973 B10R1.4 COCc1ccccc1F 34a_100000211962_200000210301 [1,1,0,0,0,0|1,0,0]=3 1974 B10R1.4 COCc1ccccc1F 34a_100138415774_100000211605 [1,1,0,0,0,0|1,0,0]=3 1975 B10R1.4 COCc1ccccc1F 7a_100000211962_200000210301 [1,1,0,0,0,0|1,0,0]=3 1976 B10R1.4 COCc1ccccc1I 34a_100000187465_200000210301 [1,1,0,0,0,0|1,0,0]=3 1977 B10R1.4 COCc1ccccc1I 34a_100138415774_100011215278 [1,1,0,0,0,0|1,0,0]=3 1978 B10R1.4 COCc1ccccc1I 7a_100000187465_200000210301 [1,1,0,0,0,0|1,0,0]=3 1979 B10R1.4 COCc1ccccc1N 34a_100000212039_200000210301 [1,1,0,0,0,0|1,0,0]=3 1980 B10R1.4 COCc1ccccc1O 271570a_203496583355_100011493684 [1,1,0,0,0,0|1,0,0]=3 1981 B10R1.4 COCc1cccnc1Br 34a_100000719692_200000210301 [1,1,0,0,0,0|2,0,0]=4 1982 B10R1.4 COCc1cccnc1Br 34a_100138415774_100010140945 [1,1,0,0,0,0|2,0,0]=4 1983 B10R1.4 COCc1cccnc1Br 7a_100000719692_200000210301 [1,1,0,0,0,0|2,0,0]=4 1984 B10R1.4 COCc1cccnc1C 34a_100000729262_200000210301 [1,1,0,0,0,0|2,0,0]=4 1985 B10R1.4 COCc1cccnc1C 34a_100138415774_100000732876 [1,1,0,0,0,0|2,0,0]=4 1986 B10R1.4 COCc1cccnc1C 7a_100000729262_200000210301 [1,1,0,0,0,0|2,0,0]=4 1987 B10R1.4 COCc1cccnc1Cl 34a_100000748726_200000210301 [1,1,0,0,0,0|2,0,0]=4 1988 B10R1.4 COCc1cccnc1Cl 34a_100138415774_100000045678 [1,1,0,0,0,0|2,0,0]=4 1989 B10R1.4 COCc1cccnc1Cl 7a_100000748726_200000210301 [1,1,0,0,0,0|2,0,0]=4 1990 B10R1.4 COCc1cccnc1F 34a_100000079888_200000210301 [1,1,0,0,0,0|2,0,0]=4 1991 B10R1.4 COCc1cccnc1F 34a_100138415774_100000099810 [1,1,0,0,0,0|2,0,0]=4 1992 B10R1.4 COCc1cccnc1F 7a_100000079888_200000210301 [1,1,0,0,0,0|2,0,0]=4 1993 B10R1.4 COCc1ccncc1C 34a_100011997032_200000210301 [1,1,0,0,0,0|2,0,0]=4 1994 B10R1.4 COCc1ccncc1C 34a_100138415774_100020672809 [1,1,0,0,0,0|2,0,0]=4 1995 B10R1.4 COCc1ccncc1F 34a_100012172863_200000210301 [1,1,0,0,0,0|2,0,0]=4 1996 B10R1.4 COCc1cnccc1C 34a_100011996381_200000210301 [1,1,0,0,0,0|2,0,0]=4 1997 B10R1.4 COCc1cnccc1C 34a_100138415774_100000690890 [1,1,0,0,0,0|2,0,0]=4 1998 B10R1.4 COCc1cnccc1Cl 34a_100000117392_200000210301 [1,1,0,0,0,0|2,0,0]=4 1999 B10R1.4 COCc1ncccc1Br 34a_100011996772_200000210301 [1,1,0,0,0,0|2,0,0]=4 2000 B10R1.4 COCc1ncccc1Br 34a_100138415774_100025702911 [1,1,0,0,0,0|2,0,0]=4 2001 B10R1.4 COCc1ncccc1C 34a_100000698912_200000210301 [1,1,0,0,0,0|2,0,0]=4 2002 B10R1.4 COCc1ncccc1C 34a_100138415774_100000696600 [1,1,0,0,0,0|2,0,0]=4 2003 B10R1.4 COCc1ncccc1Cl 34a_100012002383_200000210301 [1,1,0,0,0,0|2,0,0]=4 2004 B10R1.4 COCc1ncccc1F 34a_100011934865_200000210301 [1,1,0,0,0,0|2,0,0]=4 2005 B10R1.4 COCc1ncccc1F 34a_100138415774_100000104219 [1,1,0,0,0,0|2,0,0]=4 2006 B10R1.4 COCc1ncccc1N 34a_114873767017_200000210301 [1,1,0,0,0,0|2,0,0]=4 2007 B10R1.4 COCc1ncccc1O 34a_100138415774_200020655725 [1,1,0,0,0,0|2,0,0]=4 2008 B10R1.4 CSCc1ccccc1Br 62a_100000184730_200000210301 [1,1,0,0,0,0|1,0,0]=3 2009 B10R1.4 CSCc1ccccc1Br 62a_200000210301_100000184730 [1,1,0,0,0,0|1,0,0]=3 2010 B10R1.4 CSCc1ccccc1C 62a_100000211839_200000210301 [1,1,0,0,0,0|1,0,0]=3 2011 B10R1.4 CSCc1ccccc1C 62a_200000210301_100000211839 [1,1,0,0,0,0|1,0,0]=3 2012 B10R1.4 CSCc1ccccc1Cl 62a_100000187162_200000210301 [1,1,0,0,0,0|1,0,0]=3 2013 B10R1.4 CSCc1ccccc1Cl 62a_200000210301_100000187162 [1,1,0,0,0,0|1,0,0]=3 2014 B10R1.4 CSCc1ccccc1F 62a_100000211605_200000210301 [1,1,0,0,0,0|1,0,0]=3 2015 B10R1.4 CSCc1ccccc1F 62a_200000210301_100000211605 [1,1,0,0,0,0|1,0,0]=3 2016 B10R1.4 CSCc1ccccc1I 62a_100011216222_200000210301 [1,1,0,0,0,0|1,0,0]=3 2017 B10R1.4 CSCc1ccccc1I 62a_200000210301_100011216222 [1,1,0,0,0,0|1,0,0]=3 2018 B10R1.4 CSCc1ccccc1O 271570a_203496583355_100000148299 [1,1,0,0,0,0|1,0,0]=3 2019 B10R1.4 CSCc1cccnc1Br 62a_100010140945_200000210301 [1,1,0,0,0,0|2,0,0]=4 2020 B10R1.4 CSCc1cccnc1Br 62a_200000210301_100010140945 [1,1,0,0,0,0|2,0,0]=4 2021 B10R1.4 CSCc1cccnc1C 62a_100000732876_200000210301 [1,1,0,0,0,0|2,0,0]=4 2022 B10R1.4 CSCc1cccnc1C 62a_200000210301_100000732876 [1,1,0,0,0,0|2,0,0]=4 2023 B10R1.4 CSCc1cccnc1Cl 62a_100000045678_200000210301 [1,1,0,0,0,0|2,0,0]=4 2024 B10R1.4 CSCc1cccnc1Cl 62a_200000210301_100000045678 [1,1,0,0,0,0|2,0,0]=4 2025 B10R1.4 CSCc1cccnc1F 62a_100000099810_200000210301 [1,1,0,0,0,0|2,0,0]=4 2026 B10R1.4 CSCc1cccnc1F 62a_200000210301_100000099810 [1,1,0,0,0,0|2,0,0]=4 2027 B10R1.4 CSCc1ccncc1C 62a_100020672808_200000210301 [1,1,0,0,0,0|2,0,0]=4 2028 B10R1.4 CSCc1ccncc1C 62a_200000210301_100020672808 [1,1,0,0,0,0|2,0,0]=4 2029 B10R1.4 CSCc1ccncc1Cl 62a_100000763264_200000210301 [1,1,0,0,0,0|2,0,0]=4 2030 B10R1.4 CSCc1ccncc1Cl 62a_200000210301_100000763264 [1,1,0,0,0,0|2,0,0]=4 2031 B10R1.4 CSCc1cnccc1C 62a_100000690890_200000210301 [1,1,0,0,0,0|2,0,0]=4 2032 B10R1.4 CSCc1cnccc1C 62a_200000210301_100000690890 [1,1,0,0,0,0|2,0,0]=4 2033 B10R1.4 CSCc1ncccc1Br 62a_100025702911_200000210301 [1,1,0,0,0,0|2,0,0]=4 2034 B10R1.4 CSCc1ncccc1Br 62a_200000210301_100025702911 [1,1,0,0,0,0|2,0,0]=4 2035 B10R1.4 CSCc1ncccc1C 62a_100000696600_200000210301 [1,1,0,0,0,0|2,0,0]=4 2036 B10R1.4 CSCc1ncccc1C 62a_200000210301_100000696600 [1,1,0,0,0,0|2,0,0]=4 2037 B10R1.4 CSCc1ncccc1Cl 62a_100000099807_200000210301 [1,1,0,0,0,0|2,0,0]=4 2038 B10R1.4 CSCc1ncccc1Cl 62a_200000210301_100000099807 [1,1,0,0,0,0|2,0,0]=4 2039 B10R1.4 CSCc1ncccc1F 62a_100000104219_200000210301 [1,1,0,0,0,0|2,0,0]=4 2040 B10R1.4 CSCc1ncccc1F 62a_200000210301_100000104219 [1,1,0,0,0,0|2,0,0]=4 2041 B10R1.4 CSCc1ncccc1O 62a_200000210301_200020655725 [1,1,0,0,0,0|2,0,0]=4 2042 B10R1.4 CSCc1ncccc1O 62a_200020655725_200000210301 [1,1,0,0,0,0|2,0,0]=4 2043 B10R1.4 Cc1ccccc1CN[13CH3] 34a_100000174972_200025704644 [1,1,0,0,0,0|1,0,0]=3 2044 B10R1.4 Cc1ccccc1CO[13CH3] 34a_100000698903_200025704644 [1,1,0,0,0,0|1,0,0]=3 2045 B10R1.4 Cc1ccccc1CO[13CH3] 7a_100000698903_200025704644 [1,1,0,0,0,0|1,0,0]=3 2046 B10R1.4 Cc1ccccc1CS[13CH3] 62a_100000211839_200025704644 [1,1,0,0,0,0|1,0,0]=3 2047 B10R1.4 Cc1ccccc1CS[13CH3] 62a_200025704644_100000211839 [1,1,0,0,0,0|1,0,0]=3 2048 B10R1.4 Cc1cccnc1CN[13CH3] 34a_100011223789_200025704644 [1,1,0,0,0,0|2,0,0]=4 2049 B10R1.4 Cc1cccnc1CO[13CH3] 34a_100000698912_200025704644 [1,1,0,0,0,0|2,0,0]=4 2050 B10R1.4 Cc1cccnc1CS[13CH3] 62a_100000696600_200025704644 [1,1,0,0,0,0|2,0,0]=4 2051 B10R1.4 Cc1cccnc1CS[13CH3] 62a_200025704644_100000696600 [1,1,0,0,0,0|2,0,0]=4 2052 B10R1.4 Cc1ccncc1CO[13CH3] 34a_100011996381_200025704644 [1,1,0,0,0,0|2,0,0]=4 2053 B10R1.4 Cc1ccncc1CS[13CH3] 62a_100000690890_200025704644 [1,1,0,0,0,0|2,0,0]=4 2054 B10R1.4 Cc1ccncc1CS[13CH3] 62a_200025704644_100000690890 [1,1,0,0,0,0|2,0,0]=4 2055 B10R1.4 Cc1cnccc1CO[13CH3] 34a_100011997032_200025704644 [1,1,0,0,0,0|2,0,0]=4 2056 B10R1.4 Cc1cnccc1CS[13CH3] 62a_100020672808_200025704644 [1,1,0,0,0,0|2,0,0]=4 2057 B10R1.4 Cc1cnccc1CS[13CH3] 62a_200025704644_100020672808 [1,1,0,0,0,0|2,0,0]=4 2058 B10R1.4 Cc1ncccc1CO[13CH3] 34a_100000729262_200025704644 [1,1,0,0,0,0|2,0,0]=4 2059 B10R1.4 Cc1ncccc1CO[13CH3] 7a_100000729262_200025704644 [1,1,0,0,0,0|2,0,0]=4 2060 B10R1.4 Cc1ncccc1CS[13CH3] 62a_100000732876_200025704644 [1,1,0,0,0,0|2,0,0]=4 2061 B10R1.4 Cc1ncccc1CS[13CH3] 62a_200025704644_100000732876 [1,1,0,0,0,0|2,0,0]=4 2062 B10R1.4 N#CCc1ccccc1O 271570a_203496583355_100000033512 [1,1,0,0,0,0|1,0,1]=4 2063 B10R1.4 NCCc1ccccc1O 271570a_203496583355_100000747383 [1,1,0,0,0,0|1,0,1]=4 2064 B10R1.4 NNCc1ccccc1O 271570a_203496583355_200016993956 [1,1,0,0,0,0|2,0,0]=4 2065 B10R1.4 OCCc1ccccc1O 271570a_203496583355_100000731337 [1,1,0,0,0,0|1,0,1]=4 2066 B10R1.4 [13CH3]NCc1ccccc1Br 2230a_100000689332_200025704644 [1,1,0,0,0,0|1,0,0]=3 2067 B10R1.4 [13CH3]NCc1ccccc1Br 34a_100000689332_200025704644 [1,1,0,0,0,0|1,0,0]=3 2068 B10R1.4 [13CH3]NCc1ccccc1Cl 2230a_100000174879_200025704644 [1,1,0,0,0,0|1,0,0]=3 2069 B10R1.4 [13CH3]NCc1ccccc1Cl 34a_100000174879_200025704644 [1,1,0,0,0,0|1,0,0]=3 2070 B10R1.4 [13CH3]NCc1ccccc1F 34a_100000174869_200025704644 [1,1,0,0,0,0|1,0,0]=3 2071 B10R1.4 [13CH3]NCc1ccccc1O 34a_100000185550_200025704644 [1,1,0,0,0,0|1,0,0]=3 2072 B10R1.4 [13CH3]NCc1cccnc1Br 2230a_100009818023_200025704644 [1,1,0,0,0,0|2,0,0]=4 2073 B10R1.4 [13CH3]NCc1cccnc1Br 34a_100009818023_200025704644 [1,1,0,0,0,0|2,0,0]=4 2074 B10R1.4 [13CH3]NCc1cccnc1Cl 2230a_100015189234_200025704644 [1,1,0,0,0,0|2,0,0]=4 2075 B10R1.4 [13CH3]NCc1cccnc1Cl 34a_100015189234_200025704644 [1,1,0,0,0,0|2,0,0]=4 2076 B10R1.4 [13CH3]NCc1cccnc1F 34a_100000724633_200025704644 [1,1,0,0,0,0|2,0,0]=4 2077 B10R1.4 [13CH3]NCc1ccncc1F 34a_100011935246_200025704644 [1,1,0,0,0,0|2,0,0]=4 2078 B10R1.4 [13CH3]NCc1ncccc1Cl 2230a_100015189233_200025704644 [1,1,0,0,0,0|2,0,0]=4 2079 B10R1.4 [13CH3]NCc1ncccc1F 34a_100000690088_200025704644 [1,1,0,0,0,0|2,0,0]=4 2080 B10R1.4 [13CH3]OCc1ccccc1Br 34a_100000756307_200025704644 [1,1,0,0,0,0|1,0,0]=3 2081 B10R1.4 [13CH3]OCc1ccccc1Br 7a_100000756307_200025704644 [1,1,0,0,0,0|1,0,0]=3 2082 B10R1.4 [13CH3]OCc1ccccc1Cl 34a_100000210847_200025704644 [1,1,0,0,0,0|1,0,0]=3 2083 B10R1.4 [13CH3]OCc1ccccc1Cl 7a_100000210847_200025704644 [1,1,0,0,0,0|1,0,0]=3 2084 B10R1.4 [13CH3]OCc1ccccc1F 34a_100000211962_200025704644 [1,1,0,0,0,0|1,0,0]=3 2085 B10R1.4 [13CH3]OCc1ccccc1F 7a_100000211962_200025704644 [1,1,0,0,0,0|1,0,0]=3 2086 B10R1.4 [13CH3]OCc1ccccc1I 34a_100000187465_200025704644 [1,1,0,0,0,0|1,0,0]=3 2087 B10R1.4 [13CH3]OCc1ccccc1I 7a_100000187465_200025704644 [1,1,0,0,0,0|1,0,0]=3 2088 B10R1.4 [13CH3]OCc1ccccc1N 34a_100000212039_200025704644 [1,1,0,0,0,0|1,0,0]=3 2089 B10R1.4 [13CH3]OCc1cccnc1Br 34a_100000719692_200025704644 [1,1,0,0,0,0|2,0,0]=4 2090 B10R1.4 [13CH3]OCc1cccnc1Br 7a_100000719692_200025704644 [1,1,0,0,0,0|2,0,0]=4 2091 B10R1.4 [13CH3]OCc1cccnc1Cl 34a_100000748726_200025704644 [1,1,0,0,0,0|2,0,0]=4 2092 B10R1.4 [13CH3]OCc1cccnc1Cl 7a_100000748726_200025704644 [1,1,0,0,0,0|2,0,0]=4 2093 B10R1.4 [13CH3]OCc1cccnc1F 34a_100000079888_200025704644 [1,1,0,0,0,0|2,0,0]=4 2094 B10R1.4 [13CH3]OCc1cccnc1F 7a_100000079888_200025704644 [1,1,0,0,0,0|2,0,0]=4 2095 B10R1.4 [13CH3]OCc1ccncc1F 34a_100012172863_200025704644 [1,1,0,0,0,0|2,0,0]=4 2096 B10R1.4 [13CH3]OCc1cnccc1Cl 34a_100000117392_200025704644 [1,1,0,0,0,0|2,0,0]=4 2097 B10R1.4 [13CH3]OCc1ncccc1Br 34a_100011996772_200025704644 [1,1,0,0,0,0|2,0,0]=4 2098 B10R1.4 [13CH3]OCc1ncccc1Cl 34a_100012002383_200025704644 [1,1,0,0,0,0|2,0,0]=4 2099 B10R1.4 [13CH3]OCc1ncccc1F 34a_100011934865_200025704644 [1,1,0,0,0,0|2,0,0]=4 2100 B10R1.4 [13CH3]OCc1ncccc1N 34a_114873767017_200025704644 [1,1,0,0,0,0|2,0,0]=4 2101 B10R1.4 [13CH3]SCc1ccccc1Br 62a_100000184730_200025704644 [1,1,0,0,0,0|1,0,0]=3 2102 B10R1.4 [13CH3]SCc1ccccc1Br 62a_200025704644_100000184730 [1,1,0,0,0,0|1,0,0]=3 2103 B10R1.4 [13CH3]SCc1ccccc1Cl 62a_100000187162_200025704644 [1,1,0,0,0,0|1,0,0]=3 2104 B10R1.4 [13CH3]SCc1ccccc1Cl 62a_200025704644_100000187162 [1,1,0,0,0,0|1,0,0]=3 2105 B10R1.4 [13CH3]SCc1ccccc1F 62a_100000211605_200025704644 [1,1,0,0,0,0|1,0,0]=3 2106 B10R1.4 [13CH3]SCc1ccccc1F 62a_200025704644_100000211605 [1,1,0,0,0,0|1,0,0]=3 2107 B10R1.4 [13CH3]SCc1ccccc1I 62a_100011216222_200025704644 [1,1,0,0,0,0|1,0,0]=3 2108 B10R1.4 [13CH3]SCc1ccccc1I 62a_200025704644_100011216222 [1,1,0,0,0,0|1,0,0]=3 2109 B10R1.4 [13CH3]SCc1cccnc1Br 62a_100010140945_200025704644 [1,1,0,0,0,0|2,0,0]=4 2110 B10R1.4 [13CH3]SCc1cccnc1Br 62a_200025704644_100010140945 [1,1,0,0,0,0|2,0,0]=4 2111 B10R1.4 [13CH3]SCc1cccnc1Cl 62a_100000045678_200025704644 [1,1,0,0,0,0|2,0,0]=4 2112 B10R1.4 [13CH3]SCc1cccnc1Cl 62a_200025704644_100000045678 [1,1,0,0,0,0|2,0,0]=4 2113 B10R1.4 [13CH3]SCc1cccnc1F 62a_100000099810_200025704644 [1,1,0,0,0,0|2,0,0]=4 2114 B10R1.4 [13CH3]SCc1cccnc1F 62a_200025704644_100000099810 [1,1,0,0,0,0|2,0,0]=4 2115 B10R1.4 [13CH3]SCc1ccncc1Cl 62a_100000763264_200025704644 [1,1,0,0,0,0|2,0,0]=4 2116 B10R1.4 [13CH3]SCc1ccncc1Cl 62a_200025704644_100000763264 [1,1,0,0,0,0|2,0,0]=4 2117 B10R1.4 [13CH3]SCc1ncccc1Br 62a_100025702911_200025704644 [1,1,0,0,0,0|2,0,0]=4 2118 B10R1.4 [13CH3]SCc1ncccc1Br 62a_200025704644_100025702911 [1,1,0,0,0,0|2,0,0]=4 2119 B10R1.4 [13CH3]SCc1ncccc1Cl 62a_100000099807_200025704644 [1,1,0,0,0,0|2,0,0]=4 2120 B10R1.4 [13CH3]SCc1ncccc1Cl 62a_200025704644_100000099807 [1,1,0,0,0,0|2,0,0]=4 2121 B10R1.4 [13CH3]SCc1ncccc1F 62a_100000104219_200025704644 [1,1,0,0,0,0|2,0,0]=4 2122 B10R1.4 [13CH3]SCc1ncccc1F 62a_200025704644_100000104219 [1,1,0,0,0,0|2,0,0]=4 2123 B10R1.4 [13CH3]SCc1ncccc1O 62a_200020655725_200025704644 [1,1,0,0,0,0|2,0,0]=4 2124 B10R1.4 [13CH3]SCc1ncccc1O 62a_200025704644_200020655725 [1,1,0,0,0,0|2,0,0]=4 2125 B10R1.10 C=C=Cc1cccc(c1)Br 271570a_100015277604_100000691529 [1,1,0,0,0,0|0,0,2]=4 2126 B10R1.10 C=C=Cc1cccc(c1)C 271570a_100015277604_100011215228 [1,1,0,0,0,0|0,0,2]=4 2127 B10R1.10 C=C=Cc1cccc(c1)Cl 271570a_100015277604_100000699651 [1,1,0,0,0,0|0,0,2]=4 2128 B10R1.10 C=C=Cc1cccc(c1)F 271570a_100015277604_100000685547 [1,1,0,0,0,0|0,0,2]=4 2129 B10R1.10 C=C=Cc1cccc(c1)N 271570a_100015277604_100000210019 [1,1,0,0,0,0|0,0,2]=4 2130 B10R1.10 C=C=Cc1cccc(c1)O 271570a_100015277604_100000211634 [1,1,0,0,0,0|0,0,2]=4 2131 B10R1.10 C=C=Cc1cccc(c1)[S] 271570a_100015277604_114929384022 [1,1,0,0,0,0|0,0,2]=4 2132 B10R1.10 C=CCc1cccc(c1)O 271570a_203496583355_100009816576 [1,1,0,0,0,0|0,0,0]=2 2133 B10R1.10 CC#Cc1cccc(c1)O 271570a_203496583355_200009843338 [1,1,0,0,0,0|0,0,2]=4 2134 B10R1.10 CC=Cc1cc(ccn1)C 271570a_100016259895_100000750283 [1,1,0,0,0,0|1,0,1]=4 2135 B10R1.10 CC=Cc1cc(ccn1)Cl 271570a_100016259895_100010167805 [1,1,0,0,0,0|1,0,1]=4 2136 B10R1.10 CC=Cc1cc(ccn1)F 271570a_100016259895_100009817058 [1,1,0,0,0,0|1,0,1]=4 2137 B10R1.10 CC=Cc1cc(ccn1)N 271570a_100016259895_100009814236 [1,1,0,0,0,0|1,0,1]=4 2138 B10R1.10 CC=Cc1cc(ccn1)O 271570a_100016259895_100000762945 [1,1,0,0,0,0|1,0,1]=4 2139 B10R1.10 CC=Cc1cc[nH]c(=O)c1 271570a_100016259895_100009816521 [1,1,0,0,0,0|1,0,1]=4 2140 B10R1.10 CC=Cc1ccc[n+](c1)C 271570a_100016259895_100009996589 [1,1,0,0,0,0|1,0,1]=4 2141 B10R1.10 CC=Cc1ccc[n+](c1)[O-] 271570a_100016259895_100009815978 [1,1,0,0,0,0|1,0,1]=4 2142 B10R1.10 CC=Cc1cccc(=O)[nH]1 271570a_100016259895_100000761760 [1,1,0,0,0,0|1,0,1]=4 2143 B10R1.10 CC=Cc1cccc(c1)Br 271570a_100016259895_100000691529 [1,1,0,0,0,0|0,0,1]=3 2144 B10R1.10 CC=Cc1cccc(c1)C 271570a_100016259895_100011215228 [1,1,0,0,0,0|0,0,1]=3 2145 B10R1.10 CC=Cc1cccc(c1)Cl 271570a_100016259895_100000699651 [1,1,0,0,0,0|0,0,1]=3 2146 B10R1.10 CC=Cc1cccc(c1)F 271570a_100016259895_100000685547 [1,1,0,0,0,0|0,0,1]=3 2147 B10R1.10 CC=Cc1cccc(c1)N 271570a_100016259895_100000210019 [1,1,0,0,0,0|0,0,1]=3 2148 B10R1.10 CC=Cc1cccc(c1)O 271570a_100016259895_100000211634 [1,1,0,0,0,0|0,0,1]=3 2149 B10R1.10 CC=Cc1cccc(c1)[S] 271570a_100016259895_114929384022 [1,1,0,0,0,0|0,0,1]=3 2150 B10R1.10 CC=Cc1cccc(n1)Br 271570a_100016259895_100000684672 [1,1,0,0,0,0|1,0,1]=4 2151 B10R1.10 CC=Cc1cccc(n1)C 271570a_100016259895_100000742759 [1,1,0,0,0,0|1,0,1]=4 2152 B10R1.10 CC=Cc1cccc(n1)F 271570a_100016259895_100009815982 [1,1,0,0,0,0|1,0,1]=4 2153 B10R1.10 CC=Cc1cccc(n1)N 271570a_100016259895_100000740741 [1,1,0,0,0,0|1,0,1]=4 2154 B10R1.10 CC=Cc1ccnc(c1)Br 271570a_100016259895_100009814637 [1,1,0,0,0,0|1,0,1]=4 2155 B10R1.10 CC=Cc1ccnc(c1)C 271570a_100016259895_100000758586 [1,1,0,0,0,0|1,0,1]=4 2156 B10R1.10 CC=Cc1ccnc(c1)Cl 271570a_100016259895_100000035001 [1,1,0,0,0,0|1,0,1]=4 2157 B10R1.10 CC=Cc1ccnc(c1)F 271570a_100016259895_100009816116 [1,1,0,0,0,0|1,0,1]=4 2158 B10R1.10 CC=Cc1ccnc(c1)N 271570a_100016259895_100000744379 [1,1,0,0,0,0|1,0,1]=4 2159 B10R1.10 CC=Cc1cncc(c1)Br 271570a_100016259895_100000728054 [1,1,0,0,0,0|1,0,1]=4 2160 B10R1.10 CC=Cc1cncc(c1)C 271570a_100016259895_100000760492 [1,1,0,0,0,0|1,0,1]=4 2161 B10R1.10 CC=Cc1cncc(c1)Cl 271570a_100016259895_100000049639 [1,1,0,0,0,0|1,0,1]=4 2162 B10R1.10 CC=Cc1cncc(c1)F 271570a_100016259895_100000744099 [1,1,0,0,0,0|1,0,1]=4 2163 B10R1.10 CC=Cc1cncc(c1)N 271570a_100016259895_100000687067 [1,1,0,0,0,0|1,0,1]=4 2164 B10R1.10 CC=Cc1cncc(c1)O 271570a_100016259895_100000754920 [1,1,0,0,0,0|1,0,1]=4 2165 B10R1.10 CCCc1cccc(c1)O 271570a_203496583355_100000694964 [1,1,0,0,0,0|0,0,1]=3 2166 B10R1.10 CCNc1cccc(c1)Br 34a_100000210019_100000210202 [1,1,0,0,0,0|1,0,1]=4 2167 B10R1.10 CCNc1cccc(c1)C 2230a_100000188690_100000210202 [1,1,0,0,0,0|1,0,1]=4 2168 B10R1.10 CCNc1cccc(c1)C 34a_100000188690_100000210202 [1,1,0,0,0,0|1,0,1]=4 2169 B10R1.10 CCNc1cccc(c1)Cl 34a_100000185859_100000210202 [1,1,0,0,0,0|1,0,1]=4 2170 B10R1.10 CCNc1cccc(c1)F 34a_100000210047_100000210202 [1,1,0,0,0,0|1,0,1]=4 2171 B10R1.10 CCNc1cccc(c1)I 34a_100000211102_100000210202 [1,1,0,0,0,0|1,0,1]=4 2172 B10R1.10 CCNc1cccc(c1)O 271570a_203496583355_100000738899 [1,1,0,0,0,0|1,0,1]=4 2173 B10R1.10 CCNc1cccc(c1)O 34a_100000210217_100000210202 [1,1,0,0,0,0|1,0,1]=4 2174 B10R1.10 CCOc1cccc(c1)Br 34a_100000210342_100000210202 [1,1,0,0,0,0|1,0,1]=4 2175 B10R1.10 CCOc1cccc(c1)Br 7a_100000210342_100000210202 [1,1,0,0,0,0|1,0,1]=4 2176 B10R1.10 CCOc1cccc(c1)C 34a_100000210337_100000210202 [1,1,0,0,0,0|1,0,1]=4 2177 B10R1.10 CCOc1cccc(c1)C 7a_100000210337_100000210202 [1,1,0,0,0,0|1,0,1]=4 2178 B10R1.10 CCOc1cccc(c1)Cl 34a_100000210295_100000210202 [1,1,0,0,0,0|1,0,1]=4 2179 B10R1.10 CCOc1cccc(c1)Cl 7a_100000210295_100000210202 [1,1,0,0,0,0|1,0,1]=4 2180 B10R1.10 CCOc1cccc(c1)F 34a_100000210426_100000210202 [1,1,0,0,0,0|1,0,1]=4 2181 B10R1.10 CCOc1cccc(c1)F 7a_100000210426_100000210202 [1,1,0,0,0,0|1,0,1]=4 2182 B10R1.10 CCOc1cccc(c1)I 34a_100000211634_100000210202 [1,1,0,0,0,0|1,0,1]=4 2183 B10R1.10 CCOc1cccc(c1)I 7a_100000211634_100000210202 [1,1,0,0,0,0|1,0,1]=4 2184 B10R1.10 CCOc1cccc(c1)N 34a_100000210217_100000210202 [1,1,0,0,0,0|1,0,1]=4 2185 B10R1.10 CCOc1cccc(c1)O 271570a_203496583355_100000170002 [1,1,0,0,0,0|1,0,1]=4 2186 B10R1.10 CCSc1cccc(c1)Br 62a_100000210202_100000691529 [1,1,0,0,0,0|1,0,1]=4 2187 B10R1.10 CCSc1cccc(c1)Br 62a_100000691529_100000210202 [1,1,0,0,0,0|1,0,1]=4 2188 B10R1.10 CCSc1cccc(c1)C 62a_100000210202_100011215228 [1,1,0,0,0,0|1,0,1]=4 2189 B10R1.10 CCSc1cccc(c1)C 62a_100011215228_100000210202 [1,1,0,0,0,0|1,0,1]=4 2190 B10R1.10 CCSc1cccc(c1)Cl 62a_100000210202_100000699651 [1,1,0,0,0,0|1,0,1]=4 2191 B10R1.10 CCSc1cccc(c1)Cl 62a_100000699651_100000210202 [1,1,0,0,0,0|1,0,1]=4 2192 B10R1.10 CCSc1cccc(c1)F 62a_100000210202_100000685547 [1,1,0,0,0,0|1,0,1]=4 2193 B10R1.10 CCSc1cccc(c1)F 62a_100000685547_100000210202 [1,1,0,0,0,0|1,0,1]=4 2194 B10R1.10 CCSc1cccc(c1)N 62a_100000210019_100000210202 [1,1,0,0,0,0|1,0,1]=4 2195 B10R1.10 CCSc1cccc(c1)N 62a_100000210202_100000210019 [1,1,0,0,0,0|1,0,1]=4 2196 B10R1.10 CCSc1cccc(c1)O 271570a_203496583355_100000703699 [1,1,0,0,0,0|1,0,1]=4 2197 B10R1.10 CCSc1cccc(c1)O 62a_100000210202_100000211634 [1,1,0,0,0,0|1,0,1]=4 2198 B10R1.10 CCSc1cccc(c1)[S] 62a_100000210202_114929384022 [1,1,0,0,0,0|1,0,1]=4 2199 B10R1.10 CCSc1cccc(c1)[S] 62a_114929384022_100000210202 [1,1,0,0,0,0|1,0,1]=4 2200 B10R1.10 CNCc1cc(ccn1)Br 2230a_106832991635_100010173614 [1,1,0,0,0,0|2,0,0]=4 2201 B10R1.10 CNCc1cc(ccn1)Br 270004a_106832991635_100009818557 [1,1,0,0,0,0|2,0,0]=4 2202 B10R1.10 CNCc1cc(ccn1)Br 34a_100102657272_100010173614 [1,1,0,0,0,0|2,0,0]=4 2203 B10R1.10 CNCc1cc(ccn1)Br 7a_106832991635_100010173614 [1,1,0,0,0,0|2,0,0]=4 2204 B10R1.10 CNCc1cc(ccn1)C 207a_100102657272_100011361488 [1,1,0,0,0,0|2,0,0]=4 2205 B10R1.10 CNCc1cc(ccn1)C 2230a_106832991635_100000718516 [1,1,0,0,0,0|2,0,0]=4 2206 B10R1.10 CNCc1cc(ccn1)C 270004a_106832991635_100011361488 [1,1,0,0,0,0|2,0,0]=4 2207 B10R1.10 CNCc1cc(ccn1)C 34a_100102657272_100000718516 [1,1,0,0,0,0|2,0,0]=4 2208 B10R1.10 CNCc1cc(ccn1)C 7a_106832991635_100000718516 [1,1,0,0,0,0|2,0,0]=4 2209 B10R1.10 CNCc1cc(ccn1)Cl 2230a_106832991635_100016988179 [1,1,0,0,0,0|2,0,0]=4 2210 B10R1.10 CNCc1cc(ccn1)Cl 270004a_106832991635_100011998288 [1,1,0,0,0,0|2,0,0]=4 2211 B10R1.10 CNCc1cc(ccn1)Cl 34a_100102657272_100016988179 [1,1,0,0,0,0|2,0,0]=4 2212 B10R1.10 CNCc1cc(ccn1)Cl 7a_106832991635_100016988179 [1,1,0,0,0,0|2,0,0]=4 2213 B10R1.10 CNCc1cc(ccn1)O 271570a_203496583355_100102954512 [1,1,0,0,0,0|2,0,0]=4 2214 B10R1.10 CNCc1cccc(=O)[nH]1 207a_100102657272_100011935257 [1,1,0,0,0,0|2,0,0]=4 2215 B10R1.10 CNCc1cccc(=O)[nH]1 2230a_100000696482_200000210301 [1,1,0,0,0,0|2,0,0]=4 2216 B10R1.10 CNCc1cccc(c1)Br 207a_100102657272_100000210085 [1,1,0,0,0,0|1,0,0]=3 2217 B10R1.10 CNCc1cccc(c1)Br 2230a_100000174977_200000210301 [1,1,0,0,0,0|1,0,0]=3 2218 B10R1.10 CNCc1cccc(c1)Br 2230a_106832991635_100000698116 [1,1,0,0,0,0|1,0,0]=3 2219 B10R1.10 CNCc1cccc(c1)Br 26a_100102657272_100000210342 [1,1,0,0,0,0|1,0,0]=3 2220 B10R1.10 CNCc1cccc(c1)Br 270004a_106832991635_100000210085 [1,1,0,0,0,0|1,0,0]=3 2221 B10R1.10 CNCc1cccc(c1)Br 34a_100000174977_200000210301 [1,1,0,0,0,0|1,0,0]=3 2222 B10R1.10 CNCc1cccc(c1)Br 34a_100102657272_100000698116 [1,1,0,0,0,0|1,0,0]=3 2223 B10R1.10 CNCc1cccc(c1)Br 7a_106832991635_100000211773 [1,1,0,0,0,0|1,0,0]=3 2224 B10R1.10 CNCc1cccc(c1)C 207a_100102657272_100000211157 [1,1,0,0,0,0|1,0,0]=3 2225 B10R1.10 CNCc1cccc(c1)C 2230a_100000185548_200000210301 [1,1,0,0,0,0|1,0,0]=3 2226 B10R1.10 CNCc1cccc(c1)C 2230a_106832991635_100000211840 [1,1,0,0,0,0|1,0,0]=3 2227 B10R1.10 CNCc1cccc(c1)C 270004a_106832991635_100000211157 [1,1,0,0,0,0|1,0,0]=3 2228 B10R1.10 CNCc1cccc(c1)C 34a_100000185548_200000210301 [1,1,0,0,0,0|1,0,0]=3 2229 B10R1.10 CNCc1cccc(c1)C 34a_100102657272_100000211840 [1,1,0,0,0,0|1,0,0]=3 2230 B10R1.10 CNCc1cccc(c1)C 7a_106832991635_100000211840 [1,1,0,0,0,0|1,0,0]=3 2231 B10R1.10 CNCc1cccc(c1)Cl 207a_100102657272_100000210801 [1,1,0,0,0,0|1,0,0]=3 2232 B10R1.10 CNCc1cccc(c1)Cl 2230a_100000174878_200000210301 [1,1,0,0,0,0|1,0,0]=3 2233 B10R1.10 CNCc1cccc(c1)Cl 2230a_106832991635_100000181238 [1,1,0,0,0,0|1,0,0]=3 2234 B10R1.10 CNCc1cccc(c1)Cl 270004a_106832991635_100000210801 [1,1,0,0,0,0|1,0,0]=3 2235 B10R1.10 CNCc1cccc(c1)Cl 34a_100000174878_200000210301 [1,1,0,0,0,0|1,0,0]=3 2236 B10R1.10 CNCc1cccc(c1)Cl 34a_100102657272_100000187163 [1,1,0,0,0,0|1,0,0]=3 2237 B10R1.10 CNCc1cccc(c1)Cl 7a_106832991635_100000187163 [1,1,0,0,0,0|1,0,0]=3 2238 B10R1.10 CNCc1cccc(c1)F 207a_100102657272_100000210812 [1,1,0,0,0,0|1,0,0]=3 2239 B10R1.10 CNCc1cccc(c1)F 2230a_100000174948_200000210301 [1,1,0,0,0,0|1,0,0]=3 2240 B10R1.10 CNCc1cccc(c1)F 2230a_106832991635_100000230114 [1,1,0,0,0,0|1,0,0]=3 2241 B10R1.10 CNCc1cccc(c1)F 270004a_106832991635_100000210812 [1,1,0,0,0,0|1,0,0]=3 2242 B10R1.10 CNCc1cccc(c1)F 34a_100000174948_200000210301 [1,1,0,0,0,0|1,0,0]=3 2243 B10R1.10 CNCc1cccc(c1)F 34a_100102657272_100000187166 [1,1,0,0,0,0|1,0,0]=3 2244 B10R1.10 CNCc1cccc(c1)F 7a_106832991635_100000230114 [1,1,0,0,0,0|1,0,0]=3 2245 B10R1.10 CNCc1cccc(c1)I 207a_100102657272_100000014684 [1,1,0,0,0,0|1,0,0]=3 2246 B10R1.10 CNCc1cccc(c1)I 2230a_100000106179_200000210301 [1,1,0,0,0,0|1,0,0]=3 2247 B10R1.10 CNCc1cccc(c1)I 2230a_106832991635_100011218688 [1,1,0,0,0,0|1,0,0]=3 2248 B10R1.10 CNCc1cccc(c1)I 270004a_106832991635_100000014684 [1,1,0,0,0,0|1,0,0]=3 2249 B10R1.10 CNCc1cccc(c1)I 34a_100000106179_200000210301 [1,1,0,0,0,0|1,0,0]=3 2250 B10R1.10 CNCc1cccc(c1)I 34a_100102657272_100011218688 [1,1,0,0,0,0|1,0,0]=3 2251 B10R1.10 CNCc1cccc(c1)I 7a_106832991635_100011218688 [1,1,0,0,0,0|1,0,0]=3 2252 B10R1.10 CNCc1cccc(c1)O 207a_100102657272_100000188321 [1,1,0,0,0,0|1,0,0]=3 2253 B10R1.10 CNCc1cccc(c1)O 2230a_100000743036_200000210301 [1,1,0,0,0,0|1,0,0]=3 2254 B10R1.10 CNCc1cccc(c1)O 2230a_106832991635_100011660834 [1,1,0,0,0,0|1,0,0]=3 2255 B10R1.10 CNCc1cccc(c1)O 270004a_106832991635_100000188321 [1,1,0,0,0,0|1,0,0]=3 2256 B10R1.10 CNCc1cccc(c1)O 271570a_203496583355_100000187585 [1,1,0,0,0,0|1,0,0]=3 2257 B10R1.10 CNCc1cccc(c1)O 34a_100000743036_200000210301 [1,1,0,0,0,0|1,0,0]=3 2258 B10R1.10 CNCc1cccc(c1)O 34a_100102657272_100011660834 [1,1,0,0,0,0|1,0,0]=3 2259 B10R1.10 CNCc1cccc(c1)O 7a_106832991635_100000084143 [1,1,0,0,0,0|1,0,0]=3 2260 B10R1.10 CNCc1cccc(n1)Br 2230a_100016987751_200000210301 [1,1,0,0,0,0|2,0,0]=4 2261 B10R1.10 CNCc1cccc(n1)Br 2230a_106832991635_100009889011 [1,1,0,0,0,0|2,0,0]=4 2262 B10R1.10 CNCc1cccc(n1)Br 270004a_106832991635_100000688028 [1,1,0,0,0,0|2,0,0]=4 2263 B10R1.10 CNCc1cccc(n1)Br 34a_100102657272_100009889011 [1,1,0,0,0,0|2,0,0]=4 2264 B10R1.10 CNCc1cccc(n1)Br 7a_106832991635_100009889011 [1,1,0,0,0,0|2,0,0]=4 2265 B10R1.10 CNCc1cccc(n1)C 207a_100102657272_100011215050 [1,1,0,0,0,0|2,0,0]=4 2266 B10R1.10 CNCc1cccc(n1)C 2230a_106832991635_100000757606 [1,1,0,0,0,0|2,0,0]=4 2267 B10R1.10 CNCc1cccc(n1)C 270004a_106832991635_100011215050 [1,1,0,0,0,0|2,0,0]=4 2268 B10R1.10 CNCc1cccc(n1)C 34a_100000701342_200000210301 [1,1,0,0,0,0|2,0,0]=4 2269 B10R1.10 CNCc1cccc(n1)C 34a_100102657272_100000757606 [1,1,0,0,0,0|2,0,0]=4 2270 B10R1.10 CNCc1cccc(n1)C 7a_106832991635_100000757606 [1,1,0,0,0,0|2,0,0]=4 2271 B10R1.10 CNCc1cccc(n1)Cl 2230a_100016990191_200000210301 [1,1,0,0,0,0|2,0,0]=4 2272 B10R1.10 CNCc1cccc(n1)Cl 2230a_106832991635_100000086093 [1,1,0,0,0,0|2,0,0]=4 2273 B10R1.10 CNCc1cccc(n1)Cl 270004a_106832991635_100011361687 [1,1,0,0,0,0|2,0,0]=4 2274 B10R1.10 CNCc1cccc(n1)Cl 34a_100102657272_100000086093 [1,1,0,0,0,0|2,0,0]=4 2275 B10R1.10 CNCc1cccc(n1)Cl 7a_106832991635_100000086093 [1,1,0,0,0,0|2,0,0]=4 2276 B10R1.10 CNCc1cccc(n1)F 2230a_100015188798_200000210301 [1,1,0,0,0,0|2,0,0]=4 2277 B10R1.10 CNCc1cccc(n1)F 2230a_106832991635_100009819644 [1,1,0,0,0,0|2,0,0]=4 2278 B10R1.10 CNCc1cccc(n1)F 270004a_106832991635_100000050434 [1,1,0,0,0,0|2,0,0]=4 2279 B10R1.10 CNCc1cccc(n1)F 34a_100015188798_200000210301 [1,1,0,0,0,0|2,0,0]=4 2280 B10R1.10 CNCc1cccc(n1)F 34a_100102657272_100009819644 [1,1,0,0,0,0|2,0,0]=4 2281 B10R1.10 CNCc1cccc(n1)F 7a_106832991635_100009819644 [1,1,0,0,0,0|2,0,0]=4 2282 B10R1.10 CNCc1cccc(n1)O 271570a_203496583355_106354212997 [1,1,0,0,0,0|2,0,0]=4 2283 B10R1.10 CNCc1ccnc(c1)Br 2230a_100025757509_200000210301 [1,1,0,0,0,0|2,0,0]=4 2284 B10R1.10 CNCc1ccnc(c1)Br 2230a_106832991635_100010243470 [1,1,0,0,0,0|2,0,0]=4 2285 B10R1.10 CNCc1ccnc(c1)Br 270004a_106832991635_100009814634 [1,1,0,0,0,0|2,0,0]=4 2286 B10R1.10 CNCc1ccnc(c1)Br 34a_100025757509_200000210301 [1,1,0,0,0,0|2,0,0]=4 2287 B10R1.10 CNCc1ccnc(c1)Br 34a_100102657272_100010243470 [1,1,0,0,0,0|2,0,0]=4 2288 B10R1.10 CNCc1ccnc(c1)Br 7a_106832991635_100010254460 [1,1,0,0,0,0|2,0,0]=4 2289 B10R1.10 CNCc1ccnc(c1)C 207a_100102657272_100011361630 [1,1,0,0,0,0|2,0,0]=4 2290 B10R1.10 CNCc1ccnc(c1)C 2230a_106832991635_200020672517 [1,1,0,0,0,0|2,0,0]=4 2291 B10R1.10 CNCc1ccnc(c1)C 270004a_106832991635_100011361630 [1,1,0,0,0,0|2,0,0]=4 2292 B10R1.10 CNCc1ccnc(c1)C 34a_100011934566_200000210301 [1,1,0,0,0,0|2,0,0]=4 2293 B10R1.10 CNCc1ccnc(c1)C 34a_100102657272_200020672517 [1,1,0,0,0,0|2,0,0]=4 2294 B10R1.10 CNCc1ccnc(c1)C 7a_106832991635_200020672517 [1,1,0,0,0,0|2,0,0]=4 2295 B10R1.10 CNCc1ccnc(c1)Cl 2230a_100015205668_200000210301 [1,1,0,0,0,0|2,0,0]=4 2296 B10R1.10 CNCc1ccnc(c1)Cl 2230a_106832991635_100000764220 [1,1,0,0,0,0|2,0,0]=4 2297 B10R1.10 CNCc1ccnc(c1)Cl 270004a_106832991635_100011290808 [1,1,0,0,0,0|2,0,0]=4 2298 B10R1.10 CNCc1ccnc(c1)Cl 34a_100015205668_200000210301 [1,1,0,0,0,0|2,0,0]=4 2299 B10R1.10 CNCc1ccnc(c1)Cl 34a_100102657272_100000764220 [1,1,0,0,0,0|2,0,0]=4 2300 B10R1.10 CNCc1ccnc(c1)Cl 7a_106832991635_100000764220 [1,1,0,0,0,0|2,0,0]=4 2301 B10R1.10 CNCc1ccnc(c1)F 2230a_100015188774_200000210301 [1,1,0,0,0,0|2,0,0]=4 2302 B10R1.10 CNCc1ccnc(c1)F 270004a_106832991635_100000068331 [1,1,0,0,0,0|2,0,0]=4 2303 B10R1.10 CNCc1ccnc(c1)F 34a_100015188774_200000210301 [1,1,0,0,0,0|2,0,0]=4 2304 B10R1.10 CNCc1ccnc(c1)O 207a_100102657272_100000688113 [1,1,0,0,0,0|2,0,0]=4 2305 B10R1.10 CNCc1cncc(c1)Br 207a_100102657272_100000687066 [1,1,0,0,0,0|2,0,0]=4 2306 B10R1.10 CNCc1cncc(c1)Br 2230a_106832991635_100000738771 [1,1,0,0,0,0|2,0,0]=4 2307 B10R1.10 CNCc1cncc(c1)Br 270004a_106832991635_100000687066 [1,1,0,0,0,0|2,0,0]=4 2308 B10R1.10 CNCc1cncc(c1)Br 34a_100102657272_100000738771 [1,1,0,0,0,0|2,0,0]=4 2309 B10R1.10 CNCc1cncc(c1)Br 7a_106832991635_100000738771 [1,1,0,0,0,0|2,0,0]=4 2310 B10R1.10 CNCc1cncc(c1)C 207a_100102657272_100011998712 [1,1,0,0,0,0|2,0,0]=4 2311 B10R1.10 CNCc1cncc(c1)C 2230a_100000692839_200000210301 [1,1,0,0,0,0|2,0,0]=4 2312 B10R1.10 CNCc1cncc(c1)C 2230a_106832991635_100000716715 [1,1,0,0,0,0|2,0,0]=4 2313 B10R1.10 CNCc1cncc(c1)C 270004a_106832991635_100011998712 [1,1,0,0,0,0|2,0,0]=4 2314 B10R1.10 CNCc1cncc(c1)C 34a_100000692839_200000210301 [1,1,0,0,0,0|2,0,0]=4 2315 B10R1.10 CNCc1cncc(c1)C 34a_100102657272_100000716715 [1,1,0,0,0,0|2,0,0]=4 2316 B10R1.10 CNCc1cncc(c1)C 7a_106832991635_100000716715 [1,1,0,0,0,0|2,0,0]=4 2317 B10R1.10 CNCc1cncc(c1)Cl 207a_100102657272_100000088910 [1,1,0,0,0,0|2,0,0]=4 2318 B10R1.10 CNCc1cncc(c1)Cl 2230a_106832991635_100016992070 [1,1,0,0,0,0|2,0,0]=4 2319 B10R1.10 CNCc1cncc(c1)Cl 2230a_200020614424_200000210301 [1,1,0,0,0,0|2,0,0]=4 2320 B10R1.10 CNCc1cncc(c1)Cl 270004a_106832991635_100000088910 [1,1,0,0,0,0|2,0,0]=4 2321 B10R1.10 CNCc1cncc(c1)Cl 34a_100102657272_100016992070 [1,1,0,0,0,0|2,0,0]=4 2322 B10R1.10 CNCc1cncc(c1)Cl 7a_106832991635_100016992070 [1,1,0,0,0,0|2,0,0]=4 2323 B10R1.10 CNCc1cncc(c1)F 207a_100102657272_100011361476 [1,1,0,0,0,0|2,0,0]=4 2324 B10R1.10 CNCc1cncc(c1)F 2230a_100011962886_200000210301 [1,1,0,0,0,0|2,0,0]=4 2325 B10R1.10 CNCc1cncc(c1)F 2230a_106832991635_100000725299 [1,1,0,0,0,0|2,0,0]=4 2326 B10R1.10 CNCc1cncc(c1)F 270004a_106832991635_100011361476 [1,1,0,0,0,0|2,0,0]=4 2327 B10R1.10 CNCc1cncc(c1)F 34a_100011962886_200000210301 [1,1,0,0,0,0|2,0,0]=4 2328 B10R1.10 CNCc1cncc(c1)F 34a_100102657272_100000725299 [1,1,0,0,0,0|2,0,0]=4 2329 B10R1.10 CNCc1cncc(c1)F 7a_106832991635_100000725299 [1,1,0,0,0,0|2,0,0]=4 2330 B10R1.10 CNCc1cncc(c1)O 207a_100102657272_100012187055 [1,1,0,0,0,0|2,0,0]=4 2331 B10R1.10 CNCc1cncc(c1)O 270004a_106832991635_100012187055 [1,1,0,0,0,0|2,0,0]=4 2332 B10R1.10 CNCc1cncc(c1)O 271570a_203496583355_103549770560 [1,1,0,0,0,0|2,0,0]=4 2333 B10R1.10 COCc1cc(ccn1)Br 34a_100138415774_100010173614 [1,1,0,0,0,0|2,0,0]=4 2334 B10R1.10 COCc1cc(ccn1)C 34a_100011998357_200000210301 [1,1,0,0,0,0|2,0,0]=4 2335 B10R1.10 COCc1cc(ccn1)C 34a_100138415774_100000718516 [1,1,0,0,0,0|2,0,0]=4 2336 B10R1.10 COCc1cc(ccn1)Cl 34a_100000748867_200000210301 [1,1,0,0,0,0|2,0,0]=4 2337 B10R1.10 COCc1cc(ccn1)Cl 34a_100138415774_100016988179 [1,1,0,0,0,0|2,0,0]=4 2338 B10R1.10 COCc1cc(ccn1)N 34a_100000692640_200000210301 [1,1,0,0,0,0|2,0,0]=4 2339 B10R1.10 COCc1ccc[n+](c1)[O-] 34a_100000037817_200000210301 [1,1,0,0,0,0|2,0,0]=4 2340 B10R1.10 COCc1ccc[n+](c1)[O-] 7a_100000037817_200000210301 [1,1,0,0,0,0|2,0,0]=4 2341 B10R1.10 COCc1cccc(c1)Br 34a_100000687537_200000210301 [1,1,0,0,0,0|1,0,0]=3 2342 B10R1.10 COCc1cccc(c1)Br 34a_100138415774_100000698116 [1,1,0,0,0,0|1,0,0]=3 2343 B10R1.10 COCc1cccc(c1)Br 7a_100000687537_200000210301 [1,1,0,0,0,0|1,0,0]=3 2344 B10R1.10 COCc1cccc(c1)C 34a_100011217746_200000210301 [1,1,0,0,0,0|1,0,0]=3 2345 B10R1.10 COCc1cccc(c1)C 34a_100138415774_100000211840 [1,1,0,0,0,0|1,0,0]=3 2346 B10R1.10 COCc1cccc(c1)C 7a_100011217746_200000210301 [1,1,0,0,0,0|1,0,0]=3 2347 B10R1.10 COCc1cccc(c1)Cl 34a_100000241301_200000210301 [1,1,0,0,0,0|1,0,0]=3 2348 B10R1.10 COCc1cccc(c1)Cl 34a_100138415774_100000187163 [1,1,0,0,0,0|1,0,0]=3 2349 B10R1.10 COCc1cccc(c1)Cl 7a_100000241301_200000210301 [1,1,0,0,0,0|1,0,0]=3 2350 B10R1.10 COCc1cccc(c1)F 34a_100000210976_200000210301 [1,1,0,0,0,0|1,0,0]=3 2351 B10R1.10 COCc1cccc(c1)F 34a_100138415774_100000187166 [1,1,0,0,0,0|1,0,0]=3 2352 B10R1.10 COCc1cccc(c1)F 7a_100000210976_200000210301 [1,1,0,0,0,0|1,0,0]=3 2353 B10R1.10 COCc1cccc(c1)I 34a_100011215336_200000210301 [1,1,0,0,0,0|1,0,0]=3 2354 B10R1.10 COCc1cccc(c1)I 34a_100138415774_100011218688 [1,1,0,0,0,0|1,0,0]=3 2355 B10R1.10 COCc1cccc(c1)I 7a_100011215336_200000210301 [1,1,0,0,0,0|1,0,0]=3 2356 B10R1.10 COCc1cccc(c1)N 34a_100000211919_200000210301 [1,1,0,0,0,0|1,0,0]=3 2357 B10R1.10 COCc1cccc(c1)O 271570a_203496583355_100011493687 [1,1,0,0,0,0|1,0,0]=3 2358 B10R1.10 COCc1cccc(c1)O 34a_100138415774_100011660834 [1,1,0,0,0,0|1,0,0]=3 2359 B10R1.10 COCc1cccc(n1)Br 34a_100000694195_200000210301 [1,1,0,0,0,0|2,0,0]=4 2360 B10R1.10 COCc1cccc(n1)Br 34a_100138415774_100009889011 [1,1,0,0,0,0|2,0,0]=4 2361 B10R1.10 COCc1cccc(n1)C 34a_100000690600_200000210301 [1,1,0,0,0,0|2,0,0]=4 2362 B10R1.10 COCc1cccc(n1)C 34a_100138415774_100000757606 [1,1,0,0,0,0|2,0,0]=4 2363 B10R1.10 COCc1cccc(n1)Cl 34a_100011998359_200000210301 [1,1,0,0,0,0|2,0,0]=4 2364 B10R1.10 COCc1cccc(n1)Cl 34a_100138415774_100000086093 [1,1,0,0,0,0|2,0,0]=4 2365 B10R1.10 COCc1cccc(n1)F 34a_100000086748_200000210301 [1,1,0,0,0,0|2,0,0]=4 2366 B10R1.10 COCc1cccc(n1)F 34a_100138415774_100009819644 [1,1,0,0,0,0|2,0,0]=4 2367 B10R1.10 COCc1ccnc(c1)Br 34a_100009814636_200000210301 [1,1,0,0,0,0|2,0,0]=4 2368 B10R1.10 COCc1ccnc(c1)Br 34a_100138415774_100010243470 [1,1,0,0,0,0|2,0,0]=4 2369 B10R1.10 COCc1ccnc(c1)Br 7a_100009814636_200000210301 [1,1,0,0,0,0|2,0,0]=4 2370 B10R1.10 COCc1ccnc(c1)C 34a_100011998630_200000210301 [1,1,0,0,0,0|2,0,0]=4 2371 B10R1.10 COCc1ccnc(c1)C 34a_100138415774_200020672517 [1,1,0,0,0,0|2,0,0]=4 2372 B10R1.10 COCc1ccnc(c1)Cl 34a_100000748751_200000210301 [1,1,0,0,0,0|2,0,0]=4 2373 B10R1.10 COCc1ccnc(c1)Cl 34a_100138415774_100000764220 [1,1,0,0,0,0|2,0,0]=4 2374 B10R1.10 COCc1ccnc(c1)F 34a_100000082451_200000210301 [1,1,0,0,0,0|2,0,0]=4 2375 B10R1.10 COCc1cncc(c1)Br 34a_100011259137_200000210301 [1,1,0,0,0,0|2,0,0]=4 2376 B10R1.10 COCc1cncc(c1)Br 34a_100138415774_100000738771 [1,1,0,0,0,0|2,0,0]=4 2377 B10R1.10 COCc1cncc(c1)Br 7a_100011259137_200000210301 [1,1,0,0,0,0|2,0,0]=4 2378 B10R1.10 COCc1cncc(c1)C 34a_100011998709_200000210301 [1,1,0,0,0,0|2,0,0]=4 2379 B10R1.10 COCc1cncc(c1)C 34a_100138415774_100000716715 [1,1,0,0,0,0|2,0,0]=4 2380 B10R1.10 COCc1cncc(c1)C 7a_100011998709_200000210301 [1,1,0,0,0,0|2,0,0]=4 2381 B10R1.10 COCc1cncc(c1)Cl 34a_100000092867_200000210301 [1,1,0,0,0,0|2,0,0]=4 2382 B10R1.10 COCc1cncc(c1)Cl 34a_100138415774_100016992070 [1,1,0,0,0,0|2,0,0]=4 2383 B10R1.10 COCc1cncc(c1)Cl 7a_100000092867_200000210301 [1,1,0,0,0,0|2,0,0]=4 2384 B10R1.10 COCc1cncc(c1)F 34a_100011962875_200000210301 [1,1,0,0,0,0|2,0,0]=4 2385 B10R1.10 COCc1cncc(c1)F 34a_100138415774_100000725299 [1,1,0,0,0,0|2,0,0]=4 2386 B10R1.10 COCc1cncc(c1)F 7a_100011962875_200000210301 [1,1,0,0,0,0|2,0,0]=4 2387 B10R1.10 COCc1cncc(c1)N 34a_100000085308_200000210301 [1,1,0,0,0,0|2,0,0]=4 2388 B10R1.10 CSCc1cc(ccn1)Br 62a_100010173614_200000210301 [1,1,0,0,0,0|2,0,0]=4 2389 B10R1.10 CSCc1cc(ccn1)Br 62a_200000210301_100010173614 [1,1,0,0,0,0|2,0,0]=4 2390 B10R1.10 CSCc1cc(ccn1)C 62a_100000718516_200000210301 [1,1,0,0,0,0|2,0,0]=4 2391 B10R1.10 CSCc1cc(ccn1)C 62a_200000210301_100000718516 [1,1,0,0,0,0|2,0,0]=4 2392 B10R1.10 CSCc1cc(ccn1)Cl 62a_100016988179_200000210301 [1,1,0,0,0,0|2,0,0]=4 2393 B10R1.10 CSCc1cc(ccn1)Cl 62a_200000210301_100016988179 [1,1,0,0,0,0|2,0,0]=4 2394 B10R1.10 CSCc1cccc(c1)Br 62a_100000211773_200000210301 [1,1,0,0,0,0|1,0,0]=3 2395 B10R1.10 CSCc1cccc(c1)Br 62a_200000210301_100000211773 [1,1,0,0,0,0|1,0,0]=3 2396 B10R1.10 CSCc1cccc(c1)C 62a_100000211840_200000210301 [1,1,0,0,0,0|1,0,0]=3 2397 B10R1.10 CSCc1cccc(c1)C 62a_200000210301_100000211840 [1,1,0,0,0,0|1,0,0]=3 2398 B10R1.10 CSCc1cccc(c1)Cl 62a_100000187163_200000210301 [1,1,0,0,0,0|1,0,0]=3 2399 B10R1.10 CSCc1cccc(c1)Cl 62a_200000210301_100000187163 [1,1,0,0,0,0|1,0,0]=3 2400 B10R1.10 CSCc1cccc(c1)F 62a_100000230114_200000210301 [1,1,0,0,0,0|1,0,0]=3 2401 B10R1.10 CSCc1cccc(c1)F 62a_200000210301_100000230114 [1,1,0,0,0,0|1,0,0]=3 2402 B10R1.10 CSCc1cccc(c1)I 62a_100011218688_200000210301 [1,1,0,0,0,0|1,0,0]=3 2403 B10R1.10 CSCc1cccc(c1)I 62a_200000210301_100011218688 [1,1,0,0,0,0|1,0,0]=3 2404 B10R1.10 CSCc1cccc(c1)O 62a_100011660834_200000210301 [1,1,0,0,0,0|1,0,0]=3 2405 B10R1.10 CSCc1cccc(c1)O 62a_200000210301_100011660834 [1,1,0,0,0,0|1,0,0]=3 2406 B10R1.10 CSCc1cccc(n1)Br 62a_100009889011_200000210301 [1,1,0,0,0,0|2,0,0]=4 2407 B10R1.10 CSCc1cccc(n1)Br 62a_200000210301_100009889011 [1,1,0,0,0,0|2,0,0]=4 2408 B10R1.10 CSCc1cccc(n1)C 62a_100000757606_200000210301 [1,1,0,0,0,0|2,0,0]=4 2409 B10R1.10 CSCc1cccc(n1)C 62a_200000210301_100000757606 [1,1,0,0,0,0|2,0,0]=4 2410 B10R1.10 CSCc1cccc(n1)Cl 62a_100000086093_200000210301 [1,1,0,0,0,0|2,0,0]=4 2411 B10R1.10 CSCc1cccc(n1)Cl 62a_200000210301_100000086093 [1,1,0,0,0,0|2,0,0]=4 2412 B10R1.10 CSCc1cccc(n1)F 62a_100009819644_200000210301 [1,1,0,0,0,0|2,0,0]=4 2413 B10R1.10 CSCc1cccc(n1)F 62a_200000210301_100009819644 [1,1,0,0,0,0|2,0,0]=4 2414 B10R1.10 CSCc1ccnc(c1)Br 62a_100010254460_200000210301 [1,1,0,0,0,0|2,0,0]=4 2415 B10R1.10 CSCc1ccnc(c1)Br 62a_200000210301_100010243470 [1,1,0,0,0,0|2,0,0]=4 2416 B10R1.10 CSCc1ccnc(c1)C 62a_200000210301_200020672517 [1,1,0,0,0,0|2,0,0]=4 2417 B10R1.10 CSCc1ccnc(c1)C 62a_200020672517_200000210301 [1,1,0,0,0,0|2,0,0]=4 2418 B10R1.10 CSCc1ccnc(c1)Cl 62a_100000764220_200000210301 [1,1,0,0,0,0|2,0,0]=4 2419 B10R1.10 CSCc1ccnc(c1)Cl 62a_200000210301_100000764220 [1,1,0,0,0,0|2,0,0]=4 2420 B10R1.10 CSCc1cncc(c1)Br 62a_100000738771_200000210301 [1,1,0,0,0,0|2,0,0]=4 2421 B10R1.10 CSCc1cncc(c1)Br 62a_200000210301_100000738771 [1,1,0,0,0,0|2,0,0]=4 2422 B10R1.10 CSCc1cncc(c1)C 62a_100000716715_200000210301 [1,1,0,0,0,0|2,0,0]=4 2423 B10R1.10 CSCc1cncc(c1)C 62a_200000210301_100000716715 [1,1,0,0,0,0|2,0,0]=4 2424 B10R1.10 CSCc1cncc(c1)Cl 62a_100016992070_200000210301 [1,1,0,0,0,0|2,0,0]=4 2425 B10R1.10 CSCc1cncc(c1)Cl 62a_200000210301_100016992070 [1,1,0,0,0,0|2,0,0]=4 2426 B10R1.10 CSCc1cncc(c1)F 62a_100000725299_200000210301 [1,1,0,0,0,0|2,0,0]=4 2427 B10R1.10 CSCc1cncc(c1)F 62a_200000210301_100000725299 [1,1,0,0,0,0|2,0,0]=4 2428 B10R1.10 Cc1cc(ccn1)CN[13CH3] 34a_100011934566_200025704644 [1,1,0,0,0,0|2,0,0]=4 2429 B10R1.10 Cc1cc(ccn1)CO[13CH3] 34a_100011998630_200025704644 [1,1,0,0,0,0|2,0,0]=4 2430 B10R1.10 Cc1cc(ccn1)CS[13CH3] 62a_200020672517_200025704644 [1,1,0,0,0,0|2,0,0]=4 2431 B10R1.10 Cc1cc(ccn1)CS[13CH3] 62a_200025704644_200020672517 [1,1,0,0,0,0|2,0,0]=4 2432 B10R1.10 Cc1cccc(c1)CN[13CH3] 2230a_100000185548_200025704644 [1,1,0,0,0,0|1,0,0]=3 2433 B10R1.10 Cc1cccc(c1)CN[13CH3] 34a_100000185548_200025704644 [1,1,0,0,0,0|1,0,0]=3 2434 B10R1.10 Cc1cccc(c1)CO[13CH3] 34a_100011217746_200025704644 [1,1,0,0,0,0|1,0,0]=3 2435 B10R1.10 Cc1cccc(c1)CO[13CH3] 7a_100011217746_200025704644 [1,1,0,0,0,0|1,0,0]=3 2436 B10R1.10 Cc1cccc(c1)CS[13CH3] 62a_100000211840_200025704644 [1,1,0,0,0,0|1,0,0]=3 2437 B10R1.10 Cc1cccc(c1)CS[13CH3] 62a_200025704644_100000211840 [1,1,0,0,0,0|1,0,0]=3 2438 B10R1.10 Cc1cccc(n1)CN[13CH3] 34a_100000701342_200025704644 [1,1,0,0,0,0|2,0,0]=4 2439 B10R1.10 Cc1cccc(n1)CO[13CH3] 34a_100000690600_200025704644 [1,1,0,0,0,0|2,0,0]=4 2440 B10R1.10 Cc1cccc(n1)CS[13CH3] 62a_100000757606_200025704644 [1,1,0,0,0,0|2,0,0]=4 2441 B10R1.10 Cc1cccc(n1)CS[13CH3] 62a_200025704644_100000757606 [1,1,0,0,0,0|2,0,0]=4 2442 B10R1.10 Cc1ccnc(c1)CO[13CH3] 34a_100011998357_200025704644 [1,1,0,0,0,0|2,0,0]=4 2443 B10R1.10 Cc1ccnc(c1)CS[13CH3] 62a_100000718516_200025704644 [1,1,0,0,0,0|2,0,0]=4 2444 B10R1.10 Cc1ccnc(c1)CS[13CH3] 62a_200025704644_100000718516 [1,1,0,0,0,0|2,0,0]=4 2445 B10R1.10 Cc1cncc(c1)CN[13CH3] 2230a_100000692839_200025704644 [1,1,0,0,0,0|2,0,0]=4 2446 B10R1.10 Cc1cncc(c1)CN[13CH3] 34a_100000692839_200025704644 [1,1,0,0,0,0|2,0,0]=4 2447 B10R1.10 Cc1cncc(c1)CO[13CH3] 34a_100011998709_200025704644 [1,1,0,0,0,0|2,0,0]=4 2448 B10R1.10 Cc1cncc(c1)CO[13CH3] 7a_100011998709_200025704644 [1,1,0,0,0,0|2,0,0]=4 2449 B10R1.10 Cc1cncc(c1)CS[13CH3] 62a_100000716715_200025704644 [1,1,0,0,0,0|2,0,0]=4 2450 B10R1.10 Cc1cncc(c1)CS[13CH3] 62a_200025704644_100000716715 [1,1,0,0,0,0|2,0,0]=4 2451 B10R1.10 N#CCc1cccc(c1)O 271570a_203496583355_100000034040 [1,1,0,0,0,0|1,0,1]=4 2452 B10R1.10 NCCc1cccc(c1)O 271570a_203496583355_100011207229 [1,1,0,0,0,0|1,0,1]=4 2453 B10R1.10 NNCc1cccc(c1)O 271570a_203496583355_100000686200 [1,1,0,0,0,0|2,0,0]=4 2454 B10R1.10 O=CCc1cccc(c1)O 271570a_203496583355_200000698211 [1,1,0,0,0,0|1,0,0]=3 2455 B10R1.10 OCCc1cccc(c1)O 271570a_203496583355_100011217444 [1,1,0,0,0,0|1,0,1]=4 2456 B10R1.10 [13CH3]NCc1cccc(=O)[nH]1 2230a_100000696482_200025704644 [1,1,0,0,0,0|2,0,0]=4 2457 B10R1.10 [13CH3]NCc1cccc(c1)Br 2230a_100000174977_200025704644 [1,1,0,0,0,0|1,0,0]=3 2458 B10R1.10 [13CH3]NCc1cccc(c1)Br 34a_100000174977_200025704644 [1,1,0,0,0,0|1,0,0]=3 2459 B10R1.10 [13CH3]NCc1cccc(c1)Cl 2230a_100000174878_200025704644 [1,1,0,0,0,0|1,0,0]=3 2460 B10R1.10 [13CH3]NCc1cccc(c1)Cl 34a_100000174878_200025704644 [1,1,0,0,0,0|1,0,0]=3 2461 B10R1.10 [13CH3]NCc1cccc(c1)F 2230a_100000174948_200025704644 [1,1,0,0,0,0|1,0,0]=3 2462 B10R1.10 [13CH3]NCc1cccc(c1)F 34a_100000174948_200025704644 [1,1,0,0,0,0|1,0,0]=3 2463 B10R1.10 [13CH3]NCc1cccc(c1)I 2230a_100000106179_200025704644 [1,1,0,0,0,0|1,0,0]=3 2464 B10R1.10 [13CH3]NCc1cccc(c1)I 34a_100000106179_200025704644 [1,1,0,0,0,0|1,0,0]=3 2465 B10R1.10 [13CH3]NCc1cccc(c1)O 2230a_100000743036_200025704644 [1,1,0,0,0,0|1,0,0]=3 2466 B10R1.10 [13CH3]NCc1cccc(c1)O 34a_100000743036_200025704644 [1,1,0,0,0,0|1,0,0]=3 2467 B10R1.10 [13CH3]NCc1cccc(n1)Br 2230a_100016987751_200025704644 [1,1,0,0,0,0|2,0,0]=4 2468 B10R1.10 [13CH3]NCc1cccc(n1)Cl 2230a_100016990191_200025704644 [1,1,0,0,0,0|2,0,0]=4 2469 B10R1.10 [13CH3]NCc1cccc(n1)F 2230a_100015188798_200025704644 [1,1,0,0,0,0|2,0,0]=4 2470 B10R1.10 [13CH3]NCc1cccc(n1)F 34a_100015188798_200025704644 [1,1,0,0,0,0|2,0,0]=4 2471 B10R1.10 [13CH3]NCc1ccnc(c1)Br 2230a_100025757509_200025704644 [1,1,0,0,0,0|2,0,0]=4 2472 B10R1.10 [13CH3]NCc1ccnc(c1)Br 34a_100025757509_200025704644 [1,1,0,0,0,0|2,0,0]=4 2473 B10R1.10 [13CH3]NCc1ccnc(c1)Cl 2230a_100015205668_200025704644 [1,1,0,0,0,0|2,0,0]=4 2474 B10R1.10 [13CH3]NCc1ccnc(c1)Cl 34a_100015205668_200025704644 [1,1,0,0,0,0|2,0,0]=4 2475 B10R1.10 [13CH3]NCc1ccnc(c1)F 2230a_100015188774_200025704644 [1,1,0,0,0,0|2,0,0]=4 2476 B10R1.10 [13CH3]NCc1ccnc(c1)F 34a_100015188774_200025704644 [1,1,0,0,0,0|2,0,0]=4 2477 B10R1.10 [13CH3]NCc1cncc(c1)Cl 2230a_200020614424_200025704644 [1,1,0,0,0,0|2,0,0]=4 2478 B10R1.10 [13CH3]NCc1cncc(c1)F 2230a_100011962886_200025704644 [1,1,0,0,0,0|2,0,0]=4 2479 B10R1.10 [13CH3]NCc1cncc(c1)F 34a_100011962886_200025704644 [1,1,0,0,0,0|2,0,0]=4 2480 B10R1.10 [13CH3]OCc1cc(ccn1)Cl 34a_100000748867_200025704644 [1,1,0,0,0,0|2,0,0]=4 2481 B10R1.10 [13CH3]OCc1cc(ccn1)N 34a_100000692640_200025704644 [1,1,0,0,0,0|2,0,0]=4 2482 B10R1.10 [13CH3]OCc1ccc[n+](c1)[O-] 34a_100000037817_200025704644 [1,1,0,0,0,0|2,0,0]=4 2483 B10R1.10 [13CH3]OCc1ccc[n+](c1)[O-] 7a_100000037817_200025704644 [1,1,0,0,0,0|2,0,0]=4 2484 B10R1.10 [13CH3]OCc1cccc(c1)Br 34a_100000687537_200025704644 [1,1,0,0,0,0|1,0,0]=3 2485 B10R1.10 [13CH3]OCc1cccc(c1)Br 7a_100000687537_200025704644 [1,1,0,0,0,0|1,0,0]=3 2486 B10R1.10 [13CH3]OCc1cccc(c1)Cl 34a_100000241301_200025704644 [1,1,0,0,0,0|1,0,0]=3 2487 B10R1.10 [13CH3]OCc1cccc(c1)Cl 7a_100000241301_200025704644 [1,1,0,0,0,0|1,0,0]=3 2488 B10R1.10 [13CH3]OCc1cccc(c1)F 34a_100000210976_200025704644 [1,1,0,0,0,0|1,0,0]=3 2489 B10R1.10 [13CH3]OCc1cccc(c1)F 7a_100000210976_200025704644 [1,1,0,0,0,0|1,0,0]=3 2490 B10R1.10 [13CH3]OCc1cccc(c1)I 34a_100011215336_200025704644 [1,1,0,0,0,0|1,0,0]=3 2491 B10R1.10 [13CH3]OCc1cccc(c1)I 7a_100011215336_200025704644 [1,1,0,0,0,0|1,0,0]=3 2492 B10R1.10 [13CH3]OCc1cccc(c1)N 34a_100000211919_200025704644 [1,1,0,0,0,0|1,0,0]=3 2493 B10R1.10 [13CH3]OCc1cccc(n1)Br 34a_100000694195_200025704644 [1,1,0,0,0,0|2,0,0]=4 2494 B10R1.10 [13CH3]OCc1cccc(n1)Cl 34a_100011998359_200025704644 [1,1,0,0,0,0|2,0,0]=4 2495 B10R1.10 [13CH3]OCc1cccc(n1)F 34a_100000086748_200025704644 [1,1,0,0,0,0|2,0,0]=4 2496 B10R1.10 [13CH3]OCc1ccnc(c1)Br 34a_100009814636_200025704644 [1,1,0,0,0,0|2,0,0]=4 2497 B10R1.10 [13CH3]OCc1ccnc(c1)Br 7a_100009814636_200025704644 [1,1,0,0,0,0|2,0,0]=4 2498 B10R1.10 [13CH3]OCc1ccnc(c1)Cl 34a_100000748751_200025704644 [1,1,0,0,0,0|2,0,0]=4 2499 B10R1.10 [13CH3]OCc1ccnc(c1)F 34a_100000082451_200025704644 [1,1,0,0,0,0|2,0,0]=4 2500 B10R1.10 [13CH3]OCc1cncc(c1)Br 34a_100011259137_200025704644 [1,1,0,0,0,0|2,0,0]=4 2501 B10R1.10 [13CH3]OCc1cncc(c1)Br 7a_100011259137_200025704644 [1,1,0,0,0,0|2,0,0]=4 2502 B10R1.10 [13CH3]OCc1cncc(c1)Cl 34a_100000092867_200025704644 [1,1,0,0,0,0|2,0,0]=4 2503 B10R1.10 [13CH3]OCc1cncc(c1)Cl 7a_100000092867_200025704644 [1,1,0,0,0,0|2,0,0]=4 2504 B10R1.10 [13CH3]OCc1cncc(c1)F 34a_100011962875_200025704644 [1,1,0,0,0,0|2,0,0]=4 2505 B10R1.10 [13CH3]OCc1cncc(c1)F 7a_100011962875_200025704644 [1,1,0,0,0,0|2,0,0]=4 2506 B10R1.10 [13CH3]OCc1cncc(c1)N 34a_100000085308_200025704644 [1,1,0,0,0,0|2,0,0]=4 2507 B10R1.10 [13CH3]SCc1cc(ccn1)Br 62a_100010173614_200025704644 [1,1,0,0,0,0|2,0,0]=4 2508 B10R1.10 [13CH3]SCc1cc(ccn1)Br 62a_200025704644_100010173614 [1,1,0,0,0,0|2,0,0]=4 2509 B10R1.10 [13CH3]SCc1cc(ccn1)Cl 62a_100016988179_200025704644 [1,1,0,0,0,0|2,0,0]=4 2510 B10R1.10 [13CH3]SCc1cc(ccn1)Cl 62a_200025704644_100016988179 [1,1,0,0,0,0|2,0,0]=4 2511 B10R1.10 [13CH3]SCc1cccc(c1)Br 62a_100000211773_200025704644 [1,1,0,0,0,0|1,0,0]=3 2512 B10R1.10 [13CH3]SCc1cccc(c1)Br 62a_200025704644_100000211773 [1,1,0,0,0,0|1,0,0]=3 2513 B10R1.10 [13CH3]SCc1cccc(c1)Cl 62a_100000187163_200025704644 [1,1,0,0,0,0|1,0,0]=3 2514 B10R1.10 [13CH3]SCc1cccc(c1)Cl 62a_200025704644_100000187163 [1,1,0,0,0,0|1,0,0]=3 2515 B10R1.10 [13CH3]SCc1cccc(c1)F 62a_100000230114_200025704644 [1,1,0,0,0,0|1,0,0]=3 2516 B10R1.10 [13CH3]SCc1cccc(c1)F 62a_200025704644_100000230114 [1,1,0,0,0,0|1,0,0]=3 2517 B10R1.10 [13CH3]SCc1cccc(c1)I 62a_100011218688_200025704644 [1,1,0,0,0,0|1,0,0]=3 2518 B10R1.10 [13CH3]SCc1cccc(c1)I 62a_200025704644_100011218688 [1,1,0,0,0,0|1,0,0]=3 2519 B10R1.10 [13CH3]SCc1cccc(c1)O 62a_100011660834_200025704644 [1,1,0,0,0,0|1,0,0]=3 2520 B10R1.10 [13CH3]SCc1cccc(c1)O 62a_200025704644_100011660834 [1,1,0,0,0,0|1,0,0]=3 2521 B10R1.10 [13CH3]SCc1cccc(n1)Br 62a_100009889011_200025704644 [1,1,0,0,0,0|2,0,0]=4 2522 B10R1.10 [13CH3]SCc1cccc(n1)Br 62a_200025704644_100009889011 [1,1,0,0,0,0|2,0,0]=4 2523 B10R1.10 [13CH3]SCc1cccc(n1)Cl 62a_100000086093_200025704644 [1,1,0,0,0,0|2,0,0]=4 2524 B10R1.10 [13CH3]SCc1cccc(n1)Cl 62a_200025704644_100000086093 [1,1,0,0,0,0|2,0,0]=4 2525 B10R1.10 [13CH3]SCc1cccc(n1)F 62a_100009819644_200025704644 [1,1,0,0,0,0|2,0,0]=4 2526 B10R1.10 [13CH3]SCc1cccc(n1)F 62a_200025704644_100009819644 [1,1,0,0,0,0|2,0,0]=4 2527 B10R1.10 [13CH3]SCc1ccnc(c1)Br 62a_100010254460_200025704644 [1,1,0,0,0,0|2,0,0]=4 2528 B10R1.10 [13CH3]SCc1ccnc(c1)Br 62a_200025704644_100010243470 [1,1,0,0,0,0|2,0,0]=4 2529 B10R1.10 [13CH3]SCc1ccnc(c1)Cl 62a_100000764220_200025704644 [1,1,0,0,0,0|2,0,0]=4 2530 B10R1.10 [13CH3]SCc1ccnc(c1)Cl 62a_200025704644_100000764220 [1,1,0,0,0,0|2,0,0]=4 2531 B10R1.10 [13CH3]SCc1cncc(c1)Br 62a_100000738771_200025704644 [1,1,0,0,0,0|2,0,0]=4 2532 B10R1.10 [13CH3]SCc1cncc(c1)Br 62a_200025704644_100000738771 [1,1,0,0,0,0|2,0,0]=4 2533 B10R1.10 [13CH3]SCc1cncc(c1)Cl 62a_100016992070_200025704644 [1,1,0,0,0,0|2,0,0]=4 2534 B10R1.10 [13CH3]SCc1cncc(c1)Cl 62a_200025704644_100016992070 [1,1,0,0,0,0|2,0,0]=4 2535 B10R1.10 [13CH3]SCc1cncc(c1)F 62a_100000725299_200025704644 [1,1,0,0,0,0|2,0,0]=4 2536 B10R1.10 [13CH3]SCc1cncc(c1)F 62a_200025704644_100000725299 [1,1,0,0,0,0|2,0,0]=4 2537 B10R1.15 CC(N[13CH3])c1ccccn1 2230a_100000181244_200025704644 [1,1,0,0,0,0|2,0,0]=4 2538 B10R1.15 CC(N[13CH3])c1cccnc1 2230a_100000195435_200025704644 [1,1,0,0,0,0|2,0,0]=4 2539 B10R1.15 CC(N[13CH3])c1ccncc1 2230a_100000181269_200025704644 [1,1,0,0,0,0|2,0,0]=4 2540 B10R1.15 CC(S[13CH3])c1ccccc1 62a_100000230085_200025704644 [1,1,0,0,0,0|1,0,0]=3 2541 B10R1.15 CC(S[13CH3])c1ccccc1 62a_200025704644_100000230085 [1,1,0,0,0,0|1,0,0]=3 2542 B10R1.15 CCC(=O)c1ccccc1 1458a_100000185807_100000210202 [1,1,0,0,0,0|0,0,2]=4 2543 B10R1.15 CCN(C)c1ccccc1 2230a_100000210012_100000210202 [1,1,0,0,0,0|1,0,1]=4 2544 B10R1.15 CCN(C)c1ccccc1 2230a_100000210013_200000210301 [1,1,0,0,0,0|1,0,1]=4 2545 B10R1.15 CCN(C)c1ccccc1 269982a_100000210012_100000204670 [1,1,0,0,0,0|1,0,1]=4 2546 B10R1.15 CCN(C)c1ccccc1 269982a_100000210013_200000210301 [1,1,0,0,0,0|1,0,1]=4 2547 B10R1.15 CCN(C)c1ccccc1 34a_100000210012_100000210202 [1,1,0,0,0,0|1,0,1]=4 2548 B10R1.15 CCN(C)c1ccccc1 34a_100000210013_200000210301 [1,1,0,0,0,0|1,0,1]=4 2549 B10R1.15 CCN([13CH3])c1ccccc1 2230a_100000210013_200025704644 [1,1,0,0,0,0|1,0,1]=4 2550 B10R1.15 CCN([13CH3])c1ccccc1 269982a_100000210013_200025704644 [1,1,0,0,0,0|1,0,1]=4 2551 B10R1.15 CCN([13CH3])c1ccccc1 34a_100000210013_200025704644 [1,1,0,0,0,0|1,0,1]=4 2552 B10R1.15 CNC(=O)c1ccccc1 11a_106832991635_100000185807 [1,1,0,0,0,0|1,0,1]=4 2553 B10R1.15 CNC(=O)c1ccccc1 1626a_100102657272_100000185807 [1,1,0,0,0,0|1,0,1]=4 2554 B10R1.15 CNC(=O)c1ccccc1 240690a_100102657272_100000185807 [1,1,0,0,0,0|1,0,1]=4 2555 B10R1.15 CNC(=O)c1ccccc1 527a_100102657272_100000185807 [1,1,0,0,0,0|1,0,1]=4 2556 B10R1.15 CNC(C)c1ccccc1 2230a_106832991635_100000230085 [1,1,0,0,0,0|1,0,0]=3 2557 B10R1.15 CNC(C)c1ccccc1 269862a_106832991636_100000185851 [1,1,0,0,0,0|1,0,0]=3 2558 B10R1.15 CNC(C)c1ccccc1 34a_100102657272_100000211855 [1,1,0,0,0,0|1,0,0]=3 2559 B10R1.15 CNC(C)c1ccccc1 7a_106832991635_100000230085 [1,1,0,0,0,0|1,0,0]=3 2560 B10R1.15 CNC(C)c1ccccn1 2230a_100000181244_200000210301 [1,1,0,0,0,0|2,0,0]=4 2561 B10R1.15 CNC(C)c1ccccn1 269862a_106832991636_100000210467 [1,1,0,0,0,0|2,0,0]=4 2562 B10R1.15 CNC(C)c1cccnc1 2230a_100000195435_200000210301 [1,1,0,0,0,0|2,0,0]=4 2563 B10R1.15 CNC(C)c1cccnc1 269862a_106832991636_100000210468 [1,1,0,0,0,0|2,0,0]=4 2564 B10R1.15 CNC(C)c1ccncc1 2230a_100000181269_200000210301 [1,1,0,0,0,0|2,0,0]=4 2565 B10R1.15 CNC(C)c1ccncc1 269862a_106832991636_100000185792 [1,1,0,0,0,0|2,0,0]=4 2566 B10R1.15 CN[C@H](C)c1ccccc1 2230a_100000751104_200000210301 [1,1,0,0,0,0|1,0,0]=3 2567 B10R1.15 COC(C)c1ccccc1 34a_100138415774_100000211855 [1,1,0,0,0,0|1,0,0]=3 2568 B10R1.15 CO[C@H](C)c1ccccc1 34a_100000761318_200000210301 [1,1,0,0,0,0|1,0,0]=3 2569 B10R1.15 CO[C@H](C)c1ccccc1 7a_100000761318_200000210301 [1,1,0,0,0,0|1,0,0]=3 2570 B10R1.15 CSC(C)c1ccccc1 62a_100000230085_200000210301 [1,1,0,0,0,0|1,0,0]=3 2571 B10R1.15 CSC(C)c1ccccc1 62a_200000210301_100000230085 [1,1,0,0,0,0|1,0,0]=3 2572 B10R1.15 C[C@@H](N[13CH3])c1ccccc1 2230a_100000751104_200025704644 [1,1,0,0,0,0|1,0,0]=3 2573 B10R1.15 C[C@@H](O[13CH3])c1ccccc1 34a_100000761318_200025704644 [1,1,0,0,0,0|1,0,0]=3 2574 B10R1.15 C[C@@H](O[13CH3])c1ccccc1 7a_100000761318_200025704644 [1,1,0,0,0,0|1,0,0]=3 2575 B10R1.17 C#CCNc1ccccc1 34a_100000106764_100000184674 [1,1,0,0,0,0|0,0,2]=4 2576 B10R1.17 C#CCOc1ccccc1 34a_100000210340_100000184674 [1,1,0,0,0,0|0,0,2]=4 2577 B10R1.17 C#CCOc1ccccc1 7a_100000210340_100000038162 [1,1,0,0,0,0|0,0,2]=4 2578 B10R1.17 C#CCSc1ccccc1 62a_100000038162_100000041952 [1,1,0,0,0,0|0,0,2]=4 2579 B10R1.17 C=CCNc1ccccc1 34a_100000106764_100015514636 [1,1,0,0,0,0|0,0,0]=2 2580 B10R1.17 C=CCNc1cccnn1 27a_100020586998_100016991348 [1,1,0,0,0,0|2,0,0]=4 2581 B10R1.17 C=CCNc1ccncn1 27a_100020586998_100000703185 [1,1,0,0,0,0|2,0,0]=4 2582 B10R1.17 C=CCNc1cnccn1 27a_100020586998_100000211759 [1,1,0,0,0,0|2,0,0]=4 2583 B10R1.17 C=CCNc1ncccn1 27a_100020586998_100000211032 [1,1,0,0,0,0|2,0,0]=4 2584 B10R1.17 C=CCOc1ccccc1 34a_100000210340_100015514636 [1,1,0,0,0,0|0,0,0]=2 2585 B10R1.17 C=CCOc1ccccc1 7a_100000210340_100015514636 [1,1,0,0,0,0|0,0,0]=2 2586 B10R1.17 C=CCOc1cccnc1 34a_100000210849_100015514636 [1,1,0,0,0,0|1,0,0]=3 2587 B10R1.17 C=CCOc1cccnc1 7a_100000210849_100015514636 [1,1,0,0,0,0|1,0,0]=3 2588 B10R1.17 C=CCOc1ccncc1 34a_100000212176_100015514636 [1,1,0,0,0,0|1,0,0]=3 2589 B10R1.17 C=CCOc1ccnnc1 34a_100015204005_100015514636 [1,1,0,0,0,0|2,0,0]=4 2590 B10R1.17 C=CCOc1cncnc1 7a_100000754086_100015514636 [1,1,0,0,0,0|2,0,0]=4 2591 B10R1.17 C=CCSc1ccccc1 62a_100000210623_100000041952 [1,1,0,0,0,0|0,0,0]=2 2592 B10R1.17 C=CCSc1ccccc1 62a_100000719477_100000210623 [1,1,0,0,0,0|0,0,0]=2 2593 B10R1.17 C=CCSc1ccccn1 62a_100000210623_100011216584 [1,1,0,0,0,0|1,0,0]=3 2594 B10R1.17 C=CCSc1ccccn1 62a_100011216584_100000210623 [1,1,0,0,0,0|1,0,0]=3 2595 B10R1.17 C=CCSc1cccnc1 62a_100000210063_100000210623 [1,1,0,0,0,0|1,0,0]=3 2596 B10R1.17 C=CCSc1cccnc1 62a_100000210623_100000210063 [1,1,0,0,0,0|1,0,0]=3 2597 B10R1.17 C=CCSc1cccnn1 62a_100000210623_100016991348 [1,1,0,0,0,0|2,0,0]=4 2598 B10R1.17 C=CCSc1cccnn1 62a_100016991348_100000210623 [1,1,0,0,0,0|2,0,0]=4 2599 B10R1.17 C=CCSc1ccncc1 62a_100000210623_100000728582 [1,1,0,0,0,0|1,0,0]=3 2600 B10R1.17 C=CCSc1ccncc1 62a_100000728582_100000210623 [1,1,0,0,0,0|1,0,0]=3 2601 B10R1.17 C=CCSc1ccncn1 62a_100000210623_100000703185 [1,1,0,0,0,0|2,0,0]=4 2602 B10R1.17 C=CCSc1ccncn1 62a_100000703185_100000210623 [1,1,0,0,0,0|2,0,0]=4 2603 B10R1.17 C=CCSc1ccnnc1 62a_100000210623_100000732662 [1,1,0,0,0,0|2,0,0]=4 2604 B10R1.17 C=CCSc1ccnnc1 62a_100000732662_100000210623 [1,1,0,0,0,0|2,0,0]=4 2605 B10R1.17 C=CCSc1cnccn1 62a_100000210623_100000211759 [1,1,0,0,0,0|2,0,0]=4 2606 B10R1.17 C=CCSc1cnccn1 62a_100000211759_100000210623 [1,1,0,0,0,0|2,0,0]=4 2607 B10R1.17 C=CCSc1cncnc1 62a_100000210623_100011206942 [1,1,0,0,0,0|2,0,0]=4 2608 B10R1.17 C=CCSc1cncnc1 62a_100011206942_100000210623 [1,1,0,0,0,0|2,0,0]=4 2609 B10R1.17 C=CCSc1ncccn1 62a_100000210623_100000211032 [1,1,0,0,0,0|2,0,0]=4 2610 B10R1.17 C=CCSc1ncccn1 62a_100000211032_100000210623 [1,1,0,0,0,0|2,0,0]=4 2611 B10R1.17 CC=NNc1ccccc1 4a_100015195140_200000210099 [1,1,0,0,0,0|1,0,0]=3 2612 B10R1.17 CC=NNc1ccccn1 4a_100000183288_200000210099 [1,1,0,0,0,0|2,0,0]=4 2613 B10R1.17 CC=NNc1cccnc1 4a_100000728903_200000210099 [1,1,0,0,0,0|2,0,0]=4 2614 B10R1.17 CC=NNc1ccncc1 4a_100000698918_200000210099 [1,1,0,0,0,0|2,0,0]=4 2615 B10R1.17 CCCCc1ccccc1 271570a_100020621405_100000210277 [1,1,0,0,0,0|0,0,1]=3 2616 B10R1.17 CCCCc1ccccn1 271570a_100020621405_100011216584 [1,1,0,0,0,0|1,0,1]=4 2617 B10R1.17 CCCCc1cccnc1 271570a_100020621405_100000752921 [1,1,0,0,0,0|1,0,1]=4 2618 B10R1.17 CCCCc1ccncc1 271570a_100020621405_100000035832 [1,1,0,0,0,0|1,0,1]=4 2619 B10R1.17 CCCNc1ccccc1 34a_100000106764_100000210303 [1,1,0,0,0,0|0,0,1]=3 2620 B10R1.17 CCCOc1ccccc1 34a_100000210340_100000210303 [1,1,0,0,0,0|0,0,1]=3 2621 B10R1.17 CCCOc1ccccc1 7a_100000210340_100000210303 [1,1,0,0,0,0|0,0,1]=3 2622 B10R1.17 CCCOc1cccnc1 34a_100000210849_100000210303 [1,1,0,0,0,0|1,0,1]=4 2623 B10R1.17 CCCOc1cccnc1 7a_100000210849_100000210303 [1,1,0,0,0,0|1,0,1]=4 2624 B10R1.17 CCCOc1ccncc1 34a_100000212176_100000210303 [1,1,0,0,0,0|1,0,1]=4 2625 B10R1.17 CCCSc1ccccc1 62a_100000210303_100000041952 [1,1,0,0,0,0|0,0,1]=3 2626 B10R1.17 CCCSc1ccccc1 62a_100000719477_100000210303 [1,1,0,0,0,0|0,0,1]=3 2627 B10R1.17 CCCSc1ccccn1 62a_100000210303_100011216584 [1,1,0,0,0,0|1,0,1]=4 2628 B10R1.17 CCCSc1ccccn1 62a_100011216584_100000210303 [1,1,0,0,0,0|1,0,1]=4 2629 B10R1.17 CCCSc1cccnc1 62a_100000210063_100000210303 [1,1,0,0,0,0|1,0,1]=4 2630 B10R1.17 CCCSc1cccnc1 62a_100000210303_100000210063 [1,1,0,0,0,0|1,0,1]=4 2631 B10R1.17 CCCSc1ccncc1 62a_100000210303_100000728582 [1,1,0,0,0,0|1,0,1]=4 2632 B10R1.17 CCCSc1ccncc1 62a_100000728582_100000210303 [1,1,0,0,0,0|1,0,1]=4 2633 B10R1.17 CCNCc1ccccc1 207a_100015525214_100015611070 [1,1,0,0,0,0|0,0,1]=3 2634 B10R1.17 CCNCc1ccccc1 2230a_100015324214_100000210202 [1,1,0,0,0,0|0,0,1]=3 2635 B10R1.17 CCNCc1ccccc1 2230a_100015525214_100015291786 [1,1,0,0,0,0|0,0,1]=3 2636 B10R1.17 CCNCc1ccccc1 270004a_100015525214_100015611070 [1,1,0,0,0,0|0,0,1]=3 2637 B10R1.17 CCNCc1ccccc1 34a_100015324214_100000210202 [1,1,0,0,0,0|0,0,1]=3 2638 B10R1.17 CCNCc1ccccn1 207a_100015525214_100000209966 [1,1,0,0,0,0|1,0,1]=4 2639 B10R1.17 CCNCc1ccccn1 2230a_100015525214_100000721315 [1,1,0,0,0,0|1,0,1]=4 2640 B10R1.17 CCNCc1ccccn1 270004a_100015525214_100000209966 [1,1,0,0,0,0|1,0,1]=4 2641 B10R1.17 CCNCc1cccnc1 207a_100015525214_100000209961 [1,1,0,0,0,0|1,0,1]=4 2642 B10R1.17 CCNCc1cccnc1 2230a_100015525214_100000741622 [1,1,0,0,0,0|1,0,1]=4 2643 B10R1.17 CCNCc1cccnc1 270004a_100015525214_100000209961 [1,1,0,0,0,0|1,0,1]=4 2644 B10R1.17 CCNCc1ccncc1 207a_100015525214_100000186114 [1,1,0,0,0,0|1,0,1]=4 2645 B10R1.17 CCNCc1ccncc1 2230a_100015525214_100015193705 [1,1,0,0,0,0|1,0,1]=4 2646 B10R1.17 CCOCc1ccccc1 34a_100000210790_100000210202 [1,1,0,0,0,0|0,0,1]=3 2647 B10R1.17 CCOCc1ccccc1 34a_100121572206_100015291786 [1,1,0,0,0,0|0,0,1]=3 2648 B10R1.17 CCOCc1ccccc1 7a_100000210790_100000210202 [1,1,0,0,0,0|0,0,1]=3 2649 B10R1.17 CCOCc1ccccn1 34a_100121572206_100000721315 [1,1,0,0,0,0|1,0,1]=4 2650 B10R1.17 CCOCc1cccnc1 34a_100121572206_100000733263 [1,1,0,0,0,0|1,0,1]=4 2651 B10R1.17 CCSCc1ccccc1 62a_100000210202_100015291786 [1,1,0,0,0,0|0,0,1]=3 2652 B10R1.17 CCSCc1ccccc1 62a_100000211182_100000210202 [1,1,0,0,0,0|0,0,1]=3 2653 B10R1.17 CCSCc1ccccn1 62a_100000210202_100000721315 [1,1,0,0,0,0|1,0,1]=4 2654 B10R1.17 CCSCc1ccccn1 62a_100000721315_100000210202 [1,1,0,0,0,0|1,0,1]=4 2655 B10R1.17 CCSCc1cccnc1 62a_100000210202_100000741622 [1,1,0,0,0,0|1,0,1]=4 2656 B10R1.17 CCSCc1cccnc1 62a_100000741622_100000210202 [1,1,0,0,0,0|1,0,1]=4 2657 B10R1.17 CCSCc1ccncc1 62a_100000210202_100015193705 [1,1,0,0,0,0|1,0,1]=4 2658 B10R1.17 CCSCc1ccncc1 62a_100015193705_100000210202 [1,1,0,0,0,0|1,0,1]=4 2659 B10R1.17 CNCCc1ccccc1 2230a_100000106460_200000210301 [1,1,0,0,0,0|0,0,1]=3 2660 B10R1.17 CNCCc1ccccc1 2230a_106832991635_100000765856 [1,1,0,0,0,0|0,0,1]=3 2661 B10R1.17 CNCCc1ccccc1 34a_100000106460_200000210301 [1,1,0,0,0,0|0,0,1]=3 2662 B10R1.17 CNCCc1ccccc1 34a_100102657272_100000765856 [1,1,0,0,0,0|0,0,1]=3 2663 B10R1.17 CNCCc1ccccc1 7a_106832991635_100000765856 [1,1,0,0,0,0|0,0,1]=3 2664 B10R1.17 CNCCc1ccccn1 2230a_106832991635_100015183660 [1,1,0,0,0,0|1,0,1]=4 2665 B10R1.17 CNCCc1ccccn1 7a_106832991635_100015183660 [1,1,0,0,0,0|1,0,1]=4 2666 B10R1.17 CNCCc1cccnc1 2230a_100000736294_200000210301 [1,1,0,0,0,0|1,0,1]=4 2667 B10R1.17 CNCCc1cccnc1 2230a_106832991635_200011713674 [1,1,0,0,0,0|1,0,1]=4 2668 B10R1.17 CNCCc1cccnc1 7a_106832991635_200011713674 [1,1,0,0,0,0|1,0,1]=4 2669 B10R1.17 CNCCc1ccncc1 2230a_106832991635_100000723409 [1,1,0,0,0,0|1,0,1]=4 2670 B10R1.17 CNCCc1ccncc1 7a_106832991635_100000723409 [1,1,0,0,0,0|1,0,1]=4 2671 B10R1.17 CNCSc1ccccc1 2230a_106832991635_100011218342 [1,1,0,0,0,0|1,0,0]=3 2672 B10R1.17 COCCc1ccccc1 34a_100000210268_200000210301 [1,1,0,0,0,0|0,0,1]=3 2673 B10R1.17 COCCc1ccccc1 34a_100138415774_100000765856 [1,1,0,0,0,0|0,0,1]=3 2674 B10R1.17 COCCc1ccccc1 7a_100000210268_200000210301 [1,1,0,0,0,0|0,0,1]=3 2675 B10R1.17 COCCc1ccccn1 34a_100000210271_200000210301 [1,1,0,0,0,0|1,0,1]=4 2676 B10R1.17 COCCc1cccnc1 34a_100011217484_200000210301 [1,1,0,0,0,0|1,0,1]=4 2677 B10R1.17 COCCc1ccncc1 34a_100011216225_200000210301 [1,1,0,0,0,0|1,0,1]=4 2678 B10R1.17 COCSc1ccccc1 62a_100000719477_100000766300 [1,1,0,0,0,0|1,0,0]=3 2679 B10R1.17 COCSc1ccccc1 62a_100000766300_100000041952 [1,1,0,0,0,0|1,0,0]=3 2680 B10R1.17 COCSc1ccccn1 62a_100000766300_100011216584 [1,1,0,0,0,0|2,0,0]=4 2681 B10R1.17 COCSc1ccccn1 62a_100011216584_100000766300 [1,1,0,0,0,0|2,0,0]=4 2682 B10R1.17 COCSc1cccnc1 62a_100000210063_100000766300 [1,1,0,0,0,0|2,0,0]=4 2683 B10R1.17 COCSc1cccnc1 62a_100000766300_100000210063 [1,1,0,0,0,0|2,0,0]=4 2684 B10R1.17 COCSc1ccncc1 62a_100000728582_100000766300 [1,1,0,0,0,0|2,0,0]=4 2685 B10R1.17 COCSc1ccncc1 62a_100000766300_100000728582 [1,1,0,0,0,0|2,0,0]=4 2686 B10R1.17 CSCCc1ccccc1 62a_100000765856_200000210301 [1,1,0,0,0,0|0,0,1]=3 2687 B10R1.17 CSCCc1ccccc1 62a_200000210301_100011218657 [1,1,0,0,0,0|0,0,1]=3 2688 B10R1.17 CSCCc1ccccn1 62a_100015183660_200000210301 [1,1,0,0,0,0|1,0,1]=4 2689 B10R1.17 CSCCc1ccccn1 62a_200000210301_100015183660 [1,1,0,0,0,0|1,0,1]=4 2690 B10R1.17 CSCCc1cccnc1 62a_200000210301_200011713674 [1,1,0,0,0,0|1,0,1]=4 2691 B10R1.17 CSCCc1cccnc1 62a_200011713674_200000210301 [1,1,0,0,0,0|1,0,1]=4 2692 B10R1.17 CSCCc1ccncc1 62a_100000723409_200000210301 [1,1,0,0,0,0|1,0,1]=4 2693 B10R1.17 CSCCc1ccncc1 62a_200000210301_100000723409 [1,1,0,0,0,0|1,0,1]=4 2694 B10R1.17 CSCNc1ccccc1 34a_100000106764_100011218213 [1,1,0,0,0,0|1,0,0]=3 2695 B10R1.17 CSCOc1ccccc1 34a_100000210340_100011218213 [1,1,0,0,0,0|1,0,0]=3 2696 B10R1.17 CSCOc1cccnc1 34a_100000210849_100011218213 [1,1,0,0,0,0|2,0,0]=4 2697 B10R1.17 CSCOc1ccncc1 34a_100000212176_100011218213 [1,1,0,0,0,0|2,0,0]=4 2698 B10R1.17 CSCSc1ccccc1 62a_100000719477_100011218213 [1,1,0,0,0,0|1,0,0]=3 2699 B10R1.17 CSCSc1ccccc1 62a_100011218213_100000041952 [1,1,0,0,0,0|1,0,0]=3 2700 B10R1.17 CSCSc1ccccc1 62a_100011218342_200000210301 [1,1,0,0,0,0|1,0,0]=3 2701 B10R1.17 CSCSc1ccccc1 62a_200000210301_100011218342 [1,1,0,0,0,0|1,0,0]=3 2702 B10R1.17 CSCSc1ccccn1 62a_100011216584_100011218213 [1,1,0,0,0,0|2,0,0]=4 2703 B10R1.17 CSCSc1ccccn1 62a_100011218213_100011216584 [1,1,0,0,0,0|2,0,0]=4 2704 B10R1.17 CSCSc1cccnc1 62a_100000210063_100011218213 [1,1,0,0,0,0|2,0,0]=4 2705 B10R1.17 CSCSc1cccnc1 62a_100011218213_100000210063 [1,1,0,0,0,0|2,0,0]=4 2706 B10R1.17 CSCSc1ccncc1 62a_100000728582_100011218213 [1,1,0,0,0,0|2,0,0]=4 2707 B10R1.17 CSCSc1ccncc1 62a_100011218213_100000728582 [1,1,0,0,0,0|2,0,0]=4 2708 B10R1.17 FCCNc1ccccc1 34a_100000106764_100011217306 [1,1,0,0,0,0|1,0,1]=4 2709 B10R1.17 FCCOc1ccccc1 34a_100000210340_100011217306 [1,1,0,0,0,0|1,0,1]=4 2710 B10R1.17 FCCOc1ccccc1 7a_100000210340_100011217306 [1,1,0,0,0,0|1,0,1]=4 2711 B10R1.17 FCCSc1ccccc1 62a_100000719477_100011217306 [1,1,0,0,0,0|1,0,1]=4 2712 B10R1.17 FCCSc1ccccc1 62a_100011217306_100000041952 [1,1,0,0,0,0|1,0,1]=4 2713 B10R1.17 FCNCc1ccccc1 34a_100015324214_100015361967 [1,1,0,0,0,0|1,0,0]=3 2714 B10R1.17 FCOCc1ccccc1 34a_100000210790_100015361967 [1,1,0,0,0,0|1,0,0]=3 2715 B10R1.17 FCOCc1ccccc1 7a_100000210790_100015361967 [1,1,0,0,0,0|1,0,0]=3 2716 B10R1.17 FCSCc1ccccc1 62a_100000211182_100015361967 [1,1,0,0,0,0|1,0,0]=3 2717 B10R1.17 FCSCc1ccccc1 62a_100015361967_100015291786 [1,1,0,0,0,0|1,0,0]=3 2718 B10R1.17 FCSCc1ccccn1 62a_100000721315_100015361967 [1,1,0,0,0,0|2,0,0]=4 2719 B10R1.17 FCSCc1ccccn1 62a_100015361967_100000721315 [1,1,0,0,0,0|2,0,0]=4 2720 B10R1.17 FCSCc1cccnc1 62a_100000741622_100015361967 [1,1,0,0,0,0|2,0,0]=4 2721 B10R1.17 FCSCc1cccnc1 62a_100015361967_100000741622 [1,1,0,0,0,0|2,0,0]=4 2722 B10R1.17 FCSCc1ccncc1 62a_100015193705_100015361967 [1,1,0,0,0,0|2,0,0]=4 2723 B10R1.17 FCSCc1ccncc1 62a_100015361967_100015193705 [1,1,0,0,0,0|2,0,0]=4 2724 B10R1.17 N#CCOc1ccccc1 7a_100000210340_100011215382 [1,1,0,0,0,0|1,0,1]=4 2725 B10R1.17 N#CCSc1ccccc1 62a_100000719477_100011215382 [1,1,0,0,0,0|1,0,1]=4 2726 B10R1.17 N#CCSc1ccccc1 62a_100011215382_100000041952 [1,1,0,0,0,0|1,0,1]=4 2727 B10R1.17 O=CCNc1ccccc1 34a_100000106764_200009817547 [1,1,0,0,0,0|1,0,0]=3 2728 B10R1.17 O=CCOc1ccccc1 34a_100000210340_200009817547 [1,1,0,0,0,0|1,0,0]=3 2729 B10R1.17 O=CCOc1ccccc1 7a_100000210340_200015260668 [1,1,0,0,0,0|1,0,0]=3 2730 B10R1.17 O=CCOc1cccnc1 34a_100000210849_200009817547 [1,1,0,0,0,0|2,0,0]=4 2731 B10R1.17 O=CCOc1cccnc1 7a_100000210849_200015260668 [1,1,0,0,0,0|2,0,0]=4 2732 B10R1.17 O=CCOc1ccncc1 34a_100000212176_200009817547 [1,1,0,0,0,0|2,0,0]=4 2733 B10R1.17 O=CCSc1ccccc1 62a_100000719477_200015260668 [1,1,0,0,0,0|1,0,0]=3 2734 B10R1.17 O=CCSc1ccccc1 62a_200015260668_100000041952 [1,1,0,0,0,0|1,0,0]=3 2735 B10R1.17 O=CCSc1ccccn1 62a_100011216584_200015260668 [1,1,0,0,0,0|2,0,0]=4 2736 B10R1.17 O=CCSc1ccccn1 62a_200015260668_100011216584 [1,1,0,0,0,0|2,0,0]=4 2737 B10R1.17 O=CCSc1cccnc1 62a_100000210063_200015260668 [1,1,0,0,0,0|2,0,0]=4 2738 B10R1.17 O=CCSc1cccnc1 62a_200015260668_100000210063 [1,1,0,0,0,0|2,0,0]=4 2739 B10R1.17 O=CCSc1ccncc1 62a_100000728582_200015260668 [1,1,0,0,0,0|2,0,0]=4 2740 B10R1.17 O=CCSc1ccncc1 62a_200015260668_100000728582 [1,1,0,0,0,0|2,0,0]=4 2741 B10R1.17 OCCNc1ccccc1 34a_100000106764_100000211926 [1,1,0,0,0,0|1,0,1]=4 2742 B10R1.17 OCCOc1ccccc1 34a_100000210340_100000211926 [1,1,0,0,0,0|1,0,1]=4 2743 B10R1.17 OCCOc1ccccc1 7a_100000210340_100000211926 [1,1,0,0,0,0|1,0,1]=4 2744 B10R1.17 OCCSc1ccccc1 62a_100000211926_100000041952 [1,1,0,0,0,0|1,0,1]=4 2745 B10R1.17 OCCSc1ccccc1 62a_100000719477_100000211926 [1,1,0,0,0,0|1,0,1]=4 2746 B10R1.17 [13CH3]NCCc1ccccc1 2230a_100000106460_200025704644 [1,1,0,0,0,0|0,0,1]=3 2747 B10R1.17 [13CH3]NCCc1ccccc1 34a_100000106460_200025704644 [1,1,0,0,0,0|0,0,1]=3 2748 B10R1.17 [13CH3]NCCc1cccnc1 2230a_100000736294_200025704644 [1,1,0,0,0,0|1,0,1]=4 2749 B10R1.17 [13CH3]OCCc1ccccc1 34a_100000210268_200025704644 [1,1,0,0,0,0|0,0,1]=3 2750 B10R1.17 [13CH3]OCCc1ccccc1 7a_100000210268_200025704644 [1,1,0,0,0,0|0,0,1]=3 2751 B10R1.17 [13CH3]OCCc1ccccn1 34a_100000210271_200025704644 [1,1,0,0,0,0|1,0,1]=4 2752 B10R1.17 [13CH3]OCCc1cccnc1 34a_100011217484_200025704644 [1,1,0,0,0,0|1,0,1]=4 2753 B10R1.17 [13CH3]OCCc1ccncc1 34a_100011216225_200025704644 [1,1,0,0,0,0|1,0,1]=4 2754 B10R1.17 [13CH3]SCCc1ccccc1 62a_100000765856_200025704644 [1,1,0,0,0,0|0,0,1]=3 2755 B10R1.17 [13CH3]SCCc1ccccc1 62a_200025704644_100011218657 [1,1,0,0,0,0|0,0,1]=3 2756 B10R1.17 [13CH3]SCCc1ccccn1 62a_100015183660_200025704644 [1,1,0,0,0,0|1,0,1]=4 2757 B10R1.17 [13CH3]SCCc1ccccn1 62a_200025704644_100015183660 [1,1,0,0,0,0|1,0,1]=4 2758 B10R1.17 [13CH3]SCCc1cccnc1 62a_200011713674_200025704644 [1,1,0,0,0,0|1,0,1]=4 2759 B10R1.17 [13CH3]SCCc1cccnc1 62a_200025704644_200011713674 [1,1,0,0,0,0|1,0,1]=4 2760 B10R1.17 [13CH3]SCCc1ccncc1 62a_100000723409_200025704644 [1,1,0,0,0,0|1,0,1]=4 2761 B10R1.17 [13CH3]SCCc1ccncc1 62a_200025704644_100000723409 [1,1,0,0,0,0|1,0,1]=4 2762 B10R1.17 [13CH3]SCSc1ccccc1 62a_100011218342_200025704644 [1,1,0,0,0,0|1,0,0]=3 2763 B10R1.17 [13CH3]SCSc1ccccc1 62a_200025704644_100011218342 [1,1,0,0,0,0|1,0,0]=3 2764 B10R1.13 C=C(C)c1cc[n+](cc1)[O-] 271570a_100000694244_100000039755 [0,1,0,0,1,0|1,0,0]=3 2765 B10R1.13 C=C(C)c1ccc(=O)[nH]c1 271570a_100000694244_100000212171 [0,1,0,0,1,0|1,0,0]=3 2766 B10R1.13 C=C(C)c1ccc(=O)[nH]n1 271570a_100000694244_100009820020 [0,1,0,0,1,0|2,0,0]=4 2767 B10R1.13 C=C(C)c1ccc(cc1)Br 271570a_100000694244_100000752885 [0,1,0,0,1,0|0,0,0]=2 2768 B10R1.13 C=C(C)c1ccc(cc1)C 271570a_100000694244_100000186775 [0,1,0,0,1,0|0,0,0]=2 2769 B10R1.13 C=C(C)c1ccc(cc1)Cl 271570a_100000694244_100000755918 [0,1,0,0,1,0|0,0,0]=2 2770 B10R1.13 C=C(C)c1ccc(cc1)F 271570a_100000694244_100000211213 [0,1,0,0,1,0|0,0,0]=2 2771 B10R1.13 C=C(C)c1ccc(cc1)N 271570a_100000694244_100000185761 [0,1,0,0,1,0|0,0,0]=2 2772 B10R1.13 C=C(C)c1ccc(cc1)O 271570a_100000694244_100000185759 [0,1,0,0,1,0|0,0,0]=2 2773 B10R1.13 C=C(C)c1ccc(cc1)O 271570a_203496583355_100000185454 [0,1,0,0,1,0|0,0,0]=2 2774 B10R1.13 C=C(C)c1ccc(cn1)Br 271570a_100000694244_100000686858 [0,1,0,0,1,0|1,0,0]=3 2775 B10R1.13 C=C(C)c1ccc(cn1)C 271570a_100000694244_100000754016 [0,1,0,0,1,0|1,0,0]=3 2776 B10R1.13 C=C(C)c1ccc(cn1)Cl 271570a_100000694244_100011356976 [0,1,0,0,1,0|1,0,0]=3 2777 B10R1.13 C=C(C)c1ccc(cn1)F 271570a_100000694244_100000744514 [0,1,0,0,1,0|1,0,0]=3 2778 B10R1.13 C=C(C)c1ccc(cn1)N 271570a_100000694244_100000744251 [0,1,0,0,1,0|1,0,0]=3 2779 B10R1.13 C=C(C)c1ccc(cn1)O 271570a_100000694244_100000685995 [0,1,0,0,1,0|1,0,0]=3 2780 B10R1.13 C=C(C)c1ccc(nc1)Br 271570a_100000694244_100009814638 [0,1,0,0,1,0|1,0,0]=3 2781 B10R1.13 C=C(C)c1ccc(nc1)C 271570a_100000694244_100000751577 [0,1,0,0,1,0|1,0,0]=3 2782 B10R1.13 C=C(C)c1ccc(nc1)Cl 271570a_100000694244_100000034144 [0,1,0,0,1,0|1,0,0]=3 2783 B10R1.13 C=C(C)c1ccc(nc1)F 271570a_100000694244_100000748661 [0,1,0,0,1,0|1,0,0]=3 2784 B10R1.13 C=C(C)c1ccc(nc1)N 271570a_100000694244_100000187370 [0,1,0,0,1,0|1,0,0]=3 2785 B10R1.13 C=C(C)c1ccc(nn1)C 271570a_100000694244_100011450037 [0,1,0,0,1,0|2,0,0]=4 2786 B10R1.13 C=C(C)c1ccc(nn1)N 271570a_100000694244_100009816609 [0,1,0,0,1,0|2,0,0]=4 2787 B10R1.13 C=C(C)c1cnc(=O)[nH]c1 271570a_100000694244_102495366499 [0,1,0,0,1,0|2,0,0]=4 2788 B10R1.13 C=C(C)c1cnc(cn1)C 271570a_100000694244_100011999403 [0,1,0,0,1,0|2,0,0]=4 2789 B10R1.13 C=C(C)c1cnc(cn1)F 271570a_100000694244_100009856528 [0,1,0,0,1,0|2,0,0]=4 2790 B10R1.13 C=C(C)c1cnc(cn1)N 271570a_100000694244_100000761932 [0,1,0,0,1,0|2,0,0]=4 2791 B10R1.13 C=C(C)c1cnc(nc1)Br 271570a_100000694244_200012349914 [0,1,0,0,1,0|2,0,0]=4 2792 B10R1.13 C=C(C)c1cnc(nc1)C 271570a_100000694244_100000686985 [0,1,0,0,1,0|2,0,0]=4 2793 B10R1.13 C=C(C)c1cnc(nc1)F 271570a_100000694244_100000685262 [0,1,0,0,1,0|2,0,0]=4 2794 B10R1.13 C=C(C)c1cnc(nc1)N 271570a_100000694244_100000760574 [0,1,0,0,1,0|2,0,0]=4 2795 B10R1.13 C=C(C)c1ncc(cn1)Br 271570a_100000694244_100000690281 [0,1,0,0,1,0|2,0,0]=4 2796 B10R1.13 C=C(C)c1ncc(cn1)C 271570a_100000694244_100011825175 [0,1,0,0,1,0|2,0,0]=4 2797 B10R1.13 C=C(C)c1ncc(cn1)Cl 271570a_100000694244_100011356929 [0,1,0,0,1,0|2,0,0]=4 2798 B10R1.13 C=C(C)c1ncc(cn1)F 271570a_100000694244_100000685220 [0,1,0,0,1,0|2,0,0]=4 2799 B10R1.13 C=C(C)c1ncc(cn1)N 271570a_100000694244_100000068403 [0,1,0,0,1,0|2,0,0]=4 2800 B10R1.13 C=C(C)c1ncc(cn1)O 271570a_100000694244_100000730009 [0,1,0,0,1,0|2,0,0]=4 2801 B10R1.13 CC(=O)c1ccc(cc1)Br 1458a_100000185839_200000210301 [0,1,0,0,1,0|1,0,0]=3 2802 B10R1.13 CC(=O)c1ccc(cc1)C 1458a_100000188618_200000210301 [0,1,0,0,1,0|1,0,0]=3 2803 B10R1.13 CC(=O)c1ccc(cc1)Cl 1458a_100000210187_200000210301 [0,1,0,0,1,0|1,0,0]=3 2804 B10R1.13 CC(=O)c1ccc(cc1)F 1458a_100000187176_200000210301 [0,1,0,0,1,0|1,0,0]=3 2805 B10R1.13 CC(=O)c1ccc(cc1)I 1458a_100000187904_200000210301 [0,1,0,0,1,0|1,0,0]=3 2806 B10R1.13 CC(=O)c1ccc(cc1)O 1458a_100000212099_200000210301 [0,1,0,0,1,0|1,0,0]=3 2807 B10R1.13 CC(=O)c1ccc(cc1)O 271570a_203496583355_100000185465 [0,1,0,0,1,0|1,0,0]=3 2808 B10R1.13 CC(=O)c1ccc(cn1)O 271570a_203496583355_100000686046 [0,1,0,0,1,0|2,0,0]=4 2809 B10R1.13 CC(=O)c1ccc(nc1)O 271570a_203496583355_100000684857 [0,1,0,0,1,0|2,0,0]=4 2810 B10R1.13 CC(C)c1ccc(cc1)O 271570a_203496583355_100000750031 [0,1,0,0,1,0|0,0,2]=4 2811 B10R1.13 CC(O)c1ccc(cc1)O 271570a_203496583355_100000745893 [0,1,0,0,1,0|1,0,1]=4 2812 B10R1.13 CN(C)c1ccc(cc1)Br 2230a_100000219623_200000210301 [0,1,0,0,1,0|1,0,1]=4 2813 B10R1.13 CN(C)c1ccc(cc1)Br 269982a_100000219623_200000210301 [0,1,0,0,1,0|1,0,1]=4 2814 B10R1.13 CN(C)c1ccc(cc1)Br 34a_100000219623_200000210301 [0,1,0,0,1,0|1,0,1]=4 2815 B10R1.13 CN(C)c1ccc(cc1)Cl 2230a_100020629279_200000210301 [0,1,0,0,1,0|1,0,1]=4 2816 B10R1.13 CN(C)c1ccc(cc1)Cl 269982a_100020629279_200000210301 [0,1,0,0,1,0|1,0,1]=4 2817 B10R1.13 CN(C)c1ccc(cc1)Cl 34a_100020629279_200000210301 [0,1,0,0,1,0|1,0,1]=4 2818 B10R1.13 CN(C)c1ccc(cc1)F 2230a_100000219829_200000210301 [0,1,0,0,1,0|1,0,1]=4 2819 B10R1.13 CN(C)c1ccc(cc1)F 269982a_100000219829_200000210301 [0,1,0,0,1,0|1,0,1]=4 2820 B10R1.13 CN(C)c1ccc(cc1)F 34a_100000219829_200000210301 [0,1,0,0,1,0|1,0,1]=4 2821 B10R1.13 CN(C)c1ccc(cc1)I 2230a_100000743151_200000210301 [0,1,0,0,1,0|1,0,1]=4 2822 B10R1.13 CN(C)c1ccc(cc1)I 269982a_100000743151_200000210301 [0,1,0,0,1,0|1,0,1]=4 2823 B10R1.13 CN(C)c1ccc(cc1)I 34a_100000743151_200000210301 [0,1,0,0,1,0|1,0,1]=4 2824 B10R1.13 CN(C)c1ccc(cc1)O 269982a_100000182112_200000210301 [0,1,0,0,1,0|1,0,1]=4 2825 B10R1.13 CN(C)c1ccc(cc1)O 271570a_203496583355_100000210421 [0,1,0,0,1,0|1,0,1]=4 2826 B10R1.13 CN(C)c1ccc(cc1)O 34a_100000182112_200000210301 [0,1,0,0,1,0|1,0,1]=4 2827 B10R1.13 CN([13CH3])c1ccc(cc1)Br 2230a_100000219623_200025704644 [0,1,0,0,1,0|1,0,1]=4 2828 B10R1.13 CN([13CH3])c1ccc(cc1)Br 269982a_100000219623_200025704644 [0,1,0,0,1,0|1,0,1]=4 2829 B10R1.13 CN([13CH3])c1ccc(cc1)Br 34a_100000219623_200025704644 [0,1,0,0,1,0|1,0,1]=4 2830 B10R1.13 CN([13CH3])c1ccc(cc1)Cl 2230a_100020629279_200025704644 [0,1,0,0,1,0|1,0,1]=4 2831 B10R1.13 CN([13CH3])c1ccc(cc1)Cl 269982a_100020629279_200025704644 [0,1,0,0,1,0|1,0,1]=4 2832 B10R1.13 CN([13CH3])c1ccc(cc1)Cl 34a_100020629279_200025704644 [0,1,0,0,1,0|1,0,1]=4 2833 B10R1.13 CN([13CH3])c1ccc(cc1)F 2230a_100000219829_200025704644 [0,1,0,0,1,0|1,0,1]=4 2834 B10R1.13 CN([13CH3])c1ccc(cc1)F 269982a_100000219829_200025704644 [0,1,0,0,1,0|1,0,1]=4 2835 B10R1.13 CN([13CH3])c1ccc(cc1)F 34a_100000219829_200025704644 [0,1,0,0,1,0|1,0,1]=4 2836 B10R1.13 CN([13CH3])c1ccc(cc1)I 2230a_100000743151_200025704644 [0,1,0,0,1,0|1,0,1]=4 2837 B10R1.13 CN([13CH3])c1ccc(cc1)I 269982a_100000743151_200025704644 [0,1,0,0,1,0|1,0,1]=4 2838 B10R1.13 CN([13CH3])c1ccc(cc1)I 34a_100000743151_200025704644 [0,1,0,0,1,0|1,0,1]=4 2839 B10R1.13 CN([13CH3])c1ccc(cc1)O 269982a_100000182112_200025704644 [0,1,0,0,1,0|1,0,1]=4 2840 B10R1.13 CN([13CH3])c1ccc(cc1)O 34a_100000182112_200025704644 [0,1,0,0,1,0|1,0,1]=4 2841 B10R1.13 CS(=O)c1ccc(cc1)O 271570a_203496583355_100009816266 [0,1,0,0,1,0|2,0,0]=4 2842 B10R1.13 C[C@@H](N)c1ccc(cc1)O 271570a_203496583355_100000720352 [0,1,0,0,1,0|1,0,1]=4 2843 B10R1.13 C[C@H](N)c1ccc(cc1)O 271570a_203496583355_100000753911 [0,1,0,0,1,0|1,0,1]=4 2844 B10R1.13 Cc1ccc(cc1)C(=O)[13CH3] 1458a_100000188618_200025704644 [0,1,0,0,1,0|1,0,0]=3 2845 B10R1.13 Cc1ccc(cc1)N(C)C 2230a_100000219977_200000210301 [0,1,0,0,1,0|1,0,1]=4 2846 B10R1.13 Cc1ccc(cc1)N(C)C 269982a_100000219977_200000210301 [0,1,0,0,1,0|1,0,1]=4 2847 B10R1.13 Cc1ccc(cc1)N(C)C 34a_100000219977_200000210301 [0,1,0,0,1,0|1,0,1]=4 2848 B10R1.13 Cc1ccc(cc1)N(C)[13CH3] 2230a_100000219977_200025704644 [0,1,0,0,1,0|1,0,1]=4 2849 B10R1.13 Cc1ccc(cc1)N(C)[13CH3] 269982a_100000219977_200025704644 [0,1,0,0,1,0|1,0,1]=4 2850 B10R1.13 Cc1ccc(cc1)N(C)[13CH3] 34a_100000219977_200025704644 [0,1,0,0,1,0|1,0,1]=4 2851 B10R1.13 NC(=O)c1ccc(cc1)O 271570a_203496583355_100000162191 [0,1,0,0,1,0|2,0,0]=4 2852 B10R1.13 [13CH3]C(=O)c1ccc(cc1)Br 1458a_100000185839_200025704644 [0,1,0,0,1,0|1,0,0]=3 2853 B10R1.13 [13CH3]C(=O)c1ccc(cc1)Cl 1458a_100000210187_200025704644 [0,1,0,0,1,0|1,0,0]=3 2854 B10R1.13 [13CH3]C(=O)c1ccc(cc1)F 1458a_100000187176_200025704644 [0,1,0,0,1,0|1,0,0]=3 2855 B10R1.13 [13CH3]C(=O)c1ccc(cc1)I 1458a_100000187904_200025704644 [0,1,0,0,1,0|1,0,0]=3 2856 B10R1.13 [13CH3]C(=O)c1ccc(cc1)O 1458a_100000212099_200025704644 [0,1,0,0,1,0|1,0,0]=3 2857 B10R1.61 C=C(C)c1c[nH]ccc1=O 271570a_100000694244_100009998708 [0,1,0,0,1,0|1,0,0]=3 2858 B10R1.61 C=C(C)c1c[nH]ccc1=S 271570a_100000694244_200012280681 [0,1,0,0,1,0|1,0,0]=3 2859 B10R1.61 C=C(C)c1ccc[nH]c1=O 271570a_100000694244_100000050042 [0,1,0,0,1,0|1,0,0]=3 2860 B10R1.61 C=C(C)c1cccc[n+]1C 271570a_100000694244_100000212160 [0,1,0,0,1,0|1,0,0]=3 2861 B10R1.61 C=C(C)c1cccc[n+]1[O-] 271570a_100000694244_200000042595 [0,1,0,0,1,0|1,0,0]=3 2862 B10R1.61 C=C(C)c1ccccc1Br 271570a_100000694244_100000695589 [0,1,0,0,1,0|0,0,0]=2 2863 B10R1.61 C=C(C)c1ccccc1C 271570a_100000694244_100000210755 [0,1,0,0,1,0|0,0,0]=2 2864 B10R1.61 C=C(C)c1ccccc1Cl 271570a_100000694244_100000764095 [0,1,0,0,1,0|0,0,0]=2 2865 B10R1.61 C=C(C)c1ccccc1F 271570a_100000694244_100011215700 [0,1,0,0,1,0|0,0,0]=2 2866 B10R1.61 C=C(C)c1ccccc1N 271570a_100000694244_100000210017 [0,1,0,0,1,0|0,0,0]=2 2867 B10R1.61 C=C(C)c1ccccc1O 271570a_100000694244_100000739446 [0,1,0,0,1,0|0,0,0]=2 2868 B10R1.61 C=C(C)c1cccnc1Br 271570a_100000694244_100010202626 [0,1,0,0,1,0|1,0,0]=3 2869 B10R1.61 C=C(C)c1cccnc1C 271570a_100000694244_100000751574 [0,1,0,0,1,0|1,0,0]=3 2870 B10R1.61 C=C(C)c1cccnc1Cl 271570a_100000694244_100000036424 [0,1,0,0,1,0|1,0,0]=3 2871 B10R1.61 C=C(C)c1cccnc1F 271570a_100000694244_100009816115 [0,1,0,0,1,0|1,0,0]=3 2872 B10R1.61 C=C(C)c1cccnc1N 271570a_100000694244_100000045569 [0,1,0,0,1,0|1,0,0]=3 2873 B10R1.61 C=C(C)c1ccn[nH]c1=O 271570a_100000694244_100000087129 [0,1,0,0,1,0|2,0,0]=4 2874 B10R1.61 C=C(C)c1ccncc1Br 271570a_100000694244_100000726257 [0,1,0,0,1,0|1,0,0]=3 2875 B10R1.61 C=C(C)c1ccncc1C 271570a_100000694244_100015191297 [0,1,0,0,1,0|1,0,0]=3 2876 B10R1.61 C=C(C)c1ccncc1Cl 271570a_100000694244_100000708259 [0,1,0,0,1,0|1,0,0]=3 2877 B10R1.61 C=C(C)c1ccncc1F 271570a_100000694244_100000047030 [0,1,0,0,1,0|1,0,0]=3 2878 B10R1.61 C=C(C)c1ccncc1N 271570a_100000694244_100009815883 [0,1,0,0,1,0|1,0,0]=3 2879 B10R1.61 C=C(C)c1ccncc1O 271570a_100000694244_100009817591 [0,1,0,0,1,0|1,0,0]=3 2880 B10R1.61 C=C(C)c1cnccc1Br 271570a_100000694244_100010138639 [0,1,0,0,1,0|1,0,0]=3 2881 B10R1.61 C=C(C)c1cnccc1C 271570a_100000694244_100000761580 [0,1,0,0,1,0|1,0,0]=3 2882 B10R1.61 C=C(C)c1cnccc1Cl 271570a_100000694244_100009995489 [0,1,0,0,1,0|1,0,0]=3 2883 B10R1.61 C=C(C)c1cnccc1F 271570a_100000694244_100009820683 [0,1,0,0,1,0|1,0,0]=3 2884 B10R1.61 C=C(C)c1cnccc1N 271570a_100000694244_100000047001 [0,1,0,0,1,0|1,0,0]=3 2885 B10R1.61 C=C(C)c1cncnc1Br 271570a_100000694244_200012461658 [0,1,0,0,1,0|2,0,0]=4 2886 B10R1.61 C=C(C)c1cncnc1C 271570a_100000694244_100009819671 [0,1,0,0,1,0|2,0,0]=4 2887 B10R1.61 C=C(C)c1cncnc1Cl 271570a_100000694244_100000758962 [0,1,0,0,1,0|2,0,0]=4 2888 B10R1.61 C=C(C)c1cncnc1N 271570a_100000694244_100011996079 [0,1,0,0,1,0|2,0,0]=4 2889 B10R1.61 C=C(C)c1cncnc1O 271570a_100000694244_100000751107 [0,1,0,0,1,0|2,0,0]=4 2890 B10R1.61 C=C(C)c1cnncc1N 271570a_100000694244_100009829405 [0,1,0,0,1,0|2,0,0]=4 2891 B10R1.61 C=C(C)c1ncc[nH]c1=O 271570a_100000694244_100000763361 [0,1,0,0,1,0|2,0,0]=4 2892 B10R1.61 C=C(C)c1ncccc1Br 271570a_100000694244_100000696092 [0,1,0,0,1,0|1,0,0]=3 2893 B10R1.61 C=C(C)c1ncccc1C 271570a_100000694244_100000751373 [0,1,0,0,1,0|1,0,0]=3 2894 B10R1.61 C=C(C)c1ncccc1Cl 271570a_100000694244_100011356963 [0,1,0,0,1,0|1,0,0]=3 2895 B10R1.61 C=C(C)c1ncccc1F 271570a_100000694244_100000685392 [0,1,0,0,1,0|1,0,0]=3 2896 B10R1.61 C=C(C)c1ncccc1N 271570a_100000694244_100000688686 [0,1,0,0,1,0|1,0,0]=3 2897 B10R1.61 C=C(C)c1ncccc1O 271570a_100000694244_100000034122 [0,1,0,0,1,0|1,0,0]=3 2898 B10R1.61 C=C(C)c1nccnc1C 271570a_100000694244_100011999405 [0,1,0,0,1,0|2,0,0]=4 2899 B10R1.61 C=C(C)c1nccnc1F 271570a_100000694244_200010125657 [0,1,0,0,1,0|2,0,0]=4 2900 B10R1.61 C=C(C)c1nccnc1N 271570a_100000694244_100000747729 [0,1,0,0,1,0|2,0,0]=4 2901 B10R1.61 C=C(C)c1ncncc1C 271570a_100000694244_100011998708 [0,1,0,0,1,0|2,0,0]=4 2902 B10R1.61 C=C(C)c1ncncc1F 271570a_100000694244_100000069762 [0,1,0,0,1,0|2,0,0]=4 2903 B10R1.61 C=C(C)c1ncncc1N 271570a_100000694244_100000709731 [0,1,0,0,1,0|2,0,0]=4 2904 B10R1.61 C=C(C)c1nnccc1C 271570a_100000694244_100000089043 [0,1,0,0,1,0|2,0,0]=4 2905 B10R1.61 CC(=O)c1ccccc1Br 1458a_100000188424_200000210301 [0,1,0,0,1,0|1,0,0]=3 2906 B10R1.61 CC(=O)c1ccccc1C 1458a_100000212026_200000210301 [0,1,0,0,1,0|1,0,0]=3 2907 B10R1.61 CC(=O)c1ccccc1Cl 1458a_100000185844_200000210301 [0,1,0,0,1,0|1,0,0]=3 2908 B10R1.61 CC(=O)c1ccccc1F 1458a_100000188656_200000210301 [0,1,0,0,1,0|1,0,0]=3 2909 B10R1.61 CC(=O)c1ccccc1I 1458a_100000187884_200000210301 [0,1,0,0,1,0|1,0,0]=3 2910 B10R1.61 CC(=O)c1ccccc1O 1458a_100015234032_200000210301 [0,1,0,0,1,0|1,0,0]=3 2911 B10R1.61 CC(=O)c1ccccc1O 271570a_203496583355_100000751169 [0,1,0,0,1,0|1,0,0]=3 2912 B10R1.61 CC(=O)c1ccccc1[O-] 1458a_100009911694_200000210301 [0,1,0,0,1,0|1,0,0]=3 2913 B10R1.61 CC(=O)c1cccnc1O 271570a_203496583355_100000753718 [0,1,0,0,1,0|2,0,0]=4 2914 B10R1.61 CC(=O)c1ccncc1O 271570a_203496583355_100009993184 [0,1,0,0,1,0|2,0,0]=4 2915 B10R1.61 CC(=O)c1cnccc1O 271570a_203496583355_100160469449 [0,1,0,0,1,0|2,0,0]=4 2916 B10R1.61 CC(=O)c1ncccc1O 271570a_203496583355_100012348690 [0,1,0,0,1,0|2,0,0]=4 2917 B10R1.61 CC(C)c1ccccc1O 271570a_203496583355_100011218076 [0,1,0,0,1,0|0,0,2]=4 2918 B10R1.61 CC(N)c1ccccc1O 271570a_203496583355_100000181357 [0,1,0,0,1,0|1,0,1]=4 2919 B10R1.61 CC(O)c1ccccc1O 271570a_203496583355_100000702211 [0,1,0,0,1,0|1,0,1]=4 2920 B10R1.61 CN(C)c1ccccc1Br 2230a_100020606079_200000210301 [0,1,0,0,1,0|1,0,1]=4 2921 B10R1.61 CN(C)c1ccccc1Br 269982a_100020606079_200000210301 [0,1,0,0,1,0|1,0,1]=4 2922 B10R1.61 CN(C)c1ccccc1Br 34a_100020606079_200000210301 [0,1,0,0,1,0|1,0,1]=4 2923 B10R1.61 CN(C)c1ccccc1Cl 2230a_100000219374_200000210301 [0,1,0,0,1,0|1,0,1]=4 2924 B10R1.61 CN(C)c1ccccc1Cl 269982a_100000219374_200000210301 [0,1,0,0,1,0|1,0,1]=4 2925 B10R1.61 CN(C)c1ccccc1Cl 34a_100000219374_200000210301 [0,1,0,0,1,0|1,0,1]=4 2926 B10R1.61 CN(C)c1ccccc1F 2230a_100000220357_200000210301 [0,1,0,0,1,0|1,0,1]=4 2927 B10R1.61 CN(C)c1ccccc1F 269982a_100000220357_200000210301 [0,1,0,0,1,0|1,0,1]=4 2928 B10R1.61 CN(C)c1ccccc1F 34a_100000220357_200000210301 [0,1,0,0,1,0|1,0,1]=4 2929 B10R1.61 CN(C)c1ccccc1F 38a_100000220357_200000210301 [0,1,0,0,1,0|1,0,1]=4 2930 B10R1.61 CN(C)c1ccccc1O 269982a_100000033821_200000210301 [0,1,0,0,1,0|1,0,1]=4 2931 B10R1.61 CN(C)c1ccccc1O 271570a_203496583355_100011290883 [0,1,0,0,1,0|1,0,1]=4 2932 B10R1.61 CN([13CH3])c1ccccc1Br 2230a_100020606079_200025704644 [0,1,0,0,1,0|1,0,1]=4 2933 B10R1.61 CN([13CH3])c1ccccc1Br 269982a_100020606079_200025704644 [0,1,0,0,1,0|1,0,1]=4 2934 B10R1.61 CN([13CH3])c1ccccc1Br 34a_100020606079_200025704644 [0,1,0,0,1,0|1,0,1]=4 2935 B10R1.61 CN([13CH3])c1ccccc1Cl 2230a_100000219374_200025704644 [0,1,0,0,1,0|1,0,1]=4 2936 B10R1.61 CN([13CH3])c1ccccc1Cl 269982a_100000219374_200025704644 [0,1,0,0,1,0|1,0,1]=4 2937 B10R1.61 CN([13CH3])c1ccccc1Cl 34a_100000219374_200025704644 [0,1,0,0,1,0|1,0,1]=4 2938 B10R1.61 CN([13CH3])c1ccccc1F 2230a_100000220357_200025704644 [0,1,0,0,1,0|1,0,1]=4 2939 B10R1.61 CN([13CH3])c1ccccc1F 269982a_100000220357_200025704644 [0,1,0,0,1,0|1,0,1]=4 2940 B10R1.61 CN([13CH3])c1ccccc1F 34a_100000220357_200025704644 [0,1,0,0,1,0|1,0,1]=4 2941 B10R1.61 CN([13CH3])c1ccccc1F 38a_100000220357_200025704644 [0,1,0,0,1,0|1,0,1]=4 2942 B10R1.61 CN([13CH3])c1ccccc1O 269982a_100000033821_200025704644 [0,1,0,0,1,0|1,0,1]=4 2943 B10R1.61 CS(=O)c1ccccc1O 271570a_203496583355_100000734199 [0,1,0,0,1,0|2,0,0]=4 2944 B10R1.61 Cc1ccccc1C(=O)[13CH3] 1458a_100000212026_200025704644 [0,1,0,0,1,0|1,0,0]=3 2945 B10R1.61 Cc1ccccc1N(C)C 2230a_100000219699_200000210301 [0,1,0,0,1,0|1,0,1]=4 2946 B10R1.61 Cc1ccccc1N(C)C 269982a_100000219699_200000210301 [0,1,0,0,1,0|1,0,1]=4 2947 B10R1.61 Cc1ccccc1N(C)C 34a_100000219699_200000210301 [0,1,0,0,1,0|1,0,1]=4 2948 B10R1.61 Cc1ccccc1N(C)[13CH3] 2230a_100000219699_200025704644 [0,1,0,0,1,0|1,0,1]=4 2949 B10R1.61 Cc1ccccc1N(C)[13CH3] 269982a_100000219699_200025704644 [0,1,0,0,1,0|1,0,1]=4 2950 B10R1.61 Cc1ccccc1N(C)[13CH3] 34a_100000219699_200025704644 [0,1,0,0,1,0|1,0,1]=4 2951 B10R1.61 NC(=O)c1ccccc1O 271570a_203496583355_100000162227 [0,1,0,0,1,0|2,0,0]=4 2952 B10R1.61 [13CH3]C(=O)c1ccccc1Br 1458a_100000188424_200025704644 [0,1,0,0,1,0|1,0,0]=3 2953 B10R1.61 [13CH3]C(=O)c1ccccc1Cl 1458a_100000185844_200025704644 [0,1,0,0,1,0|1,0,0]=3 2954 B10R1.61 [13CH3]C(=O)c1ccccc1F 1458a_100000188656_200025704644 [0,1,0,0,1,0|1,0,0]=3 2955 B10R1.61 [13CH3]C(=O)c1ccccc1I 1458a_100000187884_200025704644 [0,1,0,0,1,0|1,0,0]=3 2956 B10R1.61 [13CH3]C(=O)c1ccccc1O 1458a_100015234032_200025704644 [0,1,0,0,1,0|1,0,0]=3 2957 B10R1.61 [13CH3]C(=O)c1ccccc1[O-] 1458a_100009911694_200025704644 [0,1,0,0,1,0|1,0,0]=3 2958 B10R1.113 C=C(C)c1c[n+](ccn1)[O-] 271570a_100000694244_100009880115 [0,1,0,0,1,0|2,0,0]=4 2959 B10R1.113 C=C(C)c1cc(ccn1)C 271570a_100000694244_100000750283 [0,1,0,0,1,0|1,0,0]=3 2960 B10R1.113 C=C(C)c1cc(ccn1)Cl 271570a_100000694244_100010167805 [0,1,0,0,1,0|1,0,0]=3 2961 B10R1.113 C=C(C)c1cc(ccn1)F 271570a_100000694244_100009817058 [0,1,0,0,1,0|1,0,0]=3 2962 B10R1.113 C=C(C)c1cc(ccn1)N 271570a_100000694244_100009814236 [0,1,0,0,1,0|1,0,0]=3 2963 B10R1.113 C=C(C)c1cc(ccn1)O 271570a_100000694244_100000762945 [0,1,0,0,1,0|1,0,0]=3 2964 B10R1.113 C=C(C)c1cc(cnn1)C 271570a_100000694244_100000070100 [0,1,0,0,1,0|2,0,0]=4 2965 B10R1.113 C=C(C)c1cc(cnn1)O 271570a_100000694244_200010734679 [0,1,0,0,1,0|2,0,0]=4 2966 B10R1.113 C=C(C)c1cc(ncn1)C 271570a_100000694244_100000744208 [0,1,0,0,1,0|2,0,0]=4 2967 B10R1.113 C=C(C)c1cc(ncn1)F 271570a_100000694244_200009880791 [0,1,0,0,1,0|2,0,0]=4 2968 B10R1.113 C=C(C)c1cc(ncn1)N 271570a_100000694244_100000701291 [0,1,0,0,1,0|2,0,0]=4 2969 B10R1.113 C=C(C)c1cc(ncn1)O 271570a_100000694244_100000765262 [0,1,0,0,1,0|2,0,0]=4 2970 B10R1.113 C=C(C)c1cc[nH]c(=O)c1 271570a_100000694244_100009816521 [0,1,0,0,1,0|1,0,0]=3 2971 B10R1.113 C=C(C)c1cc[nH]c(=O)n1 271570a_100000694244_200000134032 [0,1,0,0,1,0|2,0,0]=4 2972 B10R1.113 C=C(C)c1ccc[n+](c1)C 271570a_100000694244_100009996589 [0,1,0,0,1,0|1,0,0]=3 2973 B10R1.113 C=C(C)c1ccc[n+](c1)[O-] 271570a_100000694244_100009815978 [0,1,0,0,1,0|1,0,0]=3 2974 B10R1.113 C=C(C)c1cccc(=O)[nH]1 271570a_100000694244_100000761760 [0,1,0,0,1,0|1,0,0]=3 2975 B10R1.113 C=C(C)c1cccc(c1)Br 271570a_100000694244_100000691529 [0,1,0,0,1,0|0,0,0]=2 2976 B10R1.113 C=C(C)c1cccc(c1)C 271570a_100000694244_100011215228 [0,1,0,0,1,0|0,0,0]=2 2977 B10R1.113 C=C(C)c1cccc(c1)Cl 271570a_100000694244_100000699651 [0,1,0,0,1,0|0,0,0]=2 2978 B10R1.113 C=C(C)c1cccc(c1)F 271570a_100000694244_100000685547 [0,1,0,0,1,0|0,0,0]=2 2979 B10R1.113 C=C(C)c1cccc(c1)N 271570a_100000694244_100000210019 [0,1,0,0,1,0|0,0,0]=2 2980 B10R1.113 C=C(C)c1cccc(c1)O 271570a_100000694244_100000211634 [0,1,0,0,1,0|0,0,0]=2 2981 B10R1.113 C=C(C)c1cccc(c1)O 271570a_203496583355_100012123953 [0,1,0,0,1,0|0,0,0]=2 2982 B10R1.113 C=C(C)c1cccc(c1)[S] 271570a_100000694244_114929384022 [0,1,0,0,1,0|0,0,0]=2 2983 B10R1.113 C=C(C)c1cccc(n1)Br 271570a_100000694244_100000684672 [0,1,0,0,1,0|1,0,0]=3 2984 B10R1.113 C=C(C)c1cccc(n1)C 271570a_100000694244_100000742759 [0,1,0,0,1,0|1,0,0]=3 2985 B10R1.113 C=C(C)c1cccc(n1)F 271570a_100000694244_100009815982 [0,1,0,0,1,0|1,0,0]=3 2986 B10R1.113 C=C(C)c1cccc(n1)N 271570a_100000694244_100000740741 [0,1,0,0,1,0|1,0,0]=3 2987 B10R1.113 C=C(C)c1ccnc(c1)Br 271570a_100000694244_100009814637 [0,1,0,0,1,0|1,0,0]=3 2988 B10R1.113 C=C(C)c1ccnc(c1)C 271570a_100000694244_100000758586 [0,1,0,0,1,0|1,0,0]=3 2989 B10R1.113 C=C(C)c1ccnc(c1)Cl 271570a_100000694244_100000035001 [0,1,0,0,1,0|1,0,0]=3 2990 B10R1.113 C=C(C)c1ccnc(c1)F 271570a_100000694244_100009816116 [0,1,0,0,1,0|1,0,0]=3 2991 B10R1.113 C=C(C)c1ccnc(c1)N 271570a_100000694244_100000744379 [0,1,0,0,1,0|1,0,0]=3 2992 B10R1.113 C=C(C)c1ccnc(n1)C 271570a_100000694244_100000749937 [0,1,0,0,1,0|2,0,0]=4 2993 B10R1.113 C=C(C)c1ccnc(n1)N 271570a_100000694244_100009820717 [0,1,0,0,1,0|2,0,0]=4 2994 B10R1.113 C=C(C)c1cn[nH]c(=O)c1 271570a_100000694244_100010197405 [0,1,0,0,1,0|2,0,0]=4 2995 B10R1.113 C=C(C)c1cncc(c1)Br 271570a_100000694244_100000728054 [0,1,0,0,1,0|1,0,0]=3 2996 B10R1.113 C=C(C)c1cncc(c1)C 271570a_100000694244_100000760492 [0,1,0,0,1,0|1,0,0]=3 2997 B10R1.113 C=C(C)c1cncc(c1)Cl 271570a_100000694244_100000049639 [0,1,0,0,1,0|1,0,0]=3 2998 B10R1.113 C=C(C)c1cncc(c1)F 271570a_100000694244_100000744099 [0,1,0,0,1,0|1,0,0]=3 2999 B10R1.113 C=C(C)c1cncc(c1)N 271570a_100000694244_100000687067 [0,1,0,0,1,0|1,0,0]=3 3000 B10R1.113 C=C(C)c1cncc(c1)O 271570a_100000694244_100000754920 [0,1,0,0,1,0|1,0,0]=3 3001 B10R1.113 C=C(C)c1cncc(c1)O 271570a_203496583355_200009889500 [0,1,0,0,1,0|1,0,0]=3 3002 B10R1.113 C=C(C)c1cncc(n1)C 271570a_100000694244_100009842155 [0,1,0,0,1,0|2,0,0]=4 3003 B10R1.113 C=C(C)c1cncc(n1)F 271570a_100000694244_200009863489 [0,1,0,0,1,0|2,0,0]=4 3004 B10R1.113 C=C(C)c1cncc(n1)N 271570a_100000694244_100009819714 [0,1,0,0,1,0|2,0,0]=4 3005 B10R1.113 C=C(C)c1cncc(n1)O 271570a_100000694244_100011269956 [0,1,0,0,1,0|2,0,0]=4 3006 B10R1.113 C=C(C)c1cnnc(c1)N 271570a_100000694244_100000130277 [0,1,0,0,1,0|2,0,0]=4 3007 B10R1.113 C=C(C)c1nccc(n1)C 271570a_100000694244_100011243806 [0,1,0,0,1,0|2,0,0]=4 3008 B10R1.113 C=C(C)c1nccc(n1)N 271570a_100000694244_100000757536 [0,1,0,0,1,0|2,0,0]=4 3009 B10R1.113 C=C(C)c1nccc(n1)O 271570a_100000694244_100011649813 [0,1,0,0,1,0|2,0,0]=4 3010 B10R1.113 CC(=O)c1cc(ccn1)O 271570a_203496583355_100000709912 [0,1,0,0,1,0|2,0,0]=4 3011 B10R1.113 CC(=O)c1cccc(c1)Br 1458a_100000210664_200000210301 [0,1,0,0,1,0|1,0,0]=3 3012 B10R1.113 CC(=O)c1cccc(c1)C 1458a_100000189346_200000210301 [0,1,0,0,1,0|1,0,0]=3 3013 B10R1.113 CC(=O)c1cccc(c1)Cl 1458a_100000210390_200000210301 [0,1,0,0,1,0|1,0,0]=3 3014 B10R1.113 CC(=O)c1cccc(c1)F 1458a_100000210950_200000210301 [0,1,0,0,1,0|1,0,0]=3 3015 B10R1.113 CC(=O)c1cccc(c1)I 1458a_100000184098_200000210301 [0,1,0,0,1,0|1,0,0]=3 3016 B10R1.113 CC(=O)c1cccc(c1)O 1458a_100000183914_200000210301 [0,1,0,0,1,0|1,0,0]=3 3017 B10R1.113 CC(=O)c1cccc(c1)O 271570a_203496583355_100000210093 [0,1,0,0,1,0|1,0,0]=3 3018 B10R1.113 CC(=O)c1cccc(n1)O 271570a_203496583355_100009816502 [0,1,0,0,1,0|2,0,0]=4 3019 B10R1.113 CC(=O)c1ccnc(c1)O 271570a_203496583355_100000685609 [0,1,0,0,1,0|2,0,0]=4 3020 B10R1.113 CC(=O)c1cncc(c1)O 271570a_203496583355_100011216243 [0,1,0,0,1,0|2,0,0]=4 3021 B10R1.113 CC(C)c1cccc(c1)O 271570a_203496583355_100011214899 [0,1,0,0,1,0|0,0,2]=4 3022 B10R1.113 CC(N)c1cccc(c1)O 271570a_203496583355_100020642005 [0,1,0,0,1,0|1,0,1]=4 3023 B10R1.113 CC(O)c1cccc(c1)O 271570a_203496583355_100000246457 [0,1,0,0,1,0|1,0,1]=4 3024 B10R1.113 CN(C)c1cccc(c1)Br 2230a_100000219648_200000210301 [0,1,0,0,1,0|1,0,1]=4 3025 B10R1.113 CN(C)c1cccc(c1)Br 269982a_100000219648_200000210301 [0,1,0,0,1,0|1,0,1]=4 3026 B10R1.113 CN(C)c1cccc(c1)Br 34a_100000219648_200000210301 [0,1,0,0,1,0|1,0,1]=4 3027 B10R1.113 CN(C)c1cccc(c1)Cl 2230a_100000220044_200000210301 [0,1,0,0,1,0|1,0,1]=4 3028 B10R1.113 CN(C)c1cccc(c1)Cl 269982a_100000220044_200000210301 [0,1,0,0,1,0|1,0,1]=4 3029 B10R1.113 CN(C)c1cccc(c1)Cl 34a_100000220044_200000210301 [0,1,0,0,1,0|1,0,1]=4 3030 B10R1.113 CN(C)c1cccc(c1)F 2230a_100020633736_200000210301 [0,1,0,0,1,0|1,0,1]=4 3031 B10R1.113 CN(C)c1cccc(c1)F 269982a_100020633736_200000210301 [0,1,0,0,1,0|1,0,1]=4 3032 B10R1.113 CN(C)c1cccc(c1)F 34a_100020633736_200000210301 [0,1,0,0,1,0|1,0,1]=4 3033 B10R1.113 CN(C)c1cccc(c1)I 2230a_100000221217_200000210301 [0,1,0,0,1,0|1,0,1]=4 3034 B10R1.113 CN(C)c1cccc(c1)I 269982a_100000221217_200000210301 [0,1,0,0,1,0|1,0,1]=4 3035 B10R1.113 CN(C)c1cccc(c1)I 34a_100000221217_200000210301 [0,1,0,0,1,0|1,0,1]=4 3036 B10R1.113 CN(C)c1cccc(c1)O 2230a_100000756613_200000210301 [0,1,0,0,1,0|1,0,1]=4 3037 B10R1.113 CN(C)c1cccc(c1)O 269982a_100000756613_200000210301 [0,1,0,0,1,0|1,0,1]=4 3038 B10R1.113 CN(C)c1cccc(c1)O 271570a_203496583355_100011215952 [0,1,0,0,1,0|1,0,1]=4 3039 B10R1.113 CN(C)c1cccc(c1)O 34a_100000756613_200000210301 [0,1,0,0,1,0|1,0,1]=4 3040 B10R1.113 CN([13CH3])c1cccc(c1)Br 2230a_100000219648_200025704644 [0,1,0,0,1,0|1,0,1]=4 3041 B10R1.113 CN([13CH3])c1cccc(c1)Br 269982a_100000219648_200025704644 [0,1,0,0,1,0|1,0,1]=4 3042 B10R1.113 CN([13CH3])c1cccc(c1)Br 34a_100000219648_200025704644 [0,1,0,0,1,0|1,0,1]=4 3043 B10R1.113 CN([13CH3])c1cccc(c1)Cl 2230a_100000220044_200025704644 [0,1,0,0,1,0|1,0,1]=4 3044 B10R1.113 CN([13CH3])c1cccc(c1)Cl 269982a_100000220044_200025704644 [0,1,0,0,1,0|1,0,1]=4 3045 B10R1.113 CN([13CH3])c1cccc(c1)Cl 34a_100000220044_200025704644 [0,1,0,0,1,0|1,0,1]=4 3046 B10R1.113 CN([13CH3])c1cccc(c1)F 2230a_100020633736_200025704644 [0,1,0,0,1,0|1,0,1]=4 3047 B10R1.113 CN([13CH3])c1cccc(c1)F 269982a_100020633736_200025704644 [0,1,0,0,1,0|1,0,1]=4 3048 B10R1.113 CN([13CH3])c1cccc(c1)F 34a_100020633736_200025704644 [0,1,0,0,1,0|1,0,1]=4 3049 B10R1.113 CN([13CH3])c1cccc(c1)I 2230a_100000221217_200025704644 [0,1,0,0,1,0|1,0,1]=4 3050 B10R1.113 CN([13CH3])c1cccc(c1)I 269982a_100000221217_200025704644 [0,1,0,0,1,0|1,0,1]=4 3051 B10R1.113 CN([13CH3])c1cccc(c1)I 34a_100000221217_200025704644 [0,1,0,0,1,0|1,0,1]=4 3052 B10R1.113 CN([13CH3])c1cccc(c1)O 2230a_100000756613_200025704644 [0,1,0,0,1,0|1,0,1]=4 3053 B10R1.113 CN([13CH3])c1cccc(c1)O 269982a_100000756613_200025704644 [0,1,0,0,1,0|1,0,1]=4 3054 B10R1.113 CN([13CH3])c1cccc(c1)O 34a_100000756613_200025704644 [0,1,0,0,1,0|1,0,1]=4 3055 B10R1.113 CS(=O)c1cccc(c1)O 271570a_203496583355_100009816267 [0,1,0,0,1,0|2,0,0]=4 3056 B10R1.113 Cc1cccc(c1)C(=O)[13CH3] 1458a_100000189346_200025704644 [0,1,0,0,1,0|1,0,0]=3 3057 B10R1.113 Cc1cccc(c1)N(C)C 2230a_100000219674_200000210301 [0,1,0,0,1,0|1,0,1]=4 3058 B10R1.113 Cc1cccc(c1)N(C)C 269982a_100000219674_200000210301 [0,1,0,0,1,0|1,0,1]=4 3059 B10R1.113 Cc1cccc(c1)N(C)C 34a_100000219674_200000210301 [0,1,0,0,1,0|1,0,1]=4 3060 B10R1.113 Cc1cccc(c1)N(C)[13CH3] 2230a_100000219674_200025704644 [0,1,0,0,1,0|1,0,1]=4 3061 B10R1.113 Cc1cccc(c1)N(C)[13CH3] 269982a_100000219674_200025704644 [0,1,0,0,1,0|1,0,1]=4 3062 B10R1.113 Cc1cccc(c1)N(C)[13CH3] 34a_100000219674_200025704644 [0,1,0,0,1,0|1,0,1]=4 3063 B10R1.113 NC(=O)c1cccc(c1)O 271570a_203496583355_100000162208 [0,1,0,0,1,0|2,0,0]=4 3064 B10R1.113 [13CH3]C(=O)c1cccc(c1)Br 1458a_100000210664_200025704644 [0,1,0,0,1,0|1,0,0]=3 3065 B10R1.113 [13CH3]C(=O)c1cccc(c1)Cl 1458a_100000210390_200025704644 [0,1,0,0,1,0|1,0,0]=3 3066 B10R1.113 [13CH3]C(=O)c1cccc(c1)F 1458a_100000210950_200025704644 [0,1,0,0,1,0|1,0,0]=3 3067 B10R1.113 [13CH3]C(=O)c1cccc(c1)I 1458a_100000184098_200025704644 [0,1,0,0,1,0|1,0,0]=3 3068 B10R1.113 [13CH3]C(=O)c1cccc(c1)O 1458a_100000183914_200025704644 [0,1,0,0,1,0|1,0,0]=3 3069 B10R1.23 CC(=O)C(C)n1cccc1 1458a_100000243804_200000210301 [0,1,0,0,1,0|2,0,0]=4 3070 B10R1.23 CC(C(=O)[13CH3])n1cccc1 1458a_100000243804_200025704644 [0,1,0,0,1,0|2,0,0]=4 3071 B10R1.27 C=CC(=O)Cc1ccsc1 1458a_100000185746_100011233845 [0,1,0,0,1,0|2,0,0]=4 3072 B10R1.27 CCC(=O)Cc1ccc[nH]1 1458a_100000238377_100000210202 [0,1,0,0,1,0|2,0,0]=4 3073 B10R1.27 CCC(=O)Cc1ccco1 1458a_100011217309_100000210202 [0,1,0,0,1,0|2,0,0]=4 3074 B10R1.27 CCC(=O)Cc1cccs1 1458a_100000210189_100000210202 [0,1,0,0,1,0|2,0,0]=4 3075 B10R1.27 CCC(=O)Cc1ccoc1 1458a_100000684892_100000210202 [0,1,0,0,1,0|2,0,0]=4 3076 B10R1.27 CCC(=O)Cc1ccsc1 1458a_100000184062_100000210202 [0,1,0,0,1,0|2,0,0]=4 3077 B10R1.27 CCC(=O)Cc1ccsc1 1458a_100000210414_100011233845 [0,1,0,0,1,0|2,0,0]=4 3078 B10R1.27 CCC(=O)Cn1cccc1 1458a_100011196272_100000210202 [0,1,0,0,1,0|2,0,0]=4 3079 B10R1.27 CNC(=O)Cc1ccc[nH]1 11a_106832991635_100000238377 [0,1,0,0,1,0|2,0,0]=4 3080 B10R1.27 CNC(=O)Cc1ccc[nH]1 240690a_100102657272_100000238377 [0,1,0,0,1,0|2,0,0]=4 3081 B10R1.27 CNC(=O)Cc1ccc[nH]1 527a_100102657272_100000238377 [0,1,0,0,1,0|2,0,0]=4 3082 B10R1.27 CNC(=O)Cc1ccco1 11a_106832991635_100011217309 [0,1,0,0,1,0|2,0,0]=4 3083 B10R1.27 CNC(=O)Cc1ccco1 527a_100102657272_100011217309 [0,1,0,0,1,0|2,0,0]=4 3084 B10R1.27 CNC(=O)Cc1cccs1 11a_106832991635_100000210189 [0,1,0,0,1,0|2,0,0]=4 3085 B10R1.27 CNC(=O)Cc1cccs1 1626a_100102657272_100000210189 [0,1,0,0,1,0|2,0,0]=4 3086 B10R1.27 CNC(=O)Cc1cccs1 240690a_100102657272_100000210189 [0,1,0,0,1,0|2,0,0]=4 3087 B10R1.27 CNC(=O)Cc1ccoc1 11a_106832991635_100000684892 [0,1,0,0,1,0|2,0,0]=4 3088 B10R1.27 CNC(=O)Cc1ccoc1 1626a_100102657272_100000684892 [0,1,0,0,1,0|2,0,0]=4 3089 B10R1.27 CNC(=O)Cc1ccoc1 240690a_100102657272_100000684892 [0,1,0,0,1,0|2,0,0]=4 3090 B10R1.27 CNC(=O)Cc1ccoc1 527a_100102657272_100000684892 [0,1,0,0,1,0|2,0,0]=4 3091 B10R1.27 CNC(=O)Cc1ccsc1 11a_106832991635_100000184062 [0,1,0,0,1,0|2,0,0]=4 3092 B10R1.27 CNC(=O)Cc1ccsc1 1626a_100102657272_100000184062 [0,1,0,0,1,0|2,0,0]=4 3093 B10R1.27 CNC(=O)Cc1ccsc1 240690a_100102657272_100000184062 [0,1,0,0,1,0|2,0,0]=4 3094 B10R1.27 CNC(=O)Cc1ccsc1 527a_100102657272_100000184062 [0,1,0,0,1,0|2,0,0]=4 3095 B10R1.27 CNC(=O)Cn1cccc1 11a_106832991635_100011196272 [0,1,0,0,1,0|2,0,0]=4 3096 B10R1.27 CNC(=O)Cn1cccc1 1626a_100102657272_100011196272 [0,1,0,0,1,0|2,0,0]=4 3097 B10R1.27 CNC(=O)Cn1cccc1 527a_100102657272_100011196272 [0,1,0,0,1,0|2,0,0]=4 3098 B10R1.27 O=C(CF)Cc1ccc[nH]1 1458a_100000238377_100015361967 [0,1,0,0,1,0|2,0,0]=4 3099 B10R1.27 O=C(CF)Cc1ccco1 1458a_100011217309_100015361967 [0,1,0,0,1,0|2,0,0]=4 3100 B10R1.27 O=C(CF)Cc1cccs1 1458a_100000210189_100015361967 [0,1,0,0,1,0|2,0,0]=4 3101 B10R1.27 O=C(CF)Cc1ccoc1 1458a_100000684892_100015361967 [0,1,0,0,1,0|2,0,0]=4 3102 B10R1.27 O=C(CF)Cc1ccsc1 1458a_100000184062_100015361967 [0,1,0,0,1,0|2,0,0]=4 3103 B10R1.27 O=C(CF)Cn1cccc1 1458a_100011196272_100015361967 [0,1,0,0,1,0|2,0,0]=4 3104 B10R1.27 O=C(CO)Cc1ccsc1 1458a_100000210174_100011233845 [0,1,0,0,1,0|2,0,0]=4 3105 B10R1.54 CC(=O)Cc1cc(cs1)Br 1458a_100000070787_100000746031 [0,1,0,0,1,0|2,0,0]=4 3106 B10R1.54 CC(=O)Cc1cc(cs1)Br 1458a_100011542370_200000210301 [0,1,0,0,1,0|2,0,0]=4 3107 B10R1.54 CC(=O)Cc1ccc(s1)Br 1458a_100000070787_100000708592 [0,1,0,0,1,0|2,0,0]=4 3108 B10R1.54 CC(=O)Cc1ccc(s1)Br 1458a_100000238643_200000210301 [0,1,0,0,1,0|2,0,0]=4 3109 B10R1.54 CC(=O)Cc1ccc(s1)Cl 1458a_100000070787_100000185097 [0,1,0,0,1,0|2,0,0]=4 3110 B10R1.54 CC(=O)Cc1ccc(s1)Cl 1458a_100000238644_200000210301 [0,1,0,0,1,0|2,0,0]=4 3111 B10R1.54 [13CH3]C(=O)Cc1cc(cs1)Br 1458a_100011542370_200025704644 [0,1,0,0,1,0|2,0,0]=4 3112 B10R1.54 [13CH3]C(=O)Cc1ccc(s1)Br 1458a_100000238643_200025704644 [0,1,0,0,1,0|2,0,0]=4 3113 B10R1.54 [13CH3]C(=O)Cc1ccc(s1)Cl 1458a_100000238644_200025704644 [0,1,0,0,1,0|2,0,0]=4 3114 B10R1.64 CC(=O)Cc1ccsc1Br 1458a_100000070787_100009814289 [0,1,0,0,1,0|2,0,0]=4 3115 B10R1.64 CC(=O)Cc1ccsc1Cl 1458a_100000070787_100010167017 [0,1,0,0,1,0|2,0,0]=4 3116 B12R1.21 C=C(C)CNc1ccc(cc1)Br 2230a_100000210018_100000748629 [0,1,0,0,0,1|0,0,0]=2 3117 B12R1.21 C=C(C)CNc1ccc(cc1)Br 34a_100000210018_100000748629 [0,1,0,0,0,1|0,0,0]=2 3118 B12R1.21 C=C(C)CNc1ccc(cc1)C 34a_100000124888_100000748629 [0,1,0,0,0,1|0,0,0]=2 3119 B12R1.21 C=C(C)CNc1ccc(cc1)Cl 2230a_100000210052_100000748629 [0,1,0,0,0,1|0,0,0]=2 3120 B12R1.21 C=C(C)CNc1ccc(cc1)Cl 34a_100000210052_100000748629 [0,1,0,0,0,1|0,0,0]=2 3121 B12R1.21 C=C(C)CNc1ccc(cc1)F 34a_100000185862_100000748629 [0,1,0,0,0,1|0,0,0]=2 3122 B12R1.21 C=C(C)CNc1ccc(cc1)I 34a_100000185761_100000748629 [0,1,0,0,0,1|0,0,0]=2 3123 B12R1.21 C=C(C)CNc1ccc(cc1)O 34a_100000185829_100000748629 [0,1,0,0,0,1|0,0,0]=2 3124 B12R1.21 C=C(C)CNc1ccc(cn1)Br 27a_100000765925_100000686858 [0,1,0,0,0,1|1,0,0]=3 3125 B12R1.21 C=C(C)CNc1ccc(nn1)C 27a_100000765925_100000744512 [0,1,0,0,0,1|2,0,0]=4 3126 B12R1.21 C=C(C)CNc1cnc(cn1)Br 27a_100000765925_100010187541 [0,1,0,0,0,1|2,0,0]=4 3127 B12R1.21 C=C(C)CNc1cnc(cn1)C 27a_100000765925_100000074397 [0,1,0,0,0,1|2,0,0]=4 3128 B12R1.21 C=C(C)CNc1cnc(cn1)F 27a_100000765925_100009856528 [0,1,0,0,0,1|2,0,0]=4 3129 B12R1.21 C=C(C)CNc1ncc(cn1)Br 27a_100000765925_100000690281 [0,1,0,0,0,1|2,0,0]=4 3130 B12R1.21 C=C(C)CNc1ncc(cn1)C 27a_100000765925_100000061069 [0,1,0,0,0,1|2,0,0]=4 3131 B12R1.21 C=C(C)CNc1ncc(cn1)Cl 27a_100000765925_100011356929 [0,1,0,0,0,1|2,0,0]=4 3132 B12R1.21 C=C(C)CNc1ncc(cn1)F 27a_100000765925_100000685220 [0,1,0,0,0,1|2,0,0]=4 3133 B12R1.21 C=C(C)COc1ccc(=O)[nH]c1 34a_100000075641_100000748629 [0,1,0,0,0,1|1,0,0]=3 3134 B12R1.21 C=C(C)COc1ccc(cc1)Br 34a_100000185759_100000748629 [0,1,0,0,0,1|0,0,0]=2 3135 B12R1.21 C=C(C)COc1ccc(cc1)Br 7a_100000185759_100000748629 [0,1,0,0,0,1|0,0,0]=2 3136 B12R1.21 C=C(C)COc1ccc(cc1)C 34a_100000210336_100000748629 [0,1,0,0,0,1|0,0,0]=2 3137 B12R1.21 C=C(C)COc1ccc(cc1)C 7a_100000210336_100000748629 [0,1,0,0,0,1|0,0,0]=2 3138 B12R1.21 C=C(C)COc1ccc(cc1)Cl 34a_100000210216_100000748629 [0,1,0,0,0,1|0,0,0]=2 3139 B12R1.21 C=C(C)COc1ccc(cc1)Cl 7a_100000210216_100000748629 [0,1,0,0,0,1|0,0,0]=2 3140 B12R1.21 C=C(C)COc1ccc(cc1)F 34a_100000210339_100000748629 [0,1,0,0,0,1|0,0,0]=2 3141 B12R1.21 C=C(C)COc1ccc(cc1)I 34a_100000212066_100000748629 [0,1,0,0,0,1|0,0,0]=2 3142 B12R1.21 C=C(C)COc1ccc(cc1)I 7a_100000212066_100000748629 [0,1,0,0,0,1|0,0,0]=2 3143 B12R1.21 C=C(C)COc1ccc(cc1)N 34a_100000185829_100000748629 [0,1,0,0,0,1|0,0,0]=2 3144 B12R1.21 C=C(C)COc1ccc(cn1)C 34a_100000759353_100000748629 [0,1,0,0,0,1|1,0,0]=3 3145 B12R1.21 C=C(C)COc1ccc(cn1)Cl 34a_100011215309_100000748629 [0,1,0,0,0,1|1,0,0]=3 3146 B12R1.21 C=C(C)COc1ccc(cn1)F 34a_100000742473_100000748629 [0,1,0,0,0,1|1,0,0]=3 3147 B12R1.21 C=C(C)COc1ccc(cn1)N 34a_100000729260_100000748629 [0,1,0,0,0,1|1,0,0]=3 3148 B12R1.21 C=C(C)COc1ccc(nc1)Br 34a_100000685995_100000748629 [0,1,0,0,0,1|1,0,0]=3 3149 B12R1.21 C=C(C)COc1ccc(nc1)Br 7a_100000685995_100000748629 [0,1,0,0,0,1|1,0,0]=3 3150 B12R1.21 C=C(C)COc1ccc(nc1)C 34a_100000745506_100000748629 [0,1,0,0,0,1|1,0,0]=3 3151 B12R1.21 C=C(C)COc1ccc(nc1)C 7a_100000745506_100000748629 [0,1,0,0,0,1|1,0,0]=3 3152 B12R1.21 C=C(C)COc1ccc(nc1)Cl 34a_100000744096_100000748629 [0,1,0,0,0,1|1,0,0]=3 3153 B12R1.21 C=C(C)COc1ccc(nc1)Cl 7a_100000744096_100000748629 [0,1,0,0,0,1|1,0,0]=3 3154 B12R1.21 C=C(C)COc1ccc(nc1)F 34a_100000688820_100000748629 [0,1,0,0,0,1|1,0,0]=3 3155 B12R1.21 C=C(C)COc1ccc(nc1)F 7a_100000688820_100000748629 [0,1,0,0,0,1|1,0,0]=3 3156 B12R1.21 C=C(C)COc1ccc(nc1)I 34a_100000687607_100000748629 [0,1,0,0,0,1|1,0,0]=3 3157 B12R1.21 C=C(C)COc1ccc(nc1)I 7a_100000687607_100000748629 [0,1,0,0,0,1|1,0,0]=3 3158 B12R1.21 C=C(C)COc1ccc(nc1)N 34a_100015188713_100000748629 [0,1,0,0,0,1|1,0,0]=3 3159 B12R1.21 C=C(C)COc1ccc(nc1)N 7a_100015188713_100000748629 [0,1,0,0,0,1|1,0,0]=3 3160 B12R1.21 C=C(C)COc1cnc(cn1)Br 34a_100011934580_100000748629 [0,1,0,0,0,1|2,0,0]=4 3161 B12R1.21 C=C(C)COc1cnc(cn1)Cl 34a_100015839800_100000748629 [0,1,0,0,0,1|2,0,0]=4 3162 B12R1.21 C=C(C)COc1cnc(nc1)Br 34a_100000730009_100000748629 [0,1,0,0,0,1|2,0,0]=4 3163 B12R1.21 C=C(C)COc1cnc(nc1)Br 7a_100000730009_100000748629 [0,1,0,0,0,1|2,0,0]=4 3164 B12R1.21 C=C(C)COc1cnc(nc1)C 34a_100000062939_100000748629 [0,1,0,0,0,1|2,0,0]=4 3165 B12R1.21 C=C(C)COc1cnc(nc1)C 7a_100000062939_100000748629 [0,1,0,0,0,1|2,0,0]=4 3166 B12R1.21 C=C(C)COc1cnc(nc1)Cl 34a_100000092845_100000748629 [0,1,0,0,0,1|2,0,0]=4 3167 B12R1.21 C=C(C)COc1cnc(nc1)Cl 7a_100000092845_100000748629 [0,1,0,0,0,1|2,0,0]=4 3168 B12R1.21 C=C(C)COc1cnc(nc1)F 34a_200009874573_100000748629 [0,1,0,0,0,1|2,0,0]=4 3169 B12R1.21 C=C(C)COc1cnc(nc1)F 7a_200009874573_100000748629 [0,1,0,0,0,1|2,0,0]=4 3170 B12R1.21 C=C(C)COc1cnc(nc1)N 34a_100000087137_100000748629 [0,1,0,0,0,1|2,0,0]=4 3171 B12R1.21 C=C(C)COc1cnc(nc1)N 7a_100000087137_100000748629 [0,1,0,0,0,1|2,0,0]=4 3172 B12R1.21 C=C(C)COc1ncc(cn1)F 34a_100011934040_100000748629 [0,1,0,0,0,1|2,0,0]=4 3173 B12R1.21 C=C(C)CSc1cc[n+](cc1)[O-] 62a_100000748629_100000039755 [0,1,0,0,0,1|1,0,0]=3 3174 B12R1.21 C=C(C)CSc1ccc(=O)[nH]c1 62a_100000212171_100000211660 [0,1,0,0,0,1|1,0,0]=3 3175 B12R1.21 C=C(C)CSc1ccc(=O)[nH]c1 62a_100000748629_100000212171 [0,1,0,0,0,1|1,0,0]=3 3176 B12R1.21 C=C(C)CSc1ccc(=O)[nH]n1 62a_100000748629_100009820020 [0,1,0,0,0,1|2,0,0]=4 3177 B12R1.21 C=C(C)CSc1ccc(=O)[nH]n1 62a_100009820020_100000211660 [0,1,0,0,0,1|2,0,0]=4 3178 B12R1.21 C=C(C)CSc1ccc(cc1)Br 62a_100000748629_100000752885 [0,1,0,0,0,1|0,0,0]=2 3179 B12R1.21 C=C(C)CSc1ccc(cc1)Br 62a_100000752885_100000211660 [0,1,0,0,0,1|0,0,0]=2 3180 B12R1.21 C=C(C)CSc1ccc(cc1)C 62a_100000186775_100000211660 [0,1,0,0,0,1|0,0,0]=2 3181 B12R1.21 C=C(C)CSc1ccc(cc1)C 62a_100000748629_100000186775 [0,1,0,0,0,1|0,0,0]=2 3182 B12R1.21 C=C(C)CSc1ccc(cc1)Cl 62a_100000748629_100000755918 [0,1,0,0,0,1|0,0,0]=2 3183 B12R1.21 C=C(C)CSc1ccc(cc1)Cl 62a_100000755918_100000211660 [0,1,0,0,0,1|0,0,0]=2 3184 B12R1.21 C=C(C)CSc1ccc(cc1)F 62a_100000211213_100000211660 [0,1,0,0,0,1|0,0,0]=2 3185 B12R1.21 C=C(C)CSc1ccc(cc1)F 62a_100000748629_100000211213 [0,1,0,0,0,1|0,0,0]=2 3186 B12R1.21 C=C(C)CSc1ccc(cc1)N 62a_100000185761_100000211660 [0,1,0,0,0,1|0,0,0]=2 3187 B12R1.21 C=C(C)CSc1ccc(cc1)N 62a_100000748629_100000185761 [0,1,0,0,0,1|0,0,0]=2 3188 B12R1.21 C=C(C)CSc1ccc(cc1)O 62a_100000748629_100000185759 [0,1,0,0,0,1|0,0,0]=2 3189 B12R1.21 C=C(C)CSc1ccc(cn1)Br 62a_100000686858_100000211660 [0,1,0,0,0,1|1,0,0]=3 3190 B12R1.21 C=C(C)CSc1ccc(cn1)Br 62a_100000748629_100000686858 [0,1,0,0,0,1|1,0,0]=3 3191 B12R1.21 C=C(C)CSc1ccc(cn1)C 62a_100000748629_100000754016 [0,1,0,0,0,1|1,0,0]=3 3192 B12R1.21 C=C(C)CSc1ccc(cn1)C 62a_100011192072_100000211660 [0,1,0,0,0,1|1,0,0]=3 3193 B12R1.21 C=C(C)CSc1ccc(cn1)Cl 62a_100000748629_100011356976 [0,1,0,0,0,1|1,0,0]=3 3194 B12R1.21 C=C(C)CSc1ccc(cn1)Cl 62a_100011356976_100000211660 [0,1,0,0,0,1|1,0,0]=3 3195 B12R1.21 C=C(C)CSc1ccc(cn1)F 62a_100000744514_100000211660 [0,1,0,0,0,1|1,0,0]=3 3196 B12R1.21 C=C(C)CSc1ccc(cn1)F 62a_100000748629_100000744514 [0,1,0,0,0,1|1,0,0]=3 3197 B12R1.21 C=C(C)CSc1ccc(cn1)N 62a_100000737798_100000211660 [0,1,0,0,0,1|1,0,0]=3 3198 B12R1.21 C=C(C)CSc1ccc(cn1)N 62a_100000748629_100000737798 [0,1,0,0,0,1|1,0,0]=3 3199 B12R1.21 C=C(C)CSc1ccc(cn1)O 62a_100000685995_100000211660 [0,1,0,0,0,1|1,0,0]=3 3200 B12R1.21 C=C(C)CSc1ccc(cn1)O 62a_100000748629_100000744096 [0,1,0,0,0,1|1,0,0]=3 3201 B12R1.21 C=C(C)CSc1ccc(nc1)Br 62a_100000748629_100009814638 [0,1,0,0,0,1|1,0,0]=3 3202 B12R1.21 C=C(C)CSc1ccc(nc1)Br 62a_100009814638_100000211660 [0,1,0,0,0,1|1,0,0]=3 3203 B12R1.21 C=C(C)CSc1ccc(nc1)C 62a_100000748629_100000751577 [0,1,0,0,0,1|1,0,0]=3 3204 B12R1.21 C=C(C)CSc1ccc(nc1)C 62a_100000751577_100000211660 [0,1,0,0,0,1|1,0,0]=3 3205 B12R1.21 C=C(C)CSc1ccc(nc1)Cl 62a_100000034144_100000211660 [0,1,0,0,0,1|1,0,0]=3 3206 B12R1.21 C=C(C)CSc1ccc(nc1)Cl 62a_100000748629_100000034144 [0,1,0,0,0,1|1,0,0]=3 3207 B12R1.21 C=C(C)CSc1ccc(nc1)F 62a_100000042367_100000211660 [0,1,0,0,0,1|1,0,0]=3 3208 B12R1.21 C=C(C)CSc1ccc(nc1)F 62a_100000748629_100000042367 [0,1,0,0,0,1|1,0,0]=3 3209 B12R1.21 C=C(C)CSc1ccc(nc1)N 62a_100000187370_100000211660 [0,1,0,0,0,1|1,0,0]=3 3210 B12R1.21 C=C(C)CSc1ccc(nc1)N 62a_100000748629_100000187370 [0,1,0,0,0,1|1,0,0]=3 3211 B12R1.21 C=C(C)CSc1ccc(nn1)C 62a_100000744512_100000211660 [0,1,0,0,0,1|2,0,0]=4 3212 B12R1.21 C=C(C)CSc1ccc(nn1)C 62a_100000748629_100000744512 [0,1,0,0,0,1|2,0,0]=4 3213 B12R1.21 C=C(C)CSc1ccc(nn1)Cl 62a_100000068654_100000211660 [0,1,0,0,0,1|2,0,0]=4 3214 B12R1.21 C=C(C)CSc1ccc(nn1)Cl 62a_100000748629_100000068654 [0,1,0,0,0,1|2,0,0]=4 3215 B12R1.21 C=C(C)CSc1ccc(nn1)N 62a_100000748629_100010219413 [0,1,0,0,0,1|2,0,0]=4 3216 B12R1.21 C=C(C)CSc1ccc(nn1)N 62a_100010219413_100000211660 [0,1,0,0,0,1|2,0,0]=4 3217 B12R1.21 C=C(C)CSc1cnc(=O)[nH]c1 62a_100000748629_102495366499 [0,1,0,0,0,1|2,0,0]=4 3218 B12R1.21 C=C(C)CSc1cnc(=O)[nH]c1 62a_102495366499_100000211660 [0,1,0,0,0,1|2,0,0]=4 3219 B12R1.21 C=C(C)CSc1cnc(cn1)Br 62a_100000748629_100010187541 [0,1,0,0,0,1|2,0,0]=4 3220 B12R1.21 C=C(C)CSc1cnc(cn1)Br 62a_100010187541_100000211660 [0,1,0,0,0,1|2,0,0]=4 3221 B12R1.21 C=C(C)CSc1cnc(cn1)C 62a_100000748629_100011999403 [0,1,0,0,0,1|2,0,0]=4 3222 B12R1.21 C=C(C)CSc1cnc(cn1)C 62a_100011999403_100000211660 [0,1,0,0,0,1|2,0,0]=4 3223 B12R1.21 C=C(C)CSc1cnc(cn1)Cl 62a_100000748629_100010214907 [0,1,0,0,0,1|2,0,0]=4 3224 B12R1.21 C=C(C)CSc1cnc(cn1)Cl 62a_100010214907_100000211660 [0,1,0,0,0,1|2,0,0]=4 3225 B12R1.21 C=C(C)CSc1cnc(cn1)F 62a_100000748629_100009856528 [0,1,0,0,0,1|2,0,0]=4 3226 B12R1.21 C=C(C)CSc1cnc(cn1)F 62a_100009856528_100000211660 [0,1,0,0,0,1|2,0,0]=4 3227 B12R1.21 C=C(C)CSc1cnc(cn1)N 62a_100000744751_100000211660 [0,1,0,0,0,1|2,0,0]=4 3228 B12R1.21 C=C(C)CSc1cnc(cn1)N 62a_100000748629_100000744751 [0,1,0,0,0,1|2,0,0]=4 3229 B12R1.21 C=C(C)CSc1cnc(cn1)O 62a_100000748629_100015839800 [0,1,0,0,0,1|2,0,0]=4 3230 B12R1.21 C=C(C)CSc1cnc(cn1)O 62a_100011934580_100000211660 [0,1,0,0,0,1|2,0,0]=4 3231 B12R1.21 C=C(C)CSc1cnc(nc1)Br 62a_100000748629_200012349914 [0,1,0,0,0,1|2,0,0]=4 3232 B12R1.21 C=C(C)CSc1cnc(nc1)Br 62a_200012349914_100000211660 [0,1,0,0,0,1|2,0,0]=4 3233 B12R1.21 C=C(C)CSc1cnc(nc1)C 62a_100000686985_100000211660 [0,1,0,0,0,1|2,0,0]=4 3234 B12R1.21 C=C(C)CSc1cnc(nc1)C 62a_100000748629_100000686985 [0,1,0,0,0,1|2,0,0]=4 3235 B12R1.21 C=C(C)CSc1cnc(nc1)Cl 62a_100000059775_100000211660 [0,1,0,0,0,1|2,0,0]=4 3236 B12R1.21 C=C(C)CSc1cnc(nc1)Cl 62a_100000748629_100000059775 [0,1,0,0,0,1|2,0,0]=4 3237 B12R1.21 C=C(C)CSc1cnc(nc1)F 62a_100000685262_100000211660 [0,1,0,0,0,1|2,0,0]=4 3238 B12R1.21 C=C(C)CSc1cnc(nc1)F 62a_100000748629_100000685262 [0,1,0,0,0,1|2,0,0]=4 3239 B12R1.21 C=C(C)CSc1cnc(nc1)N 62a_100000748629_100000766020 [0,1,0,0,0,1|2,0,0]=4 3240 B12R1.21 C=C(C)CSc1cnc(nc1)N 62a_100000766020_100000211660 [0,1,0,0,0,1|2,0,0]=4 3241 B12R1.21 C=C(C)CSc1ncc(cn1)Br 62a_100000690281_100000211660 [0,1,0,0,0,1|2,0,0]=4 3242 B12R1.21 C=C(C)CSc1ncc(cn1)Br 62a_100000748629_100000690281 [0,1,0,0,0,1|2,0,0]=4 3243 B12R1.21 C=C(C)CSc1ncc(cn1)C 62a_100000061069_100000211660 [0,1,0,0,0,1|2,0,0]=4 3244 B12R1.21 C=C(C)CSc1ncc(cn1)C 62a_100000748629_100000061069 [0,1,0,0,0,1|2,0,0]=4 3245 B12R1.21 C=C(C)CSc1ncc(cn1)Cl 62a_100000748629_100011356929 [0,1,0,0,0,1|2,0,0]=4 3246 B12R1.21 C=C(C)CSc1ncc(cn1)Cl 62a_100011356929_100000211660 [0,1,0,0,0,1|2,0,0]=4 3247 B12R1.21 C=C(C)CSc1ncc(cn1)F 62a_100000685220_100000211660 [0,1,0,0,0,1|2,0,0]=4 3248 B12R1.21 C=C(C)CSc1ncc(cn1)F 62a_100000748629_100000685220 [0,1,0,0,0,1|2,0,0]=4 3249 B12R1.21 C=C(C)CSc1ncc(cn1)N 62a_100000068403_100000211660 [0,1,0,0,0,1|2,0,0]=4 3250 B12R1.21 C=C(C)CSc1ncc(cn1)N 62a_100000748629_100000068403 [0,1,0,0,0,1|2,0,0]=4 3251 B12R1.21 C=C(C)CSc1ncc(cn1)O 62a_100000730009_100000211660 [0,1,0,0,0,1|2,0,0]=4 3252 B12R1.21 C=C(C)CSc1ncc(cn1)O 62a_100000748629_100000092845 [0,1,0,0,0,1|2,0,0]=4 3253 B12R1.21 C=C(F)CNc1ccc(cc1)Br 2230a_100000210018_100009893438 [0,1,0,0,0,1|1,0,0]=3 3254 B12R1.21 C=C(F)CNc1ccc(cc1)Br 34a_100000210018_100009893438 [0,1,0,0,0,1|1,0,0]=3 3255 B12R1.21 C=C(F)CNc1ccc(cc1)C 34a_100000124888_100009893438 [0,1,0,0,0,1|1,0,0]=3 3256 B12R1.21 C=C(F)CNc1ccc(cc1)Cl 2230a_100000210052_100009893438 [0,1,0,0,0,1|1,0,0]=3 3257 B12R1.21 C=C(F)CNc1ccc(cc1)Cl 34a_100000210052_100009893438 [0,1,0,0,0,1|1,0,0]=3 3258 B12R1.21 C=C(F)CNc1ccc(cc1)F 34a_100000185862_100009893438 [0,1,0,0,0,1|1,0,0]=3 3259 B12R1.21 C=C(F)CNc1ccc(cc1)I 34a_100000185761_100009893438 [0,1,0,0,0,1|1,0,0]=3 3260 B12R1.21 C=C(F)CNc1ccc(cc1)O 34a_100000185829_100009893438 [0,1,0,0,0,1|1,0,0]=3 3261 B12R1.21 C=C(F)COc1ccc(=O)[nH]c1 34a_100000075641_100009893438 [0,1,0,0,0,1|2,0,0]=4 3262 B12R1.21 C=C(F)COc1ccc(cc1)Br 34a_100000185759_100009893438 [0,1,0,0,0,1|1,0,0]=3 3263 B12R1.21 C=C(F)COc1ccc(cc1)Br 7a_100000185759_100000042424 [0,1,0,0,0,1|1,0,0]=3 3264 B12R1.21 C=C(F)COc1ccc(cc1)C 34a_100000210336_100009893438 [0,1,0,0,0,1|1,0,0]=3 3265 B12R1.21 C=C(F)COc1ccc(cc1)C 7a_100000210336_100000042424 [0,1,0,0,0,1|1,0,0]=3 3266 B12R1.21 C=C(F)COc1ccc(cc1)Cl 34a_100000210216_100009893438 [0,1,0,0,0,1|1,0,0]=3 3267 B12R1.21 C=C(F)COc1ccc(cc1)Cl 7a_100000210216_100000042424 [0,1,0,0,0,1|1,0,0]=3 3268 B12R1.21 C=C(F)COc1ccc(cc1)F 34a_100000210339_100009893438 [0,1,0,0,0,1|1,0,0]=3 3269 B12R1.21 C=C(F)COc1ccc(cc1)I 34a_100000212066_100009893438 [0,1,0,0,0,1|1,0,0]=3 3270 B12R1.21 C=C(F)COc1ccc(cc1)I 7a_100000212066_100000042424 [0,1,0,0,0,1|1,0,0]=3 3271 B12R1.21 C=C(F)COc1ccc(cc1)N 34a_100000185829_100009893438 [0,1,0,0,0,1|1,0,0]=3 3272 B12R1.21 C=C(F)COc1ccc(cn1)C 34a_100000759353_100009893438 [0,1,0,0,0,1|2,0,0]=4 3273 B12R1.21 C=C(F)COc1ccc(cn1)Cl 34a_100011215309_100009893438 [0,1,0,0,0,1|2,0,0]=4 3274 B12R1.21 C=C(F)COc1ccc(cn1)F 34a_100000742473_100009893438 [0,1,0,0,0,1|2,0,0]=4 3275 B12R1.21 C=C(F)COc1ccc(cn1)N 34a_100000729260_100009893438 [0,1,0,0,0,1|2,0,0]=4 3276 B12R1.21 C=C(F)COc1ccc(nc1)Br 34a_100000685995_100009893438 [0,1,0,0,0,1|2,0,0]=4 3277 B12R1.21 C=C(F)COc1ccc(nc1)Br 7a_100000685995_100000042424 [0,1,0,0,0,1|2,0,0]=4 3278 B12R1.21 C=C(F)COc1ccc(nc1)C 34a_100000745506_100009893438 [0,1,0,0,0,1|2,0,0]=4 3279 B12R1.21 C=C(F)COc1ccc(nc1)C 7a_100000745506_100000042424 [0,1,0,0,0,1|2,0,0]=4 3280 B12R1.21 C=C(F)COc1ccc(nc1)Cl 34a_100000744096_100009893438 [0,1,0,0,0,1|2,0,0]=4 3281 B12R1.21 C=C(F)COc1ccc(nc1)Cl 7a_100000744096_100000042424 [0,1,0,0,0,1|2,0,0]=4 3282 B12R1.21 C=C(F)COc1ccc(nc1)F 34a_100000688820_100009893438 [0,1,0,0,0,1|2,0,0]=4 3283 B12R1.21 C=C(F)COc1ccc(nc1)F 7a_100000688820_100000042424 [0,1,0,0,0,1|2,0,0]=4 3284 B12R1.21 C=C(F)COc1ccc(nc1)I 34a_100000687607_100009893438 [0,1,0,0,0,1|2,0,0]=4 3285 B12R1.21 C=C(F)COc1ccc(nc1)I 7a_100000687607_100000042424 [0,1,0,0,0,1|2,0,0]=4 3286 B12R1.21 C=C(F)COc1ccc(nc1)N 34a_100015188713_100009893438 [0,1,0,0,0,1|2,0,0]=4 3287 B12R1.21 C=C(F)COc1ccc(nc1)N 7a_100015188713_100000042424 [0,1,0,0,0,1|2,0,0]=4 3288 B12R1.21 C=C(F)CSc1cc[n+](cc1)[O-] 62a_100000042424_100000039755 [0,1,0,0,0,1|2,0,0]=4 3289 B12R1.21 C=C(F)CSc1ccc(=O)[nH]c1 62a_100000042424_100000212171 [0,1,0,0,0,1|2,0,0]=4 3290 B12R1.21 C=C(F)CSc1ccc(=O)[nH]c1 62a_100000212171_100000042424 [0,1,0,0,0,1|2,0,0]=4 3291 B12R1.21 C=C(F)CSc1ccc(cc1)Br 62a_100000042424_100000752885 [0,1,0,0,0,1|1,0,0]=3 3292 B12R1.21 C=C(F)CSc1ccc(cc1)Br 62a_100000752885_100000042424 [0,1,0,0,0,1|1,0,0]=3 3293 B12R1.21 C=C(F)CSc1ccc(cc1)C 62a_100000042424_100000186775 [0,1,0,0,0,1|1,0,0]=3 3294 B12R1.21 C=C(F)CSc1ccc(cc1)C 62a_100000186775_100000042424 [0,1,0,0,0,1|1,0,0]=3 3295 B12R1.21 C=C(F)CSc1ccc(cc1)Cl 62a_100000042424_100000755918 [0,1,0,0,0,1|1,0,0]=3 3296 B12R1.21 C=C(F)CSc1ccc(cc1)Cl 62a_100000755918_100000042424 [0,1,0,0,0,1|1,0,0]=3 3297 B12R1.21 C=C(F)CSc1ccc(cc1)F 62a_100000042424_100000211213 [0,1,0,0,0,1|1,0,0]=3 3298 B12R1.21 C=C(F)CSc1ccc(cc1)F 62a_100000211213_100000042424 [0,1,0,0,0,1|1,0,0]=3 3299 B12R1.21 C=C(F)CSc1ccc(cc1)N 62a_100000042424_100000185761 [0,1,0,0,0,1|1,0,0]=3 3300 B12R1.21 C=C(F)CSc1ccc(cc1)N 62a_100000185761_100000042424 [0,1,0,0,0,1|1,0,0]=3 3301 B12R1.21 C=C(F)CSc1ccc(cc1)O 62a_100000042424_100000185759 [0,1,0,0,0,1|1,0,0]=3 3302 B12R1.21 C=C(F)CSc1ccc(cn1)Br 62a_100000042424_100000686858 [0,1,0,0,0,1|2,0,0]=4 3303 B12R1.21 C=C(F)CSc1ccc(cn1)Br 62a_100000686858_100000042424 [0,1,0,0,0,1|2,0,0]=4 3304 B12R1.21 C=C(F)CSc1ccc(cn1)C 62a_100000042424_100000754016 [0,1,0,0,0,1|2,0,0]=4 3305 B12R1.21 C=C(F)CSc1ccc(cn1)C 62a_100011192072_100000042424 [0,1,0,0,0,1|2,0,0]=4 3306 B12R1.21 C=C(F)CSc1ccc(cn1)Cl 62a_100000042424_100011356976 [0,1,0,0,0,1|2,0,0]=4 3307 B12R1.21 C=C(F)CSc1ccc(cn1)Cl 62a_100011356976_100000042424 [0,1,0,0,0,1|2,0,0]=4 3308 B12R1.21 C=C(F)CSc1ccc(cn1)F 62a_100000042424_100000744514 [0,1,0,0,0,1|2,0,0]=4 3309 B12R1.21 C=C(F)CSc1ccc(cn1)F 62a_100000744514_100000042424 [0,1,0,0,0,1|2,0,0]=4 3310 B12R1.21 C=C(F)CSc1ccc(cn1)N 62a_100000042424_100000737798 [0,1,0,0,0,1|2,0,0]=4 3311 B12R1.21 C=C(F)CSc1ccc(cn1)N 62a_100000737798_100000042424 [0,1,0,0,0,1|2,0,0]=4 3312 B12R1.21 C=C(F)CSc1ccc(cn1)O 62a_100000042424_100000744096 [0,1,0,0,0,1|2,0,0]=4 3313 B12R1.21 C=C(F)CSc1ccc(cn1)O 62a_100000685995_100000042424 [0,1,0,0,0,1|2,0,0]=4 3314 B12R1.21 C=C(F)CSc1ccc(nc1)Br 62a_100000042424_100009814638 [0,1,0,0,0,1|2,0,0]=4 3315 B12R1.21 C=C(F)CSc1ccc(nc1)Br 62a_100009814638_100000042424 [0,1,0,0,0,1|2,0,0]=4 3316 B12R1.21 C=C(F)CSc1ccc(nc1)C 62a_100000042424_100000751577 [0,1,0,0,0,1|2,0,0]=4 3317 B12R1.21 C=C(F)CSc1ccc(nc1)C 62a_100000751577_100000042424 [0,1,0,0,0,1|2,0,0]=4 3318 B12R1.21 C=C(F)CSc1ccc(nc1)Cl 62a_100000034144_100000042424 [0,1,0,0,0,1|2,0,0]=4 3319 B12R1.21 C=C(F)CSc1ccc(nc1)Cl 62a_100000042424_100000034144 [0,1,0,0,0,1|2,0,0]=4 3320 B12R1.21 C=C(F)CSc1ccc(nc1)F 62a_100000042367_100000042424 [0,1,0,0,0,1|2,0,0]=4 3321 B12R1.21 C=C(F)CSc1ccc(nc1)F 62a_100000042424_100000042367 [0,1,0,0,0,1|2,0,0]=4 3322 B12R1.21 C=C(F)CSc1ccc(nc1)N 62a_100000042424_100000187370 [0,1,0,0,0,1|2,0,0]=4 3323 B12R1.21 C=C(F)CSc1ccc(nc1)N 62a_100000187370_100000042424 [0,1,0,0,0,1|2,0,0]=4 3324 B12R1.21 CC(=O)/C=C/c1ccc(cc1)O 271570a_203496583355_200016259395 [0,1,0,0,0,1|1,0,1]=4 3325 B12R1.21 CC(=O)C#Cc1ccc(cc1)Br 1458a_100012100275_200000210301 [0,1,0,0,0,1|1,0,1]=4 3326 B12R1.21 CC(=O)C#Cc1ccc(cc1)Cl 1458a_100011892723_200000210301 [0,1,0,0,0,1|1,0,1]=4 3327 B12R1.21 CC(=O)C#Cc1ccc(cc1)F 1458a_100000238512_200000210301 [0,1,0,0,0,1|1,0,1]=4 3328 B12R1.21 CC(=O)C=Cc1ccc(cc1)Br 1458a_100016267368_200000210301 [0,1,0,0,0,1|1,0,1]=4 3329 B12R1.21 CC(=O)C=Cc1ccc(cc1)C 1458a_100000716854_200000210301 [0,1,0,0,0,1|1,0,1]=4 3330 B12R1.21 CC(=O)C=Cc1ccc(cc1)Cl 1458a_100000184863_200000210301 [0,1,0,0,0,1|1,0,1]=4 3331 B12R1.21 CC(=O)C=Cc1ccc(cc1)F 1458a_100000182136_200000210301 [0,1,0,0,0,1|1,0,1]=4 3332 B12R1.21 CC(=O)C=Cc1ccc(cc1)I 1458a_100102526154_200000210301 [0,1,0,0,0,1|1,0,1]=4 3333 B12R1.21 CC(=O)CCc1ccc(cc1)Br 1458a_100000070787_100011740612 [0,1,0,0,0,1|1,0,0]=3 3334 B12R1.21 CC(=O)CCc1ccc(cc1)Br 1458a_100000217147_200000210301 [0,1,0,0,0,1|1,0,0]=3 3335 B12R1.21 CC(=O)CCc1ccc(cc1)C 1458a_100000070787_100011713686 [0,1,0,0,0,1|1,0,0]=3 3336 B12R1.21 CC(=O)CCc1ccc(cc1)C 1458a_100000234883_200000210301 [0,1,0,0,0,1|1,0,0]=3 3337 B12R1.21 CC(=O)CCc1ccc(cc1)Cl 1458a_100000070787_100011713675 [0,1,0,0,0,1|1,0,0]=3 3338 B12R1.21 CC(=O)CCc1ccc(cc1)Cl 1458a_100000235379_200000210301 [0,1,0,0,0,1|1,0,0]=3 3339 B12R1.21 CC(=O)CCc1ccc(cc1)F 1458a_100000070787_100011217392 [0,1,0,0,0,1|1,0,0]=3 3340 B12R1.21 CC(=O)CCc1ccc(cc1)F 1458a_100000198493_200000210301 [0,1,0,0,0,1|1,0,0]=3 3341 B12R1.21 CC(=O)CCc1ccc(cc1)I 1458a_100011217499_200000210301 [0,1,0,0,0,1|1,0,0]=3 3342 B12R1.21 CC(=O)CCc1ccc(cc1)O 1458a_100000070787_100009816426 [0,1,0,0,0,1|1,0,0]=3 3343 B12R1.21 CC(=O)CCc1ccc(cc1)O 1458a_100000742835_200000210301 [0,1,0,0,0,1|1,0,0]=3 3344 B12R1.21 CC(=O)CCc1ccc(cc1)O 271570a_203496583355_100000723691 [0,1,0,0,0,1|1,0,0]=3 3345 B12R1.21 CC(=O)COc1ccc(cc1)Br 1458a_100000182358_200000210301 [0,1,0,0,0,1|1,0,0]=3 3346 B12R1.21 CC(=O)COc1ccc(cc1)C 1458a_100000182360_200000210301 [0,1,0,0,0,1|1,0,0]=3 3347 B12R1.21 CC(=O)COc1ccc(cc1)Cl 1458a_100016990877_200000210301 [0,1,0,0,0,1|1,0,0]=3 3348 B12R1.21 CC(=O)COc1ccc(cc1)F 1458a_100000184765_200000210301 [0,1,0,0,0,1|1,0,0]=3 3349 B12R1.21 CC(=O)COc1ccc(cc1)I 1458a_100000184369_200000210301 [0,1,0,0,0,1|1,0,0]=3 3350 B12R1.21 CC(=O)COc1ccc(cc1)O 1458a_100000031633_200000210301 [0,1,0,0,0,1|1,0,0]=3 3351 B12R1.21 CC(=O)CSc1ccc(cc1)Br 1458a_100000179496_200000210301 [0,1,0,0,0,1|1,0,0]=3 3352 B12R1.21 CC(=O)CSc1ccc(cc1)C 1458a_100000179497_200000210301 [0,1,0,0,0,1|1,0,0]=3 3353 B12R1.21 CC(=O)CSc1ccc(cc1)Cl 1458a_100000178402_200000210301 [0,1,0,0,0,1|1,0,0]=3 3354 B12R1.21 CC(=O)CSc1ccc(cc1)F 1458a_100000691584_200000210301 [0,1,0,0,0,1|1,0,0]=3 3355 B12R1.21 CC(=O)NCc1ccc(cc1)Br 11a_100000174875_100015343762 [0,1,0,0,0,1|1,0,0]=3 3356 B12R1.21 CC(=O)NCc1ccc(cc1)Br 1626a_100000174875_100015343762 [0,1,0,0,0,1|1,0,0]=3 3357 B12R1.21 CC(=O)NCc1ccc(cc1)Br 240690a_100000174875_100015343762 [0,1,0,0,0,1|1,0,0]=3 3358 B12R1.21 CC(=O)NCc1ccc(cc1)Br 527a_100000174875_100103153847 [0,1,0,0,0,1|1,0,0]=3 3359 B12R1.21 CC(=O)NCc1ccc(cc1)C 11a_100000174908_100015343762 [0,1,0,0,0,1|1,0,0]=3 3360 B12R1.21 CC(=O)NCc1ccc(cc1)C 1626a_100000174908_100015343762 [0,1,0,0,0,1|1,0,0]=3 3361 B12R1.21 CC(=O)NCc1ccc(cc1)C 240690a_100000174908_100015343762 [0,1,0,0,0,1|1,0,0]=3 3362 B12R1.21 CC(=O)NCc1ccc(cc1)C 527a_100000174908_100103153847 [0,1,0,0,0,1|1,0,0]=3 3363 B12R1.21 CC(=O)NCc1ccc(cc1)Cl 11a_100000174871_100015343762 [0,1,0,0,0,1|1,0,0]=3 3364 B12R1.21 CC(=O)NCc1ccc(cc1)Cl 1626a_100000174871_100015343762 [0,1,0,0,0,1|1,0,0]=3 3365 B12R1.21 CC(=O)NCc1ccc(cc1)Cl 240690a_100000174871_100015343762 [0,1,0,0,0,1|1,0,0]=3 3366 B12R1.21 CC(=O)NCc1ccc(cc1)Cl 527a_100000174871_100103153847 [0,1,0,0,0,1|1,0,0]=3 3367 B12R1.21 CC(=O)NCc1ccc(cc1)F 11a_100000174882_100015343762 [0,1,0,0,0,1|1,0,0]=3 3368 B12R1.21 CC(=O)NCc1ccc(cc1)F 1626a_100000174882_100015343762 [0,1,0,0,0,1|1,0,0]=3 3369 B12R1.21 CC(=O)NCc1ccc(cc1)F 240690a_100000174882_100015343762 [0,1,0,0,0,1|1,0,0]=3 3370 B12R1.21 CC(=O)NCc1ccc(cc1)F 527a_100000174882_100103153847 [0,1,0,0,0,1|1,0,0]=3 3371 B12R1.21 CC(=O)NCc1ccc(cc1)I 11a_100016989417_100015343762 [0,1,0,0,0,1|1,0,0]=3 3372 B12R1.21 CC(=O)NCc1ccc(cc1)I 1626a_100016989417_100015343762 [0,1,0,0,0,1|1,0,0]=3 3373 B12R1.21 CC(=O)NCc1ccc(cc1)I 240690a_100016989417_100015343762 [0,1,0,0,0,1|1,0,0]=3 3374 B12R1.21 CC(=O)NCc1ccc(cc1)I 527a_100016989417_100103153847 [0,1,0,0,0,1|1,0,0]=3 3375 B12R1.21 CC(=O)NCc1ccc(cc1)O 240690a_100000185549_100015343762 [0,1,0,0,0,1|1,0,0]=3 3376 B12R1.21 CC(=O)NCc1ccc(cc1)O 271570a_203496583355_200000685173 [0,1,0,0,0,1|1,0,0]=3 3377 B12R1.21 CC(=O)NCc1ccc(cc1)O 527a_100000185549_100103153847 [0,1,0,0,0,1|1,0,0]=3 3378 B12R1.21 CC(=O)NCc1ccc(cn1)Br 11a_100015188789_100015343762 [0,1,0,0,0,1|2,0,0]=4 3379 B12R1.21 CC(=O)NCc1ccc(cn1)Br 1626a_100015188789_100015343762 [0,1,0,0,0,1|2,0,0]=4 3380 B12R1.21 CC(=O)NCc1ccc(cn1)Br 240690a_100015188789_100015343762 [0,1,0,0,0,1|2,0,0]=4 3381 B12R1.21 CC(=O)NCc1ccc(cn1)Br 527a_100015188789_100103153847 [0,1,0,0,0,1|2,0,0]=4 3382 B12R1.21 CC(=O)NCc1ccc(cn1)C 11a_100015187455_100015343762 [0,1,0,0,0,1|2,0,0]=4 3383 B12R1.21 CC(=O)NCc1ccc(cn1)C 1626a_100015187455_100015343762 [0,1,0,0,0,1|2,0,0]=4 3384 B12R1.21 CC(=O)NCc1ccc(cn1)C 240690a_100015187455_100015343762 [0,1,0,0,0,1|2,0,0]=4 3385 B12R1.21 CC(=O)NCc1ccc(cn1)C 527a_100015187455_100103153847 [0,1,0,0,0,1|2,0,0]=4 3386 B12R1.21 CC(=O)NCc1ccc(cn1)Cl 11a_100000697193_100015343762 [0,1,0,0,0,1|2,0,0]=4 3387 B12R1.21 CC(=O)NCc1ccc(cn1)Cl 1626a_100000697193_100015343762 [0,1,0,0,0,1|2,0,0]=4 3388 B12R1.21 CC(=O)NCc1ccc(cn1)Cl 240690a_100000697193_100015343762 [0,1,0,0,0,1|2,0,0]=4 3389 B12R1.21 CC(=O)NCc1ccc(cn1)Cl 527a_100000697193_100103153847 [0,1,0,0,0,1|2,0,0]=4 3390 B12R1.21 CC(=O)NCc1ccc(cn1)F 11a_100020620131_100015343762 [0,1,0,0,0,1|2,0,0]=4 3391 B12R1.21 CC(=O)NCc1ccc(cn1)F 1626a_100020620131_100015343762 [0,1,0,0,0,1|2,0,0]=4 3392 B12R1.21 CC(=O)NCc1ccc(cn1)F 240690a_100020620131_100015343762 [0,1,0,0,0,1|2,0,0]=4 3393 B12R1.21 CC(=O)NCc1ccc(cn1)F 527a_100020620131_100103153847 [0,1,0,0,0,1|2,0,0]=4 3394 B12R1.21 CC(=O)NCc1ccc(cn1)O 240690a_100020605196_100015343762 [0,1,0,0,0,1|2,0,0]=4 3395 B12R1.21 CC(=O)NCc1ccc(nc1)Br 11a_100009817727_100015343762 [0,1,0,0,0,1|2,0,0]=4 3396 B12R1.21 CC(=O)NCc1ccc(nc1)Br 240690a_100009817727_100015343762 [0,1,0,0,0,1|2,0,0]=4 3397 B12R1.21 CC(=O)NCc1ccc(nc1)Br 527a_100009817727_100103153847 [0,1,0,0,0,1|2,0,0]=4 3398 B12R1.21 CC(=O)NCc1ccc(nc1)C 11a_100000740942_100015343762 [0,1,0,0,0,1|2,0,0]=4 3399 B12R1.21 CC(=O)NCc1ccc(nc1)C 1626a_100000740942_100015343762 [0,1,0,0,0,1|2,0,0]=4 3400 B12R1.21 CC(=O)NCc1ccc(nc1)C 240690a_100000740942_100015343762 [0,1,0,0,0,1|2,0,0]=4 3401 B12R1.21 CC(=O)NCc1ccc(nc1)C 527a_100000740942_100103153847 [0,1,0,0,0,1|2,0,0]=4 3402 B12R1.21 CC(=O)NCc1ccc(nc1)Cl 11a_100000735879_100015343762 [0,1,0,0,0,1|2,0,0]=4 3403 B12R1.21 CC(=O)NCc1ccc(nc1)Cl 1626a_100000735879_100015343762 [0,1,0,0,0,1|2,0,0]=4 3404 B12R1.21 CC(=O)NCc1ccc(nc1)Cl 240690a_100000735879_100015343762 [0,1,0,0,0,1|2,0,0]=4 3405 B12R1.21 CC(=O)NCc1ccc(nc1)Cl 527a_100000735879_100103153847 [0,1,0,0,0,1|2,0,0]=4 3406 B12R1.21 CC(=O)NCc1ccc(nc1)F 11a_100000101913_100015343762 [0,1,0,0,0,1|2,0,0]=4 3407 B12R1.21 CC(=O)NCc1ccc(nc1)F 1626a_100000101913_100015343762 [0,1,0,0,0,1|2,0,0]=4 3408 B12R1.21 CC(=O)NCc1ccc(nc1)F 240690a_100000101913_100015343762 [0,1,0,0,0,1|2,0,0]=4 3409 B12R1.21 CC(=O)NCc1ccc(nc1)F 527a_100000101913_100103153847 [0,1,0,0,0,1|2,0,0]=4 3410 B12R1.21 CC(=O)NCc1ccc(nc1)O 11a_100000757128_100015343762 [0,1,0,0,0,1|2,0,0]=4 3411 B12R1.21 CC(=O)NCc1ccc(nc1)O 240690a_100000757128_100015343762 [0,1,0,0,0,1|2,0,0]=4 3412 B12R1.21 CC(=O)NNc1ccc(cc1)Br 22a_100000735608_100000070787 [0,1,0,0,0,1|2,0,0]=4 3413 B12R1.21 CC(=O)NNc1ccc(cc1)C 22a_100000683527_100000070787 [0,1,0,0,0,1|2,0,0]=4 3414 B12R1.21 CC(=O)NNc1ccc(cc1)Cl 22a_100000683521_100000070787 [0,1,0,0,0,1|2,0,0]=4 3415 B12R1.21 CC(=O)NNc1ccc(cc1)F 22a_100000728448_100000070787 [0,1,0,0,0,1|2,0,0]=4 3416 B12R1.21 CC(=O)NNc1ccc(cc1)I 22a_100016988836_100000070787 [0,1,0,0,0,1|2,0,0]=4 3417 B12R1.21 CC(=O)NNc1ccc(cc1)O 271570a_203496583355_200009815283 [0,1,0,0,0,1|2,0,0]=4 3418 B12R1.21 CC(C)CNc1ccc(cc1)Br 2230a_100000210018_100000210760 [0,1,0,0,0,1|0,0,2]=4 3419 B12R1.21 CC(C)CNc1ccc(cc1)Br 34a_100000210018_100000210624 [0,1,0,0,0,1|0,0,2]=4 3420 B12R1.21 CC(C)CNc1ccc(cc1)Cl 2230a_100000210052_100000210760 [0,1,0,0,0,1|0,0,2]=4 3421 B12R1.21 CC(C)CNc1ccc(cc1)Cl 34a_100000210052_100000210624 [0,1,0,0,0,1|0,0,2]=4 3422 B12R1.21 CC(C)CNc1ccc(cc1)F 34a_100000185862_100000210624 [0,1,0,0,0,1|0,0,2]=4 3423 B12R1.21 CC(C)CNc1ccc(cc1)I 34a_100000185761_100000210624 [0,1,0,0,0,1|0,0,2]=4 3424 B12R1.21 CC(C)CNc1ccc(cc1)O 271570a_203496583355_200011231703 [0,1,0,0,0,1|0,0,2]=4 3425 B12R1.21 CC(C)CNc1ccc(cc1)O 34a_100000185829_100000210624 [0,1,0,0,0,1|0,0,2]=4 3426 B12R1.21 CC(C)COc1ccc(cc1)Br 34a_100000185759_100000210624 [0,1,0,0,0,1|0,0,2]=4 3427 B12R1.21 CC(C)COc1ccc(cc1)Br 7a_100000185759_100000210760 [0,1,0,0,0,1|0,0,2]=4 3428 B12R1.21 CC(C)COc1ccc(cc1)Cl 34a_100000210216_100000210624 [0,1,0,0,0,1|0,0,2]=4 3429 B12R1.21 CC(C)COc1ccc(cc1)Cl 7a_100000210216_100000210760 [0,1,0,0,0,1|0,0,2]=4 3430 B12R1.21 CC(C)COc1ccc(cc1)F 34a_100000210339_100000210624 [0,1,0,0,0,1|0,0,2]=4 3431 B12R1.21 CC(C)COc1ccc(cc1)I 34a_100000212066_100000210624 [0,1,0,0,0,1|0,0,2]=4 3432 B12R1.21 CC(C)COc1ccc(cc1)I 7a_100000212066_100000210760 [0,1,0,0,0,1|0,0,2]=4 3433 B12R1.21 CC(C)COc1ccc(cc1)N 34a_100000185829_100000210624 [0,1,0,0,0,1|0,0,2]=4 3434 B12R1.21 CC(C)COc1ccc(cc1)O 271570a_203496583355_200000169949 [0,1,0,0,0,1|0,0,2]=4 3435 B12R1.21 CC(C)CSc1ccc(cc1)Br 62a_100000210624_100000752885 [0,1,0,0,0,1|0,0,2]=4 3436 B12R1.21 CC(C)CSc1ccc(cc1)Br 62a_100000752885_100000210760 [0,1,0,0,0,1|0,0,2]=4 3437 B12R1.21 CC(C)CSc1ccc(cc1)Cl 62a_100000210624_100000755918 [0,1,0,0,0,1|0,0,2]=4 3438 B12R1.21 CC(C)CSc1ccc(cc1)Cl 62a_100000755918_100000210760 [0,1,0,0,0,1|0,0,2]=4 3439 B12R1.21 CC(C)CSc1ccc(cc1)F 62a_100000210624_100000211213 [0,1,0,0,0,1|0,0,2]=4 3440 B12R1.21 CC(C)CSc1ccc(cc1)F 62a_100000211213_100000210760 [0,1,0,0,0,1|0,0,2]=4 3441 B12R1.21 CC(C)CSc1ccc(cc1)N 62a_100000185761_100000210760 [0,1,0,0,0,1|0,0,2]=4 3442 B12R1.21 CC(C)CSc1ccc(cc1)N 62a_100000210624_100000185761 [0,1,0,0,0,1|0,0,2]=4 3443 B12R1.21 CC(C)CSc1ccc(cc1)O 62a_100000210624_100000185759 [0,1,0,0,0,1|0,0,2]=4 3444 B12R1.21 CC(C)NCc1ccc(cc1)Br 207a_100138425928_100000186029 [0,1,0,0,0,1|0,0,2]=4 3445 B12R1.21 CC(C)NCc1ccc(cc1)Br 2230a_100000174875_100000210206 [0,1,0,0,0,1|0,0,2]=4 3446 B12R1.21 CC(C)NCc1ccc(cc1)Br 2230a_100138425928_100011217064 [0,1,0,0,0,1|0,0,2]=4 3447 B12R1.21 CC(C)NCc1ccc(cc1)Br 34a_100000174875_100000210206 [0,1,0,0,0,1|0,0,2]=4 3448 B12R1.21 CC(C)NCc1ccc(cc1)Br 34a_100138425928_100000189115 [0,1,0,0,0,1|0,0,2]=4 3449 B12R1.21 CC(C)NCc1ccc(cc1)Cl 207a_100138425928_100000189385 [0,1,0,0,0,1|0,0,2]=4 3450 B12R1.21 CC(C)NCc1ccc(cc1)Cl 2230a_100000174871_100000210206 [0,1,0,0,0,1|0,0,2]=4 3451 B12R1.21 CC(C)NCc1ccc(cc1)Cl 2230a_100138425928_100000694040 [0,1,0,0,0,1|0,0,2]=4 3452 B12R1.21 CC(C)NCc1ccc(cc1)Cl 34a_100000174871_100000210206 [0,1,0,0,0,1|0,0,2]=4 3453 B12R1.21 CC(C)NCc1ccc(cc1)Cl 34a_100138425928_100000694040 [0,1,0,0,0,1|0,0,2]=4 3454 B12R1.21 CC(C)NCc1ccc(cc1)F 207a_100138425928_100000210084 [0,1,0,0,0,1|0,0,2]=4 3455 B12R1.21 CC(C)NCc1ccc(cc1)F 2230a_100000174882_100000210206 [0,1,0,0,0,1|0,0,2]=4 3456 B12R1.21 CC(C)NCc1ccc(cc1)F 2230a_100138425928_100000198546 [0,1,0,0,0,1|0,0,2]=4 3457 B12R1.21 CC(C)NCc1ccc(cc1)F 34a_100000174882_100000210206 [0,1,0,0,0,1|0,0,2]=4 3458 B12R1.21 CC(C)NCc1ccc(cc1)F 34a_100138425928_100000198546 [0,1,0,0,0,1|0,0,2]=4 3459 B12R1.21 CC(C)NCc1ccc(cc1)I 207a_100138425928_100000188517 [0,1,0,0,0,1|0,0,2]=4 3460 B12R1.21 CC(C)NCc1ccc(cc1)I 2230a_100016989417_100000210206 [0,1,0,0,0,1|0,0,2]=4 3461 B12R1.21 CC(C)NCc1ccc(cc1)I 2230a_100138425928_100000189116 [0,1,0,0,0,1|0,0,2]=4 3462 B12R1.21 CC(C)NCc1ccc(cc1)I 34a_100016989417_100000210206 [0,1,0,0,0,1|0,0,2]=4 3463 B12R1.21 CC(C)NCc1ccc(cc1)I 34a_100138425928_100000189116 [0,1,0,0,0,1|0,0,2]=4 3464 B12R1.21 CC(C)NCc1ccc(cc1)O 271570a_203496583355_100000195760 [0,1,0,0,0,1|0,0,2]=4 3465 B12R1.21 CC(C)NCc1ccc(cc1)O 34a_100000185549_100000210206 [0,1,0,0,0,1|0,0,2]=4 3466 B12R1.21 CC(C)OCc1ccc(cc1)Br 34a_100000212225_100000189115 [0,1,0,0,0,1|0,0,2]=4 3467 B12R1.21 CC(C)OCc1ccc(cc1)Br 34a_100000695286_100000210206 [0,1,0,0,0,1|0,0,2]=4 3468 B12R1.21 CC(C)OCc1ccc(cc1)Cl 34a_100000211118_100000210206 [0,1,0,0,0,1|0,0,2]=4 3469 B12R1.21 CC(C)OCc1ccc(cc1)Cl 34a_100000212225_100000694040 [0,1,0,0,0,1|0,0,2]=4 3470 B12R1.21 CC(C)OCc1ccc(cc1)Cl 7a_100000211118_100000210206 [0,1,0,0,0,1|0,0,2]=4 3471 B12R1.21 CC(C)OCc1ccc(cc1)F 34a_100000210977_100000210206 [0,1,0,0,0,1|0,0,2]=4 3472 B12R1.21 CC(C)OCc1ccc(cc1)F 34a_100000212225_100000198546 [0,1,0,0,0,1|0,0,2]=4 3473 B12R1.21 CC(C)OCc1ccc(cc1)F 7a_100000210977_100000210206 [0,1,0,0,0,1|0,0,2]=4 3474 B12R1.21 CC(C)OCc1ccc(cc1)I 34a_100000212225_100000189116 [0,1,0,0,0,1|0,0,2]=4 3475 B12R1.21 CC(C)OCc1ccc(cc1)I 34a_100000690907_100000210206 [0,1,0,0,0,1|0,0,2]=4 3476 B12R1.21 CC(C)OCc1ccc(cc1)I 7a_100000690907_100000210206 [0,1,0,0,0,1|0,0,2]=4 3477 B12R1.21 CC(C)OCc1ccc(cc1)N 34a_100011215238_100000210206 [0,1,0,0,0,1|0,0,2]=4 3478 B12R1.21 CC(C)OCc1ccc(cc1)O 271570a_203496583355_100000758563 [0,1,0,0,0,1|0,0,2]=4 3479 B12R1.21 CC(C)SCc1ccc(cc1)Br 62a_100000189115_100000210206 [0,1,0,0,0,1|0,0,2]=4 3480 B12R1.21 CC(C)SCc1ccc(cc1)Br 62a_100000210206_100000189115 [0,1,0,0,0,1|0,0,2]=4 3481 B12R1.21 CC(C)SCc1ccc(cc1)Cl 62a_100000187161_100000210206 [0,1,0,0,0,1|0,0,2]=4 3482 B12R1.21 CC(C)SCc1ccc(cc1)Cl 62a_100000210206_100000187161 [0,1,0,0,0,1|0,0,2]=4 3483 B12R1.21 CC(C)SCc1ccc(cc1)F 62a_100000198546_100000210206 [0,1,0,0,0,1|0,0,2]=4 3484 B12R1.21 CC(C)SCc1ccc(cc1)F 62a_100000210206_100000187164 [0,1,0,0,0,1|0,0,2]=4 3485 B12R1.21 CC(C)SCc1ccc(cc1)I 62a_100000189116_100000210206 [0,1,0,0,0,1|0,0,2]=4 3486 B12R1.21 CC(C)SCc1ccc(cc1)I 62a_100000210206_100000189116 [0,1,0,0,0,1|0,0,2]=4 3487 B12R1.21 CC(C)SCc1ccc(cc1)O 271570a_203496583355_100000173087 [0,1,0,0,0,1|0,0,2]=4 3488 B12R1.21 CC(O)CNc1ccc(cc1)Br 2230a_100000210018_100011218427 [0,1,0,0,0,1|1,0,1]=4 3489 B12R1.21 CC(O)CNc1ccc(cc1)Br 34a_100000210018_100011218427 [0,1,0,0,0,1|1,0,1]=4 3490 B12R1.21 CC(O)CNc1ccc(cc1)Cl 2230a_100000210052_100011218427 [0,1,0,0,0,1|1,0,1]=4 3491 B12R1.21 CC(O)CNc1ccc(cc1)Cl 34a_100000210052_100011218427 [0,1,0,0,0,1|1,0,1]=4 3492 B12R1.21 CC(O)CNc1ccc(cc1)F 34a_100000185862_100011218427 [0,1,0,0,0,1|1,0,1]=4 3493 B12R1.21 CC(O)CNc1ccc(cc1)I 34a_100000185761_100011218427 [0,1,0,0,0,1|1,0,1]=4 3494 B12R1.21 CC(O)CNc1ccc(cc1)O 34a_100000185829_100011218427 [0,1,0,0,0,1|1,0,1]=4 3495 B12R1.21 CC(O)COc1ccc(cc1)Br 34a_100000185759_100011218427 [0,1,0,0,0,1|1,0,1]=4 3496 B12R1.21 CC(O)COc1ccc(cc1)Br 7a_100000185759_100011218427 [0,1,0,0,0,1|1,0,1]=4 3497 B12R1.21 CC(O)COc1ccc(cc1)Cl 34a_100000210216_100011218427 [0,1,0,0,0,1|1,0,1]=4 3498 B12R1.21 CC(O)COc1ccc(cc1)Cl 7a_100000210216_100011218427 [0,1,0,0,0,1|1,0,1]=4 3499 B12R1.21 CC(O)COc1ccc(cc1)F 34a_100000210339_100011218427 [0,1,0,0,0,1|1,0,1]=4 3500 B12R1.21 CC(O)COc1ccc(cc1)I 34a_100000212066_100011218427 [0,1,0,0,0,1|1,0,1]=4 3501 B12R1.21 CC(O)COc1ccc(cc1)I 7a_100000212066_100011218427 [0,1,0,0,0,1|1,0,1]=4 3502 B12R1.21 CC(O)COc1ccc(cc1)N 34a_100000185829_100011218427 [0,1,0,0,0,1|1,0,1]=4 3503 B12R1.21 CC(O)CSc1ccc(cc1)Br 62a_100000752885_100011218427 [0,1,0,0,0,1|1,0,1]=4 3504 B12R1.21 CC(O)CSc1ccc(cc1)Br 62a_100011218427_100000752885 [0,1,0,0,0,1|1,0,1]=4 3505 B12R1.21 CC(O)CSc1ccc(cc1)Cl 62a_100000755918_100011218427 [0,1,0,0,0,1|1,0,1]=4 3506 B12R1.21 CC(O)CSc1ccc(cc1)Cl 62a_100011218427_100000755918 [0,1,0,0,0,1|1,0,1]=4 3507 B12R1.21 CC(O)CSc1ccc(cc1)F 62a_100000211213_100011218427 [0,1,0,0,0,1|1,0,1]=4 3508 B12R1.21 CC(O)CSc1ccc(cc1)F 62a_100011218427_100000211213 [0,1,0,0,0,1|1,0,1]=4 3509 B12R1.21 CC(O)CSc1ccc(cc1)N 62a_100000185761_100011218427 [0,1,0,0,0,1|1,0,1]=4 3510 B12R1.21 CC(O)CSc1ccc(cc1)N 62a_100011218427_100000185761 [0,1,0,0,0,1|1,0,1]=4 3511 B12R1.21 CC(O)CSc1ccc(cc1)O 62a_100011218427_100000185759 [0,1,0,0,0,1|1,0,1]=4 3512 B12R1.21 CN(C)CCc1ccc(cc1)Br 2230a_100000752880_200000210301 [0,1,0,0,0,1|1,0,1]=4 3513 B12R1.21 CN(C)CCc1ccc(cc1)Br 2230a_100102631434_100011740612 [0,1,0,0,0,1|1,0,1]=4 3514 B12R1.21 CN(C)CCc1ccc(cc1)Br 269982a_100000752880_200000210301 [0,1,0,0,0,1|1,0,1]=4 3515 B12R1.21 CN(C)CCc1ccc(cc1)Br 269982a_100102631434_100011740612 [0,1,0,0,0,1|1,0,1]=4 3516 B12R1.21 CN(C)CCc1ccc(cc1)Br 34a_100000752880_200000210301 [0,1,0,0,0,1|1,0,1]=4 3517 B12R1.21 CN(C)CCc1ccc(cc1)Cl 2230a_100000698262_200000210301 [0,1,0,0,0,1|1,0,1]=4 3518 B12R1.21 CN(C)CCc1ccc(cc1)Cl 2230a_100102631434_100011713675 [0,1,0,0,0,1|1,0,1]=4 3519 B12R1.21 CN(C)CCc1ccc(cc1)Cl 269982a_100000698262_200000210301 [0,1,0,0,0,1|1,0,1]=4 3520 B12R1.21 CN(C)CCc1ccc(cc1)Cl 269982a_100102631434_100011713675 [0,1,0,0,0,1|1,0,1]=4 3521 B12R1.21 CN(C)CCc1ccc(cc1)Cl 34a_100000698262_200000210301 [0,1,0,0,0,1|1,0,1]=4 3522 B12R1.21 CN(C)CCc1ccc(cc1)F 2230a_100102631434_100011217392 [0,1,0,0,0,1|1,0,1]=4 3523 B12R1.21 CN(C)CCc1ccc(cc1)F 2230a_100102946585_200000210301 [0,1,0,0,0,1|1,0,1]=4 3524 B12R1.21 CN(C)CCc1ccc(cc1)F 269982a_100102631434_100011217392 [0,1,0,0,0,1|1,0,1]=4 3525 B12R1.21 CN(C)CCc1ccc(cc1)F 269982a_100102946585_200000210301 [0,1,0,0,0,1|1,0,1]=4 3526 B12R1.21 CN(C)CCc1ccc(cc1)F 34a_100102946585_200000210301 [0,1,0,0,0,1|1,0,1]=4 3527 B12R1.21 CN(C)CCc1ccc(cc1)O 2230a_100016989440_200000210301 [0,1,0,0,0,1|1,0,1]=4 3528 B12R1.21 CN(C)CCc1ccc(cc1)O 2230a_100102631434_100009816426 [0,1,0,0,0,1|1,0,1]=4 3529 B12R1.21 CN(C)CCc1ccc(cc1)O 269982a_100016989440_200000210301 [0,1,0,0,0,1|1,0,1]=4 3530 B12R1.21 CN(C)CCc1ccc(cc1)O 269982a_100102631434_100009816426 [0,1,0,0,0,1|1,0,1]=4 3531 B12R1.21 CN(C)CCc1ccc(cc1)O 34a_100016989440_200000210301 [0,1,0,0,0,1|1,0,1]=4 3532 B12R1.21 CN([13CH3])CCc1ccc(cc1)Br 2230a_100000752880_200025704644 [0,1,0,0,0,1|1,0,1]=4 3533 B12R1.21 CN([13CH3])CCc1ccc(cc1)Br 269982a_100000752880_200025704644 [0,1,0,0,0,1|1,0,1]=4 3534 B12R1.21 CN([13CH3])CCc1ccc(cc1)Br 34a_100000752880_200025704644 [0,1,0,0,0,1|1,0,1]=4 3535 B12R1.21 CN([13CH3])CCc1ccc(cc1)Cl 2230a_100000698262_200025704644 [0,1,0,0,0,1|1,0,1]=4 3536 B12R1.21 CN([13CH3])CCc1ccc(cc1)Cl 269982a_100000698262_200025704644 [0,1,0,0,0,1|1,0,1]=4 3537 B12R1.21 CN([13CH3])CCc1ccc(cc1)Cl 34a_100000698262_200025704644 [0,1,0,0,0,1|1,0,1]=4 3538 B12R1.21 CN([13CH3])CCc1ccc(cc1)F 2230a_100102946585_200025704644 [0,1,0,0,0,1|1,0,1]=4 3539 B12R1.21 CN([13CH3])CCc1ccc(cc1)F 269982a_100102946585_200025704644 [0,1,0,0,0,1|1,0,1]=4 3540 B12R1.21 CN([13CH3])CCc1ccc(cc1)F 34a_100102946585_200025704644 [0,1,0,0,0,1|1,0,1]=4 3541 B12R1.21 CN([13CH3])CCc1ccc(cc1)O 2230a_100016989440_200025704644 [0,1,0,0,0,1|1,0,1]=4 3542 B12R1.21 CN([13CH3])CCc1ccc(cc1)O 269982a_100016989440_200025704644 [0,1,0,0,0,1|1,0,1]=4 3543 B12R1.21 CN([13CH3])CCc1ccc(cc1)O 34a_100016989440_200025704644 [0,1,0,0,0,1|1,0,1]=4 3544 B12R1.21 C[C@@H](O)CNc1ccc(cc1)Br 2230a_100000210018_100009817552 [0,1,0,0,0,1|1,0,1]=4 3545 B12R1.21 C[C@@H](O)CNc1ccc(cc1)Br 34a_100000210018_100009817552 [0,1,0,0,0,1|1,0,1]=4 3546 B12R1.21 C[C@@H](O)CNc1ccc(cc1)Cl 2230a_100000210052_100009817552 [0,1,0,0,0,1|1,0,1]=4 3547 B12R1.21 C[C@@H](O)CNc1ccc(cc1)Cl 34a_100000210052_100009817552 [0,1,0,0,0,1|1,0,1]=4 3548 B12R1.21 C[C@@H](O)CNc1ccc(cc1)F 34a_100000185862_100009817552 [0,1,0,0,0,1|1,0,1]=4 3549 B12R1.21 C[C@@H](O)CNc1ccc(cc1)I 34a_100000185761_100009817552 [0,1,0,0,0,1|1,0,1]=4 3550 B12R1.21 C[C@@H](O)CNc1ccc(cc1)O 34a_100000185829_100009817552 [0,1,0,0,0,1|1,0,1]=4 3551 B12R1.21 C[C@@H](O)COc1ccc(cc1)Br 34a_100000185759_100009817552 [0,1,0,0,0,1|1,0,1]=4 3552 B12R1.21 C[C@@H](O)COc1ccc(cc1)Br 7a_100000185759_100009817552 [0,1,0,0,0,1|1,0,1]=4 3553 B12R1.21 C[C@@H](O)COc1ccc(cc1)Cl 34a_100000210216_100009817552 [0,1,0,0,0,1|1,0,1]=4 3554 B12R1.21 C[C@@H](O)COc1ccc(cc1)Cl 7a_100000210216_100009817552 [0,1,0,0,0,1|1,0,1]=4 3555 B12R1.21 C[C@@H](O)COc1ccc(cc1)F 34a_100000210339_100009817552 [0,1,0,0,0,1|1,0,1]=4 3556 B12R1.21 C[C@@H](O)COc1ccc(cc1)I 34a_100000212066_100009817552 [0,1,0,0,0,1|1,0,1]=4 3557 B12R1.21 C[C@@H](O)COc1ccc(cc1)I 7a_100000212066_100009817552 [0,1,0,0,0,1|1,0,1]=4 3558 B12R1.21 C[C@@H](O)COc1ccc(cc1)N 34a_100000185829_100009817552 [0,1,0,0,0,1|1,0,1]=4 3559 B12R1.21 C[C@@H](O)CSc1ccc(cc1)Br 62a_100000752885_100009817552 [0,1,0,0,0,1|1,0,1]=4 3560 B12R1.21 C[C@@H](O)CSc1ccc(cc1)Br 62a_100009817552_100000752885 [0,1,0,0,0,1|1,0,1]=4 3561 B12R1.21 C[C@@H](O)CSc1ccc(cc1)Cl 62a_100000755918_100009817552 [0,1,0,0,0,1|1,0,1]=4 3562 B12R1.21 C[C@@H](O)CSc1ccc(cc1)Cl 62a_100009817552_100000755918 [0,1,0,0,0,1|1,0,1]=4 3563 B12R1.21 C[C@@H](O)CSc1ccc(cc1)F 62a_100000211213_100009817552 [0,1,0,0,0,1|1,0,1]=4 3564 B12R1.21 C[C@@H](O)CSc1ccc(cc1)F 62a_100009817552_100000211213 [0,1,0,0,0,1|1,0,1]=4 3565 B12R1.21 C[C@@H](O)CSc1ccc(cc1)N 62a_100000185761_100009817552 [0,1,0,0,0,1|1,0,1]=4 3566 B12R1.21 C[C@@H](O)CSc1ccc(cc1)N 62a_100009817552_100000185761 [0,1,0,0,0,1|1,0,1]=4 3567 B12R1.21 C[C@@H](O)CSc1ccc(cc1)O 62a_100009817552_100000185759 [0,1,0,0,0,1|1,0,1]=4 3568 B12R1.21 Cc1ccc(cc1)C=CC(=O)[13CH3] 1458a_100000716854_200025704644 [0,1,0,0,0,1|1,0,1]=4 3569 B12R1.21 Cc1ccc(cc1)CCC(=O)[13CH3] 1458a_100000234883_200025704644 [0,1,0,0,0,1|1,0,0]=3 3570 B12R1.21 Cc1ccc(cc1)CCN(C)C 2230a_100102631434_100011713686 [0,1,0,0,0,1|1,0,1]=4 3571 B12R1.21 Cc1ccc(cc1)CCN(C)C 269982a_100102631434_100011713686 [0,1,0,0,0,1|1,0,1]=4 3572 B12R1.21 Cc1ccc(cc1)CNC(C)C 207a_100138425928_100000211033 [0,1,0,0,0,1|0,0,2]=4 3573 B12R1.21 Cc1ccc(cc1)CNC(C)C 2230a_100000174908_100000210206 [0,1,0,0,0,1|0,0,2]=4 3574 B12R1.21 Cc1ccc(cc1)CNC(C)C 2230a_100138425928_100000210814 [0,1,0,0,0,1|0,0,2]=4 3575 B12R1.21 Cc1ccc(cc1)CNC(C)C 34a_100000174908_100000210206 [0,1,0,0,0,1|0,0,2]=4 3576 B12R1.21 Cc1ccc(cc1)CNC(C)C 34a_100138425928_100000210814 [0,1,0,0,0,1|0,0,2]=4 3577 B12R1.21 Cc1ccc(cc1)COC(C)C 34a_100000212225_100000210814 [0,1,0,0,0,1|0,0,2]=4 3578 B12R1.21 Cc1ccc(cc1)COC(C)C 34a_100011215236_100000210206 [0,1,0,0,0,1|0,0,2]=4 3579 B12R1.21 Cc1ccc(cc1)COC(C)C 7a_100011215236_100000210206 [0,1,0,0,0,1|0,0,2]=4 3580 B12R1.21 Cc1ccc(cc1)CSC(C)C 62a_100000210206_100000210814 [0,1,0,0,0,1|0,0,2]=4 3581 B12R1.21 Cc1ccc(cc1)CSC(C)C 62a_100000210814_100000210206 [0,1,0,0,0,1|0,0,2]=4 3582 B12R1.21 Cc1ccc(cc1)NCC(=O)N 34a_100000124888_100000187820 [0,1,0,0,0,1|2,0,0]=4 3583 B12R1.21 Cc1ccc(cc1)NCC(=O)[O-] 34a_100000124888_100020667443 [0,1,0,0,0,1|2,0,0]=4 3584 B12R1.21 Cc1ccc(cc1)NCC(C)C 34a_100000124888_100000210624 [0,1,0,0,0,1|0,0,2]=4 3585 B12R1.21 Cc1ccc(cc1)NCC(C)O 34a_100000124888_100011218427 [0,1,0,0,0,1|1,0,1]=4 3586 B12R1.21 Cc1ccc(cc1)NC[C@@H](C)O 34a_100000124888_100009817552 [0,1,0,0,0,1|1,0,1]=4 3587 B12R1.21 Cc1ccc(cc1)OCC(=O)N 34a_100000210336_100000187820 [0,1,0,0,0,1|2,0,0]=4 3588 B12R1.21 Cc1ccc(cc1)OCC(=O)N 7a_100000210336_100000187820 [0,1,0,0,0,1|2,0,0]=4 3589 B12R1.21 Cc1ccc(cc1)OCC(=O)[13CH3] 1458a_100000182360_200025704644 [0,1,0,0,0,1|1,0,0]=3 3590 B12R1.21 Cc1ccc(cc1)OCC(=O)[O-] 34a_100000210336_100020667443 [0,1,0,0,0,1|2,0,0]=4 3591 B12R1.21 Cc1ccc(cc1)OCC(C)C 34a_100000210336_100000210624 [0,1,0,0,0,1|0,0,2]=4 3592 B12R1.21 Cc1ccc(cc1)OCC(C)C 7a_100000210336_100000210760 [0,1,0,0,0,1|0,0,2]=4 3593 B12R1.21 Cc1ccc(cc1)OCC(C)O 34a_100000210336_100011218427 [0,1,0,0,0,1|1,0,1]=4 3594 B12R1.21 Cc1ccc(cc1)OCC(C)O 7a_100000210336_100011218427 [0,1,0,0,0,1|1,0,1]=4 3595 B12R1.21 Cc1ccc(cc1)OC[C@@H](C)O 34a_100000210336_100009817552 [0,1,0,0,0,1|1,0,1]=4 3596 B12R1.21 Cc1ccc(cc1)OC[C@@H](C)O 7a_100000210336_100009817552 [0,1,0,0,0,1|1,0,1]=4 3597 B12R1.21 Cc1ccc(cc1)SCC(=O)N 62a_100000186775_100000747473 [0,1,0,0,0,1|2,0,0]=4 3598 B12R1.21 Cc1ccc(cc1)SCC(=O)N 62a_100000747473_100000186775 [0,1,0,0,0,1|2,0,0]=4 3599 B12R1.21 Cc1ccc(cc1)SCC(=O)[13CH3] 1458a_100000179497_200025704644 [0,1,0,0,0,1|1,0,0]=3 3600 B12R1.21 Cc1ccc(cc1)SCC(=O)[O-] 62a_100000186775_100020667443 [0,1,0,0,0,1|2,0,0]=4 3601 B12R1.21 Cc1ccc(cc1)SCC(=O)[O-] 62a_100020667443_100000186775 [0,1,0,0,0,1|2,0,0]=4 3602 B12R1.21 Cc1ccc(cc1)SCC(C)C 62a_100000186775_100000210760 [0,1,0,0,0,1|0,0,2]=4 3603 B12R1.21 Cc1ccc(cc1)SCC(C)C 62a_100000210624_100000186775 [0,1,0,0,0,1|0,0,2]=4 3604 B12R1.21 Cc1ccc(cc1)SCC(C)O 62a_100000186775_100011218427 [0,1,0,0,0,1|1,0,1]=4 3605 B12R1.21 Cc1ccc(cc1)SCC(C)O 62a_100011218427_100000186775 [0,1,0,0,0,1|1,0,1]=4 3606 B12R1.21 Cc1ccc(cc1)SC[C@@H](C)O 62a_100000186775_100009817552 [0,1,0,0,0,1|1,0,1]=4 3607 B12R1.21 Cc1ccc(cc1)SC[C@@H](C)O 62a_100009817552_100000186775 [0,1,0,0,0,1|1,0,1]=4 3608 B12R1.21 NC(=O)CCc1ccc(cc1)O 271570a_203496583355_200010110666 [0,1,0,0,0,1|2,0,0]=4 3609 B12R1.21 NC(=O)CNc1ccc(cc1)Br 2230a_100000210018_100000747473 [0,1,0,0,0,1|2,0,0]=4 3610 B12R1.21 NC(=O)CNc1ccc(cc1)Br 34a_100000210018_100000187820 [0,1,0,0,0,1|2,0,0]=4 3611 B12R1.21 NC(=O)CNc1ccc(cc1)Cl 2230a_100000210052_100000747473 [0,1,0,0,0,1|2,0,0]=4 3612 B12R1.21 NC(=O)CNc1ccc(cc1)Cl 34a_100000210052_100000187820 [0,1,0,0,0,1|2,0,0]=4 3613 B12R1.21 NC(=O)CNc1ccc(cc1)F 34a_100000185862_100000187820 [0,1,0,0,0,1|2,0,0]=4 3614 B12R1.21 NC(=O)CNc1ccc(cc1)I 34a_100000185761_100000187820 [0,1,0,0,0,1|2,0,0]=4 3615 B12R1.21 NC(=O)CNc1ccc(cc1)O 34a_100000185829_100000187820 [0,1,0,0,0,1|2,0,0]=4 3616 B12R1.21 NC(=O)COc1ccc(cc1)Br 34a_100000185759_100000187820 [0,1,0,0,0,1|2,0,0]=4 3617 B12R1.21 NC(=O)COc1ccc(cc1)Br 7a_100000185759_100000187820 [0,1,0,0,0,1|2,0,0]=4 3618 B12R1.21 NC(=O)COc1ccc(cc1)Cl 34a_100000210216_100000187820 [0,1,0,0,0,1|2,0,0]=4 3619 B12R1.21 NC(=O)COc1ccc(cc1)Cl 7a_100000210216_100000187820 [0,1,0,0,0,1|2,0,0]=4 3620 B12R1.21 NC(=O)COc1ccc(cc1)F 34a_100000210339_100000187820 [0,1,0,0,0,1|2,0,0]=4 3621 B12R1.21 NC(=O)COc1ccc(cc1)I 34a_100000212066_100000187820 [0,1,0,0,0,1|2,0,0]=4 3622 B12R1.21 NC(=O)COc1ccc(cc1)I 7a_100000212066_100000187820 [0,1,0,0,0,1|2,0,0]=4 3623 B12R1.21 NC(=O)COc1ccc(cc1)N 34a_100000185829_100000187820 [0,1,0,0,0,1|2,0,0]=4 3624 B12R1.21 NC(=O)CSc1ccc(cc1)Br 62a_100000747473_100000752885 [0,1,0,0,0,1|2,0,0]=4 3625 B12R1.21 NC(=O)CSc1ccc(cc1)Br 62a_100000752885_100000747473 [0,1,0,0,0,1|2,0,0]=4 3626 B12R1.21 NC(=O)CSc1ccc(cc1)Cl 62a_100000747473_100000755918 [0,1,0,0,0,1|2,0,0]=4 3627 B12R1.21 NC(=O)CSc1ccc(cc1)Cl 62a_100000755918_100000747473 [0,1,0,0,0,1|2,0,0]=4 3628 B12R1.21 NC(=O)CSc1ccc(cc1)F 62a_100000211213_100000747473 [0,1,0,0,0,1|2,0,0]=4 3629 B12R1.21 NC(=O)CSc1ccc(cc1)F 62a_100000747473_100000211213 [0,1,0,0,0,1|2,0,0]=4 3630 B12R1.21 NC(=O)CSc1ccc(cc1)N 62a_100000185761_100000747473 [0,1,0,0,0,1|2,0,0]=4 3631 B12R1.21 NC(=O)CSc1ccc(cc1)N 62a_100000747473_100000185761 [0,1,0,0,0,1|2,0,0]=4 3632 B12R1.21 NC(=O)CSc1ccc(cc1)O 271570a_203496583355_100000149456 [0,1,0,0,0,1|2,0,0]=4 3633 B12R1.21 NC(=O)CSc1ccc(cc1)O 62a_100000747473_100000185759 [0,1,0,0,0,1|2,0,0]=4 3634 B12R1.21 Nc1ccc(cc1)OCC(=O)[O-] 34a_100000185829_100020667443 [0,1,0,0,0,1|2,0,0]=4 3635 B12R1.21 Nc1ccc(cc1)SCC(=O)[O-] 62a_100000185761_100020667443 [0,1,0,0,0,1|2,0,0]=4 3636 B12R1.21 Nc1ccc(cc1)SCC(=O)[O-] 62a_100020667443_100000185761 [0,1,0,0,0,1|2,0,0]=4 3637 B12R1.21 O=C([O-])CNc1ccc(cc1)Br 34a_100000210018_100020667443 [0,1,0,0,0,1|2,0,0]=4 3638 B12R1.21 O=C([O-])CNc1ccc(cc1)Cl 34a_100000210052_100020667443 [0,1,0,0,0,1|2,0,0]=4 3639 B12R1.21 O=C([O-])CNc1ccc(cc1)F 34a_100000185862_100020667443 [0,1,0,0,0,1|2,0,0]=4 3640 B12R1.21 O=C([O-])CNc1ccc(cc1)I 34a_100000185761_100020667443 [0,1,0,0,0,1|2,0,0]=4 3641 B12R1.21 O=C([O-])CNc1ccc(cc1)O 34a_100000185829_100020667443 [0,1,0,0,0,1|2,0,0]=4 3642 B12R1.21 O=C([O-])COc1ccc(cc1)Br 34a_100000185759_100020667443 [0,1,0,0,0,1|2,0,0]=4 3643 B12R1.21 O=C([O-])COc1ccc(cc1)Cl 34a_100000210216_100020667443 [0,1,0,0,0,1|2,0,0]=4 3644 B12R1.21 O=C([O-])COc1ccc(cc1)F 34a_100000210339_100020667443 [0,1,0,0,0,1|2,0,0]=4 3645 B12R1.21 O=C([O-])COc1ccc(cc1)I 34a_100000212066_100020667443 [0,1,0,0,0,1|2,0,0]=4 3646 B12R1.21 O=C([O-])CSc1ccc(cc1)Br 62a_100000752885_100020667443 [0,1,0,0,0,1|2,0,0]=4 3647 B12R1.21 O=C([O-])CSc1ccc(cc1)Br 62a_100020667443_100000752885 [0,1,0,0,0,1|2,0,0]=4 3648 B12R1.21 O=C([O-])CSc1ccc(cc1)Cl 62a_100000755918_100020667443 [0,1,0,0,0,1|2,0,0]=4 3649 B12R1.21 O=C([O-])CSc1ccc(cc1)Cl 62a_100020667443_100000755918 [0,1,0,0,0,1|2,0,0]=4 3650 B12R1.21 O=C([O-])CSc1ccc(cc1)F 62a_100000211213_100020667443 [0,1,0,0,0,1|2,0,0]=4 3651 B12R1.21 O=C([O-])CSc1ccc(cc1)F 62a_100020667443_100000211213 [0,1,0,0,0,1|2,0,0]=4 3652 B12R1.21 O=C([O-])CSc1ccc(cc1)O 62a_100020667443_100000185759 [0,1,0,0,0,1|2,0,0]=4 3653 B12R1.21 [13CH3]C(=O)C#Cc1ccc(cc1)Br 1458a_100012100275_200025704644 [0,1,0,0,0,1|1,0,1]=4 3654 B12R1.21 [13CH3]C(=O)C#Cc1ccc(cc1)Cl 1458a_100011892723_200025704644 [0,1,0,0,0,1|1,0,1]=4 3655 B12R1.21 [13CH3]C(=O)C#Cc1ccc(cc1)F 1458a_100000238512_200025704644 [0,1,0,0,0,1|1,0,1]=4 3656 B12R1.21 [13CH3]C(=O)C=Cc1ccc(cc1)Br 1458a_100016267368_200025704644 [0,1,0,0,0,1|1,0,1]=4 3657 B12R1.21 [13CH3]C(=O)C=Cc1ccc(cc1)Cl 1458a_100000184863_200025704644 [0,1,0,0,0,1|1,0,1]=4 3658 B12R1.21 [13CH3]C(=O)C=Cc1ccc(cc1)F 1458a_100000182136_200025704644 [0,1,0,0,0,1|1,0,1]=4 3659 B12R1.21 [13CH3]C(=O)C=Cc1ccc(cc1)I 1458a_100102526154_200025704644 [0,1,0,0,0,1|1,0,1]=4 3660 B12R1.21 [13CH3]C(=O)CCc1ccc(cc1)Br 1458a_100000217147_200025704644 [0,1,0,0,0,1|1,0,0]=3 3661 B12R1.21 [13CH3]C(=O)CCc1ccc(cc1)Cl 1458a_100000235379_200025704644 [0,1,0,0,0,1|1,0,0]=3 3662 B12R1.21 [13CH3]C(=O)CCc1ccc(cc1)F 1458a_100000198493_200025704644 [0,1,0,0,0,1|1,0,0]=3 3663 B12R1.21 [13CH3]C(=O)CCc1ccc(cc1)I 1458a_100011217499_200025704644 [0,1,0,0,0,1|1,0,0]=3 3664 B12R1.21 [13CH3]C(=O)CCc1ccc(cc1)O 1458a_100000742835_200025704644 [0,1,0,0,0,1|1,0,0]=3 3665 B12R1.21 [13CH3]C(=O)COc1ccc(cc1)Br 1458a_100000182358_200025704644 [0,1,0,0,0,1|1,0,0]=3 3666 B12R1.21 [13CH3]C(=O)COc1ccc(cc1)Cl 1458a_100016990877_200025704644 [0,1,0,0,0,1|1,0,0]=3 3667 B12R1.21 [13CH3]C(=O)COc1ccc(cc1)F 1458a_100000184765_200025704644 [0,1,0,0,0,1|1,0,0]=3 3668 B12R1.21 [13CH3]C(=O)COc1ccc(cc1)I 1458a_100000184369_200025704644 [0,1,0,0,0,1|1,0,0]=3 3669 B12R1.21 [13CH3]C(=O)COc1ccc(cc1)O 1458a_100000031633_200025704644 [0,1,0,0,0,1|1,0,0]=3 3670 B12R1.21 [13CH3]C(=O)CSc1ccc(cc1)Br 1458a_100000179496_200025704644 [0,1,0,0,0,1|1,0,0]=3 3671 B12R1.21 [13CH3]C(=O)CSc1ccc(cc1)Cl 1458a_100000178402_200025704644 [0,1,0,0,0,1|1,0,0]=3 3672 B12R1.21 [13CH3]C(=O)CSc1ccc(cc1)F 1458a_100000691584_200025704644 [0,1,0,0,0,1|1,0,0]=3 3673 B12R1.27 C#CC(=NNc1ccccc1)C 4a_100015195140_100000690481 [0,1,0,0,0,1|1,0,1]=4 3674 B12R1.27 C#CC(=O)CCc1ccccc1 1458a_100000211873_100000765856 [0,1,0,0,0,1|1,0,1]=4 3675 B12R1.27 C#CC(C)NCc1ccccc1 2230a_100000707721_100015291786 [0,1,0,0,0,1|0,0,2]=4 3676 B12R1.27 C#CC(C)NCc1ccccc1 270004a_100000707721_100015611070 [0,1,0,0,0,1|0,0,2]=4 3677 B12R1.27 C#CC(C)NCc1ccccc1 34a_100000707721_100015291786 [0,1,0,0,0,1|0,0,2]=4 3678 B12R1.27 C#CC(C)NCc1ccccc1 34a_100015324214_200000035995 [0,1,0,0,0,1|0,0,2]=4 3679 B12R1.27 C#CC(C)OCc1ccccc1 34a_100000210790_200000035995 [0,1,0,0,0,1|0,0,2]=4 3680 B12R1.27 C#CC(C)SCc1ccccc1 62a_200000035995_100015291786 [0,1,0,0,0,1|0,0,2]=4 3681 B12R1.27 C#C[C@@H](C)OCc1ccccc1 34a_100009815206_100015291786 [0,1,0,0,0,1|0,0,2]=4 3682 B12R1.27 C#C[C@@H](C)OCc1ccccc1 7a_100009815206_100000211182 [0,1,0,0,0,1|0,0,2]=4 3683 B12R1.27 C=C(C#N)CNc1ccccc1 34a_100000106764_100000694840 [0,1,0,0,0,1|0,0,1]=3 3684 B12R1.27 C=C(C#N)COc1ccccc1 34a_100000210340_100000694840 [0,1,0,0,0,1|0,0,1]=3 3685 B12R1.27 C=C(C#N)COc1cccnc1 34a_100000210849_100000694840 [0,1,0,0,0,1|1,0,1]=4 3686 B12R1.27 C=C(C#N)COc1ccncc1 34a_100000212176_100000694840 [0,1,0,0,0,1|1,0,1]=4 3687 B12R1.27 C=C(C#N)CSc1ccccc1 62a_100000719477_100000694840 [0,1,0,0,0,1|0,0,1]=3 3688 B12R1.27 C=C(C#N)CSc1ccccn1 62a_100011216584_100000694840 [0,1,0,0,0,1|1,0,1]=4 3689 B12R1.27 C=C(C#N)CSc1cccnc1 62a_100000210063_100000694840 [0,1,0,0,0,1|1,0,1]=4 3690 B12R1.27 C=C(C#N)CSc1ccncc1 62a_100000728582_100000694840 [0,1,0,0,0,1|1,0,1]=4 3691 B12R1.27 C=CC(=NNc1ccccc1)C 4a_100015195140_200015361842 [0,1,0,0,0,1|1,0,0]=3 3692 B12R1.27 C=CC(=NNc1ccccn1)C 4a_100000183288_200015361842 [0,1,0,0,0,1|2,0,0]=4 3693 B12R1.27 C=CC(=NNc1cccnc1)C 4a_100000728903_200015361842 [0,1,0,0,0,1|2,0,0]=4 3694 B12R1.27 C=CC(=NNc1ccncc1)C 4a_100000698918_200015361842 [0,1,0,0,0,1|2,0,0]=4 3695 B12R1.27 C=CC(=O)CCc1ccccc1 1458a_100000185746_100000765856 [0,1,0,0,0,1|1,0,0]=3 3696 B12R1.27 C=CC(=O)CCc1ccccn1 1458a_100000185746_100015183660 [0,1,0,0,0,1|2,0,0]=4 3697 B12R1.27 C=CC(=O)CCc1cccnc1 1458a_100000185746_200011713674 [0,1,0,0,0,1|2,0,0]=4 3698 B12R1.27 C=CC(=O)CCc1ccncc1 1458a_100000185746_100000723409 [0,1,0,0,0,1|2,0,0]=4 3699 B12R1.27 C=CC(=O)NCc1ccccc1 1626a_100015324214_100000185746 [0,1,0,0,0,1|1,0,0]=3 3700 B12R1.27 C=CC(=O)NCc1ccccc1 240690a_100015324214_200121576911 [0,1,0,0,0,1|1,0,0]=3 3701 B12R1.27 C=CC(=O)NCc1ccccn1 1626a_100000210449_100000185746 [0,1,0,0,0,1|2,0,0]=4 3702 B12R1.27 C=CC(=O)NCc1ccccn1 240690a_100000210449_200121576911 [0,1,0,0,0,1|2,0,0]=4 3703 B12R1.27 C=CC(=O)NCc1cccnc1 240690a_100000210453_200121576911 [0,1,0,0,0,1|2,0,0]=4 3704 B12R1.27 C=CC(=O)NCc1ccncc1 1626a_100000210450_100000185746 [0,1,0,0,0,1|2,0,0]=4 3705 B12R1.27 C=CC(=O)NCc1ccncc1 240690a_100000210450_200121576911 [0,1,0,0,0,1|2,0,0]=4 3706 B12R1.27 C=CC(=O)NNc1ccccc1 22a_100015195140_100000185746 [0,1,0,0,0,1|2,0,0]=4 3707 B12R1.27 C=CC(C)OCc1ccccc1 34a_100000695699_100015291786 [0,1,0,0,0,1|0,0,1]=3 3708 B12R1.27 C=CC(C)OCc1ccccn1 34a_100000695699_100000721315 [0,1,0,0,0,1|1,0,1]=4 3709 B12R1.27 C=CC(C)OCc1cccnc1 34a_100000695699_100000733263 [0,1,0,0,0,1|1,0,1]=4 3710 B12R1.27 C=CC(C)SCc1ccccc1 62a_100011215867_100015291786 [0,1,0,0,0,1|0,0,1]=3 3711 B12R1.27 C=CC(C)SCc1ccccn1 62a_100011215867_100000721315 [0,1,0,0,0,1|1,0,1]=4 3712 B12R1.27 C=CC(C)SCc1cccnc1 62a_100011215867_100000741622 [0,1,0,0,0,1|1,0,1]=4 3713 B12R1.27 C=CC(C)SCc1ccncc1 62a_100011215867_100015193705 [0,1,0,0,0,1|1,0,1]=4 3714 B12R1.27 C=CC(O)CNc1ccccc1 34a_100000106764_100000730141 [0,1,0,0,0,1|1,0,1]=4 3715 B12R1.27 C=CC(O)COc1ccccc1 34a_100000210340_100000730141 [0,1,0,0,0,1|1,0,1]=4 3716 B12R1.27 C=CC(O)COc1ccccc1 7a_100000210340_100000730141 [0,1,0,0,0,1|1,0,1]=4 3717 B12R1.27 C=CC(O)CSc1ccccc1 62a_100000719477_100000730141 [0,1,0,0,0,1|1,0,1]=4 3718 B12R1.27 C=CC(O)CSc1ccccc1 62a_100000730141_100000041952 [0,1,0,0,0,1|1,0,1]=4 3719 B12R1.27 CC(=NNc1ccccc1)CF 4a_100015195140_100000039719 [0,1,0,0,0,1|1,0,1]=4 3720 B12R1.27 CC(=NNc1ccccc1)CO 4a_100015195140_100000211253 [0,1,0,0,0,1|1,0,1]=4 3721 B12R1.27 CC(C#N)NCc1ccccc1 2230a_100000737613_100015291786 [0,1,0,0,0,1|0,0,2]=4 3722 B12R1.27 CC(C#N)NCc1ccccc1 2230a_100015324214_100000184139 [0,1,0,0,0,1|0,0,2]=4 3723 B12R1.27 CC(C#N)OCc1ccccc1 34a_100011218135_100015291786 [0,1,0,0,0,1|0,0,2]=4 3724 B12R1.27 CC(C#N)OCc1ccccc1 7a_100000210790_100000703298 [0,1,0,0,0,1|0,0,2]=4 3725 B12R1.27 CC(C#N)SCc1ccccc1 62a_100000211182_100000703298 [0,1,0,0,0,1|0,0,2]=4 3726 B12R1.27 CC(C#N)SCc1ccccc1 62a_100000703298_100015291786 [0,1,0,0,0,1|0,0,2]=4 3727 B12R1.27 CC(CCc1ccccc1)N[13CH3] 2230a_100000210798_200025704644 [0,1,0,0,0,1|0,0,2]=4 3728 B12R1.27 CC(CCc1ccccc1)N[13CH3] 34a_100000210798_200025704644 [0,1,0,0,0,1|0,0,2]=4 3729 B12R1.27 CC(CF)OCc1ccccc1 34a_100016041109_100015291786 [0,1,0,0,0,1|0,0,2]=4 3730 B12R1.27 CC(CF)OCc1ccccc1 7a_100016041109_100000211182 [0,1,0,0,0,1|0,0,2]=4 3731 B12R1.27 CC(CN)OCc1ccccc1 34a_100000210904_100015291786 [0,1,0,0,0,1|0,0,2]=4 3732 B12R1.27 CC(CO)NCc1ccccc1 2230a_100015324214_100012180447 [0,1,0,0,0,1|0,0,2]=4 3733 B12R1.27 CC(CO)NCc1ccccc1 34a_100015324214_100012180447 [0,1,0,0,0,1|0,0,2]=4 3734 B12R1.27 CC(CO)OCc1ccccc1 34a_100000210790_100012180447 [0,1,0,0,0,1|0,0,2]=4 3735 B12R1.27 CC(CO)OCc1ccccc1 7a_100000210790_100012180447 [0,1,0,0,0,1|0,0,2]=4 3736 B12R1.27 CC(CO)SCc1ccccc1 62a_100012180447_100015291786 [0,1,0,0,0,1|0,0,2]=4 3737 B12R1.27 CC(COc1ccccc1)N[13CH3] 2230a_100000746794_200025704644 [0,1,0,0,0,1|0,0,2]=4 3738 B12R1.27 CC(COc1ccccc1)N[13CH3] 34a_100000746794_200025704644 [0,1,0,0,0,1|0,0,2]=4 3739 B12R1.27 CC(COc1ccccc1)O[13CH3] 34a_100000210911_200025704644 [0,1,0,0,0,1|0,0,2]=4 3740 B12R1.27 CC(COc1ccccc1)O[13CH3] 7a_100000210911_200025704644 [0,1,0,0,0,1|0,0,2]=4 3741 B12R1.27 CCC(=O)C#Cc1ccccc1 1458a_100000736102_100000210202 [0,1,0,0,0,1|1,0,1]=4 3742 B12R1.27 CCC(=O)C=Cc1ccccc1 1458a_100000210462_100000210202 [0,1,0,0,0,1|1,0,1]=4 3743 B12R1.27 CCC(=O)CCc1ccccc1 1458a_100000185753_100000210202 [0,1,0,0,0,1|1,0,0]=3 3744 B12R1.27 CCC(=O)CCc1ccccc1 1458a_100000210414_100000765856 [0,1,0,0,0,1|1,0,0]=3 3745 B12R1.27 CCC(=O)CCc1ccccn1 1458a_100000210414_100015183660 [0,1,0,0,0,1|2,0,0]=4 3746 B12R1.27 CCC(=O)CCc1ccccn1 1458a_100015195070_100000210202 [0,1,0,0,0,1|2,0,0]=4 3747 B12R1.27 CCC(=O)CCc1cccnc1 1458a_100000198484_100000210202 [0,1,0,0,0,1|2,0,0]=4 3748 B12R1.27 CCC(=O)CCc1cccnc1 1458a_100000210414_200011713674 [0,1,0,0,0,1|2,0,0]=4 3749 B12R1.27 CCC(=O)CCc1ccncc1 1458a_100000210414_100000723409 [0,1,0,0,0,1|2,0,0]=4 3750 B12R1.27 CCC(=O)CCc1ccncc1 1458a_100011225043_100000210202 [0,1,0,0,0,1|2,0,0]=4 3751 B12R1.27 CCC(=O)COc1ccccc1 1458a_100000186222_100000210202 [0,1,0,0,0,1|1,0,0]=3 3752 B12R1.27 CCC(=O)COc1ccccc1 7a_100000210340_100000747405 [0,1,0,0,0,1|1,0,0]=3 3753 B12R1.27 CCC(=O)COc1ccccn1 1458a_100102699861_100000210202 [0,1,0,0,0,1|2,0,0]=4 3754 B12R1.27 CCC(=O)COc1cccnc1 1458a_100015207166_100000210202 [0,1,0,0,0,1|2,0,0]=4 3755 B12R1.27 CCC(=O)COc1cccnc1 7a_100000210849_100000747405 [0,1,0,0,0,1|2,0,0]=4 3756 B12R1.27 CCC(=O)CSc1ccccc1 1458a_100000211596_100000210202 [0,1,0,0,0,1|1,0,0]=3 3757 B12R1.27 CCC(=O)CSc1ccccc1 62a_100000719477_100000747405 [0,1,0,0,0,1|1,0,0]=3 3758 B12R1.27 CCC(=O)CSc1ccccc1 62a_100000747405_100000041952 [0,1,0,0,0,1|1,0,0]=3 3759 B12R1.27 CCC(=O)CSc1ccccn1 1458a_100000156281_100000210202 [0,1,0,0,0,1|2,0,0]=4 3760 B12R1.27 CCC(=O)CSc1ccccn1 62a_100000747405_100011216584 [0,1,0,0,0,1|2,0,0]=4 3761 B12R1.27 CCC(=O)CSc1ccccn1 62a_100011216584_100000747405 [0,1,0,0,0,1|2,0,0]=4 3762 B12R1.27 CCC(=O)CSc1cccnc1 62a_100000210063_100000747405 [0,1,0,0,0,1|2,0,0]=4 3763 B12R1.27 CCC(=O)CSc1cccnc1 62a_100000747405_100000210063 [0,1,0,0,0,1|2,0,0]=4 3764 B12R1.27 CCC(=O)CSc1ccncc1 1458a_100000211328_100000210202 [0,1,0,0,0,1|2,0,0]=4 3765 B12R1.27 CCC(=O)CSc1ccncc1 62a_100000728582_100000747405 [0,1,0,0,0,1|2,0,0]=4 3766 B12R1.27 CCC(=O)CSc1ccncc1 62a_100000747405_100000728582 [0,1,0,0,0,1|2,0,0]=4 3767 B12R1.27 CCC(=O)NCc1ccccc1 11a_100015324214_100000210414 [0,1,0,0,0,1|1,0,0]=3 3768 B12R1.27 CCC(=O)NCc1ccccc1 1626a_100015324214_100000210414 [0,1,0,0,0,1|1,0,0]=3 3769 B12R1.27 CCC(=O)NCc1ccccc1 240690a_100015324214_100000210414 [0,1,0,0,0,1|1,0,0]=3 3770 B12R1.27 CCC(=O)NCc1ccccc1 527a_100015324214_100000210414 [0,1,0,0,0,1|1,0,0]=3 3771 B12R1.27 CCC(=O)NCc1ccccn1 11a_100000210449_100000210414 [0,1,0,0,0,1|2,0,0]=4 3772 B12R1.27 CCC(=O)NCc1ccccn1 1626a_100000210449_100000210414 [0,1,0,0,0,1|2,0,0]=4 3773 B12R1.27 CCC(=O)NCc1ccccn1 240690a_100000210449_100000210414 [0,1,0,0,0,1|2,0,0]=4 3774 B12R1.27 CCC(=O)NCc1ccccn1 527a_100000210449_100000210414 [0,1,0,0,0,1|2,0,0]=4 3775 B12R1.27 CCC(=O)NCc1cccnc1 11a_100000210453_100000210414 [0,1,0,0,0,1|2,0,0]=4 3776 B12R1.27 CCC(=O)NCc1cccnc1 240690a_100000210453_100000210414 [0,1,0,0,0,1|2,0,0]=4 3777 B12R1.27 CCC(=O)NCc1cccnc1 527a_100000210453_100000210414 [0,1,0,0,0,1|2,0,0]=4 3778 B12R1.27 CCC(=O)NCc1ccncc1 11a_100000210450_100000210414 [0,1,0,0,0,1|2,0,0]=4 3779 B12R1.27 CCC(=O)NCc1ccncc1 1626a_100000210450_100000210414 [0,1,0,0,0,1|2,0,0]=4 3780 B12R1.27 CCC(=O)NCc1ccncc1 240690a_100000210450_100000210414 [0,1,0,0,0,1|2,0,0]=4 3781 B12R1.27 CCC(=O)NCc1ccncc1 527a_100000210450_100000210414 [0,1,0,0,0,1|2,0,0]=4 3782 B12R1.27 CCC(=O)NNc1ccccc1 22a_100015195140_100000210414 [0,1,0,0,0,1|2,0,0]=4 3783 B12R1.27 CCC(C)CNc1ccccc1 34a_100000106764_100000748023 [0,1,0,0,0,1|0,0,2]=4 3784 B12R1.27 CCC(C)COc1ccccc1 34a_100000210340_100000748023 [0,1,0,0,0,1|0,0,2]=4 3785 B12R1.27 CCC(C)COc1ccccc1 7a_100000210340_100000748023 [0,1,0,0,0,1|0,0,2]=4 3786 B12R1.27 CCC(C)CSc1ccccc1 62a_100000719477_100000748023 [0,1,0,0,0,1|0,0,2]=4 3787 B12R1.27 CCC(C)CSc1ccccc1 62a_100000748023_100000041952 [0,1,0,0,0,1|0,0,2]=4 3788 B12R1.27 CCC(C)NCc1ccccc1 207a_100000209981_100015611070 [0,1,0,0,0,1|0,0,2]=4 3789 B12R1.27 CCC(C)NCc1ccccc1 2230a_100000209981_100015291786 [0,1,0,0,0,1|0,0,2]=4 3790 B12R1.27 CCC(C)NCc1ccccc1 2230a_100015324214_100000758301 [0,1,0,0,0,1|0,0,2]=4 3791 B12R1.27 CCC(C)NCc1ccccc1 270004a_100000209981_100015611070 [0,1,0,0,0,1|0,0,2]=4 3792 B12R1.27 CCC(C)NCc1ccccc1 34a_100015324214_100011215416 [0,1,0,0,0,1|0,0,2]=4 3793 B12R1.27 CCC(C)OCc1ccccc1 34a_100000210790_100011215416 [0,1,0,0,0,1|0,0,2]=4 3794 B12R1.27 CCC(C)OCc1ccccc1 7a_100000210228_100000211182 [0,1,0,0,0,1|0,0,2]=4 3795 B12R1.27 CCC(C)OCc1ccccc1 7a_100000210790_100000758301 [0,1,0,0,0,1|0,0,2]=4 3796 B12R1.27 CCC(C)SCc1ccccc1 62a_100000211182_100000758301 [0,1,0,0,0,1|0,0,2]=4 3797 B12R1.27 CCC(C)SCc1ccccc1 62a_100000758301_100015291786 [0,1,0,0,0,1|0,0,2]=4 3798 B12R1.27 CCC(O)CNc1ccccc1 34a_100000106764_100011218378 [0,1,0,0,0,1|1,0,1]=4 3799 B12R1.27 CCC(O)COc1ccccc1 34a_100000210340_100011218378 [0,1,0,0,0,1|1,0,1]=4 3800 B12R1.27 CCC(O)COc1ccccc1 7a_100000210340_100011218378 [0,1,0,0,0,1|1,0,1]=4 3801 B12R1.27 CCC(O)CSc1ccccc1 62a_100000719477_100011218378 [0,1,0,0,0,1|1,0,1]=4 3802 B12R1.27 CCC(O)CSc1ccccc1 62a_100011218378_100000041952 [0,1,0,0,0,1|1,0,1]=4 3803 B12R1.27 CCN(C)CCc1ccccc1 2230a_100000207497_100000210202 [0,1,0,0,0,1|1,0,1]=4 3804 B12R1.27 CCN(C)CCc1ccccc1 2230a_100000225621_100000765856 [0,1,0,0,0,1|1,0,1]=4 3805 B12R1.27 CCN(C)CCc1ccccc1 2230a_100000741020_200000210301 [0,1,0,0,0,1|1,0,1]=4 3806 B12R1.27 CCN(C)CCc1ccccc1 269982a_100000207497_100000204670 [0,1,0,0,0,1|1,0,1]=4 3807 B12R1.27 CCN(C)CCc1ccccc1 269982a_100000225621_100000765856 [0,1,0,0,0,1|1,0,1]=4 3808 B12R1.27 CCN(C)CCc1ccccc1 269982a_100000741020_200000210301 [0,1,0,0,0,1|1,0,1]=4 3809 B12R1.27 CCN(C)CSc1ccccc1 2230a_100000225621_100011218342 [0,1,0,0,0,1|1,0,1]=4 3810 B12R1.27 CCN(C)CSc1ccccc1 269982a_100000225621_100011218342 [0,1,0,0,0,1|1,0,1]=4 3811 B12R1.27 CCN([13CH3])CCc1ccccc1 2230a_100000741020_200025704644 [0,1,0,0,0,1|1,0,1]=4 3812 B12R1.27 CCN([13CH3])CCc1ccccc1 269982a_100000741020_200025704644 [0,1,0,0,0,1|1,0,1]=4 3813 B12R1.27 CC[C@H](C)CNc1ccccc1 34a_100000106764_100009816398 [0,1,0,0,0,1|0,0,2]=4 3814 B12R1.27 CC[C@H](C)COc1ccccc1 34a_100000210340_100009816398 [0,1,0,0,0,1|0,0,2]=4 3815 B12R1.27 CC[C@H](C)COc1ccccc1 7a_100000210340_100009816398 [0,1,0,0,0,1|0,0,2]=4 3816 B12R1.27 CC[C@H](C)CSc1ccccc1 62a_100000719477_100009816398 [0,1,0,0,0,1|0,0,2]=4 3817 B12R1.27 CC[C@H](C)CSc1ccccc1 62a_100009816398_100000041952 [0,1,0,0,0,1|0,0,2]=4 3818 B12R1.27 CN(CF)CCc1ccccc1 269982a_100000207497_100015361967 [0,1,0,0,0,1|1,0,1]=4 3819 B12R1.27 CNC(=O)C#Cc1ccccc1 240690a_100102657272_100000736102 [0,1,0,0,0,1|1,0,1]=4 3820 B12R1.27 CNC(=O)C=Cc1ccccc1 11a_106832991635_100000210462 [0,1,0,0,0,1|1,0,1]=4 3821 B12R1.27 CNC(=O)C=Cc1ccccc1 1626a_100102657272_100000210462 [0,1,0,0,0,1|1,0,1]=4 3822 B12R1.27 CNC(=O)CCc1ccccc1 11a_106832991635_100000185753 [0,1,0,0,0,1|1,0,0]=3 3823 B12R1.27 CNC(=O)CCc1ccccc1 1626a_100102657272_100000185753 [0,1,0,0,0,1|1,0,0]=3 3824 B12R1.27 CNC(=O)CCc1ccccc1 240690a_100102657272_100000185753 [0,1,0,0,0,1|1,0,0]=3 3825 B12R1.27 CNC(=O)CCc1ccccc1 527a_100102657272_100000185753 [0,1,0,0,0,1|1,0,0]=3 3826 B12R1.27 CNC(=O)CCc1ccccn1 11a_106832991635_100015195070 [0,1,0,0,0,1|2,0,0]=4 3827 B12R1.27 CNC(=O)CCc1ccccn1 240690a_100102657272_100015195070 [0,1,0,0,0,1|2,0,0]=4 3828 B12R1.27 CNC(=O)CCc1ccccn1 527a_100102657272_100015195070 [0,1,0,0,0,1|2,0,0]=4 3829 B12R1.27 CNC(=O)CCc1cccnc1 11a_106832991635_100000198484 [0,1,0,0,0,1|2,0,0]=4 3830 B12R1.27 CNC(=O)CCc1cccnc1 1626a_100102657272_100000198484 [0,1,0,0,0,1|2,0,0]=4 3831 B12R1.27 CNC(=O)CCc1cccnc1 240690a_100102657272_100000198484 [0,1,0,0,0,1|2,0,0]=4 3832 B12R1.27 CNC(=O)CCc1cccnc1 527a_100102657272_100000198484 [0,1,0,0,0,1|2,0,0]=4 3833 B12R1.27 CNC(=O)CCc1ccncc1 11a_106832991635_100011225043 [0,1,0,0,0,1|2,0,0]=4 3834 B12R1.27 CNC(=O)CCc1ccncc1 240690a_100102657272_100011225043 [0,1,0,0,0,1|2,0,0]=4 3835 B12R1.27 CNC(=O)CCc1ccncc1 527a_100102657272_100011225043 [0,1,0,0,0,1|2,0,0]=4 3836 B12R1.27 CNC(=O)CNc1ccccc1 34a_100000106764_100000183359 [0,1,0,0,0,1|1,0,0]=3 3837 B12R1.27 CNC(=O)COc1ccccc1 11a_106832991635_100000186222 [0,1,0,0,0,1|1,0,0]=3 3838 B12R1.27 CNC(=O)COc1ccccc1 1626a_100102657272_100000186222 [0,1,0,0,0,1|1,0,0]=3 3839 B12R1.27 CNC(=O)COc1ccccc1 240690a_100102657272_100000186222 [0,1,0,0,0,1|1,0,0]=3 3840 B12R1.27 CNC(=O)COc1ccccc1 34a_100000210340_100000183359 [0,1,0,0,0,1|1,0,0]=3 3841 B12R1.27 CNC(=O)COc1ccccc1 527a_100102657272_100000186222 [0,1,0,0,0,1|1,0,0]=3 3842 B12R1.27 CNC(=O)COc1ccccc1 7a_100000210340_100000183359 [0,1,0,0,0,1|1,0,0]=3 3843 B12R1.27 CNC(=O)COc1ccccn1 1626a_100102657272_100102699861 [0,1,0,0,0,1|2,0,0]=4 3844 B12R1.27 CNC(=O)COc1ccccn1 240690a_100102657272_100102699861 [0,1,0,0,0,1|2,0,0]=4 3845 B12R1.27 CNC(=O)COc1ccccn1 527a_100102657272_100102699861 [0,1,0,0,0,1|2,0,0]=4 3846 B12R1.27 CNC(=O)COc1cccnc1 11a_106832991635_100015207166 [0,1,0,0,0,1|2,0,0]=4 3847 B12R1.27 CNC(=O)COc1cccnc1 1626a_100102657272_100015207166 [0,1,0,0,0,1|2,0,0]=4 3848 B12R1.27 CNC(=O)COc1cccnc1 240690a_100102657272_100015207166 [0,1,0,0,0,1|2,0,0]=4 3849 B12R1.27 CNC(=O)COc1cccnc1 34a_100000210849_100000183359 [0,1,0,0,0,1|2,0,0]=4 3850 B12R1.27 CNC(=O)COc1cccnc1 527a_100102657272_100015207166 [0,1,0,0,0,1|2,0,0]=4 3851 B12R1.27 CNC(=O)COc1cccnc1 7a_100000210849_100000183359 [0,1,0,0,0,1|2,0,0]=4 3852 B12R1.27 CNC(=O)COc1ccncc1 34a_100000212176_100000183359 [0,1,0,0,0,1|2,0,0]=4 3853 B12R1.27 CNC(=O)CSc1ccccc1 11a_106832991635_100000211596 [0,1,0,0,0,1|1,0,0]=3 3854 B12R1.27 CNC(=O)CSc1ccccc1 1626a_100102657272_100000211596 [0,1,0,0,0,1|1,0,0]=3 3855 B12R1.27 CNC(=O)CSc1ccccc1 240690a_100102657272_100000211596 [0,1,0,0,0,1|1,0,0]=3 3856 B12R1.27 CNC(=O)CSc1ccccc1 527a_100102657272_100000211596 [0,1,0,0,0,1|1,0,0]=3 3857 B12R1.27 CNC(=O)CSc1ccccc1 62a_100000183359_100000041952 [0,1,0,0,0,1|1,0,0]=3 3858 B12R1.27 CNC(=O)CSc1ccccc1 62a_100000719477_100000183359 [0,1,0,0,0,1|1,0,0]=3 3859 B12R1.27 CNC(=O)CSc1ccccn1 11a_106832991635_100000156281 [0,1,0,0,0,1|2,0,0]=4 3860 B12R1.27 CNC(=O)CSc1ccccn1 240690a_100102657272_100000156281 [0,1,0,0,0,1|2,0,0]=4 3861 B12R1.27 CNC(=O)CSc1ccccn1 527a_100102657272_100000156281 [0,1,0,0,0,1|2,0,0]=4 3862 B12R1.27 CNC(=O)CSc1ccccn1 62a_100000183359_100011216584 [0,1,0,0,0,1|2,0,0]=4 3863 B12R1.27 CNC(=O)CSc1ccccn1 62a_100011216584_100000183359 [0,1,0,0,0,1|2,0,0]=4 3864 B12R1.27 CNC(=O)CSc1cccnc1 62a_100000183359_100000210063 [0,1,0,0,0,1|2,0,0]=4 3865 B12R1.27 CNC(=O)CSc1cccnc1 62a_100000210063_100000183359 [0,1,0,0,0,1|2,0,0]=4 3866 B12R1.27 CNC(=O)CSc1ccncc1 11a_106832991635_100000211328 [0,1,0,0,0,1|2,0,0]=4 3867 B12R1.27 CNC(=O)CSc1ccncc1 1626a_100102657272_100000211328 [0,1,0,0,0,1|2,0,0]=4 3868 B12R1.27 CNC(=O)CSc1ccncc1 240690a_100102657272_100000211328 [0,1,0,0,0,1|2,0,0]=4 3869 B12R1.27 CNC(=O)CSc1ccncc1 527a_100102657272_100000211328 [0,1,0,0,0,1|2,0,0]=4 3870 B12R1.27 CNC(=O)CSc1ccncc1 62a_100000183359_100000728582 [0,1,0,0,0,1|2,0,0]=4 3871 B12R1.27 CNC(=O)CSc1ccncc1 62a_100000728582_100000183359 [0,1,0,0,0,1|2,0,0]=4 3872 B12R1.27 CNC(=O)NCc1ccccc1 2708a_100015324214_106832991635 [0,1,0,0,0,1|1,0,0]=3 3873 B12R1.27 CNC(=O)NCc1ccccc1 2708a_100102657272_100015324214 [0,1,0,0,0,1|1,0,0]=3 3874 B12R1.27 CNC(=O)NCc1ccccc1 273464a_100015324214_100102657272 [0,1,0,0,0,1|1,0,0]=3 3875 B12R1.27 CNC(=O)NCc1ccccc1 273464a_100102657272_100015324214 [0,1,0,0,0,1|1,0,0]=3 3876 B12R1.27 CNC(=O)NCc1ccccc1 512a_100015324214_100102657272 [0,1,0,0,0,1|1,0,0]=3 3877 B12R1.27 CNC(=O)NCc1ccccc1 512a_106832991638_100015324214 [0,1,0,0,0,1|1,0,0]=3 3878 B12R1.27 CNC(=O)NCc1ccccn1 2708a_100000210449_106832991635 [0,1,0,0,0,1|2,0,0]=4 3879 B12R1.27 CNC(=O)NCc1ccccn1 2708a_100102657272_100000210449 [0,1,0,0,0,1|2,0,0]=4 3880 B12R1.27 CNC(=O)NCc1ccccn1 273464a_100000210449_100102657272 [0,1,0,0,0,1|2,0,0]=4 3881 B12R1.27 CNC(=O)NCc1ccccn1 273464a_100102657272_100000210449 [0,1,0,0,0,1|2,0,0]=4 3882 B12R1.27 CNC(=O)NCc1ccccn1 512a_106832991638_100000210449 [0,1,0,0,0,1|2,0,0]=4 3883 B12R1.27 CNC(=O)NCc1cccnc1 2708a_100000210453_106832991635 [0,1,0,0,0,1|2,0,0]=4 3884 B12R1.27 CNC(=O)NCc1cccnc1 2708a_100102657272_100000210453 [0,1,0,0,0,1|2,0,0]=4 3885 B12R1.27 CNC(=O)NCc1cccnc1 273464a_100000210453_100102657272 [0,1,0,0,0,1|2,0,0]=4 3886 B12R1.27 CNC(=O)NCc1cccnc1 273464a_100102657272_100000210453 [0,1,0,0,0,1|2,0,0]=4 3887 B12R1.27 CNC(=O)NCc1cccnc1 512a_100000210453_100102657272 [0,1,0,0,0,1|2,0,0]=4 3888 B12R1.27 CNC(=O)NCc1cccnc1 512a_106832991638_100000210453 [0,1,0,0,0,1|2,0,0]=4 3889 B12R1.27 CNC(=O)NCc1ccncc1 2708a_100000210450_106832991635 [0,1,0,0,0,1|2,0,0]=4 3890 B12R1.27 CNC(=O)NCc1ccncc1 2708a_100102657272_100000210450 [0,1,0,0,0,1|2,0,0]=4 3891 B12R1.27 CNC(=O)NCc1ccncc1 273464a_100000210450_100102657272 [0,1,0,0,0,1|2,0,0]=4 3892 B12R1.27 CNC(=O)NCc1ccncc1 273464a_100102657272_100000210450 [0,1,0,0,0,1|2,0,0]=4 3893 B12R1.27 CNC(=O)NCc1ccncc1 512a_106832991638_100000210450 [0,1,0,0,0,1|2,0,0]=4 3894 B12R1.27 CNC(=O)NNc1ccccc1 273464a_100102657272_100015195140 [0,1,0,0,0,1|2,0,0]=4 3895 B12R1.27 CNC(=O)NNc1ccccc1 512a_106832991638_100015195140 [0,1,0,0,0,1|2,0,0]=4 3896 B12R1.27 CNC(C)CCc1ccccc1 2230a_100000210798_200000210301 [0,1,0,0,0,1|0,0,2]=4 3897 B12R1.27 CNC(C)CCc1ccccc1 270004a_106832991635_100000210092 [0,1,0,0,0,1|0,0,2]=4 3898 B12R1.27 CNC(C)CCc1ccccc1 34a_100000210798_200000210301 [0,1,0,0,0,1|0,0,2]=4 3899 B12R1.27 CNC(C)COc1ccccc1 2230a_100000746794_200000210301 [0,1,0,0,0,1|0,0,2]=4 3900 B12R1.27 CNC(C)COc1ccccc1 270004a_106832991635_100000150576 [0,1,0,0,0,1|0,0,2]=4 3901 B12R1.27 CNC(C)COc1ccccc1 34a_100000746794_200000210301 [0,1,0,0,0,1|0,0,2]=4 3902 B12R1.27 CNC(C)CSc1ccccc1 270004a_106832991635_100000150717 [0,1,0,0,0,1|0,0,2]=4 3903 B12R1.27 COC(=O)CNc1ccccc1 34a_100000106764_100000747449 [0,1,0,0,0,1|1,0,0]=3 3904 B12R1.27 COC(=O)COc1ccccc1 34a_100000210340_100000747449 [0,1,0,0,0,1|1,0,0]=3 3905 B12R1.27 COC(=O)COc1ccccc1 7a_100000210340_100000747449 [0,1,0,0,0,1|1,0,0]=3 3906 B12R1.27 COC(=O)COc1cccnc1 34a_100000210849_100000747449 [0,1,0,0,0,1|2,0,0]=4 3907 B12R1.27 COC(=O)COc1cccnc1 7a_100000210849_100000747449 [0,1,0,0,0,1|2,0,0]=4 3908 B12R1.27 COC(=O)COc1ccncc1 34a_100000212176_100000747449 [0,1,0,0,0,1|2,0,0]=4 3909 B12R1.27 COC(=O)CSc1ccccc1 62a_100000719477_100000747449 [0,1,0,0,0,1|1,0,0]=3 3910 B12R1.27 COC(=O)CSc1ccccc1 62a_100000747449_100000041952 [0,1,0,0,0,1|1,0,0]=3 3911 B12R1.27 COC(=O)CSc1ccccn1 62a_100000747449_100011216584 [0,1,0,0,0,1|2,0,0]=4 3912 B12R1.27 COC(=O)CSc1ccccn1 62a_100011216584_100000747449 [0,1,0,0,0,1|2,0,0]=4 3913 B12R1.27 COC(=O)CSc1cccnc1 62a_100000210063_100000747449 [0,1,0,0,0,1|2,0,0]=4 3914 B12R1.27 COC(=O)CSc1cccnc1 62a_100000747449_100000210063 [0,1,0,0,0,1|2,0,0]=4 3915 B12R1.27 COC(=O)CSc1ccncc1 62a_100000728582_100000747449 [0,1,0,0,0,1|2,0,0]=4 3916 B12R1.27 COC(=O)CSc1ccncc1 62a_100000747449_100000728582 [0,1,0,0,0,1|2,0,0]=4 3917 B12R1.27 COC(C)COc1ccccc1 34a_100000210911_200000210301 [0,1,0,0,0,1|0,0,2]=4 3918 B12R1.27 COC(C)COc1ccccc1 7a_100000210911_200000210301 [0,1,0,0,0,1|0,0,2]=4 3919 B12R1.27 COC(C)SCc1ccccc1 62a_100000211182_100009879195 [0,1,0,0,0,1|0,0,2]=4 3920 B12R1.27 COC(C)SCc1ccccc1 62a_100009879195_100015291786 [0,1,0,0,0,1|0,0,2]=4 3921 B12R1.27 CO[C@@H](C)CCc1ccccc1 34a_100009815974_200000210301 [0,1,0,0,0,1|0,0,2]=4 3922 B12R1.27 CO[C@@H](C)CCc1ccccc1 7a_100009815974_200000210301 [0,1,0,0,0,1|0,0,2]=4 3923 B12R1.27 C[C@@H](CCc1ccccc1)O[13CH3] 34a_100009815974_200025704644 [0,1,0,0,0,1|0,0,2]=4 3924 B12R1.27 C[C@@H](CCc1ccccc1)O[13CH3] 7a_100009815974_200025704644 [0,1,0,0,0,1|0,0,2]=4 3925 B12R1.27 C[C@@H](CO)CNc1ccccc1 34a_100000106764_100000059175 [0,1,0,0,0,1|0,0,2]=4 3926 B12R1.27 C[C@@H](CO)COc1ccccc1 34a_100000210340_100000059175 [0,1,0,0,0,1|0,0,2]=4 3927 B12R1.27 C[C@@H](CO)COc1ccccc1 7a_100000210340_100000059175 [0,1,0,0,0,1|0,0,2]=4 3928 B12R1.27 C[C@@H](CO)CSc1ccccc1 62a_100000059175_100000041952 [0,1,0,0,0,1|0,0,2]=4 3929 B12R1.27 C[C@@H](CO)CSc1ccccc1 62a_100000719477_100000059175 [0,1,0,0,0,1|0,0,2]=4 3930 B12R1.27 C[C@H](CF)NCc1ccccc1 207a_100102880703_100015611070 [0,1,0,0,0,1|0,0,2]=4 3931 B12R1.27 C[C@H](CF)NCc1ccccc1 270004a_100102880703_100015611070 [0,1,0,0,0,1|0,0,2]=4 3932 B12R1.27 C[C@H](CO)NCc1ccccc1 207a_100000737577_100015611070 [0,1,0,0,0,1|0,0,2]=4 3933 B12R1.27 C[C@H](CO)NCc1ccccc1 2230a_100000737577_100015291786 [0,1,0,0,0,1|0,0,2]=4 3934 B12R1.27 C[C@H](CO)NCc1ccccc1 270004a_100000737577_100015611070 [0,1,0,0,0,1|0,0,2]=4 3935 B12R1.27 C[C@H](CO)SCc1ccccc1 62a_100000211182_100016084084 [0,1,0,0,0,1|0,0,2]=4 3936 B12R1.27 C[C@H](CO)SCc1ccccc1 62a_100016084084_100015291786 [0,1,0,0,0,1|0,0,2]=4 3937 B12R1.27 O=C(C#Cc1ccccc1)CF 1458a_100000736102_100015361967 [0,1,0,0,0,1|1,0,1]=4 3938 B12R1.27 O=C(C=Cc1ccccc1)CF 1458a_100000210462_100015361967 [0,1,0,0,0,1|1,0,1]=4 3939 B12R1.27 O=C(CF)CCc1ccccc1 1458a_100000185753_100015361967 [0,1,0,0,0,1|1,0,0]=3 3940 B12R1.27 O=C(CF)CCc1ccccn1 1458a_100015195070_100015361967 [0,1,0,0,0,1|2,0,0]=4 3941 B12R1.27 O=C(CF)CCc1cccnc1 1458a_100000198484_100015361967 [0,1,0,0,0,1|2,0,0]=4 3942 B12R1.27 O=C(CF)CCc1ccncc1 1458a_100011225043_100015361967 [0,1,0,0,0,1|2,0,0]=4 3943 B12R1.27 O=C(CF)COc1ccccc1 1458a_100000186222_100015361967 [0,1,0,0,0,1|1,0,0]=3 3944 B12R1.27 O=C(CF)COc1ccccn1 1458a_100102699861_100015361967 [0,1,0,0,0,1|2,0,0]=4 3945 B12R1.27 O=C(CF)COc1cccnc1 1458a_100015207166_100015361967 [0,1,0,0,0,1|2,0,0]=4 3946 B12R1.27 O=C(CF)CSc1ccccc1 1458a_100000211596_100015361967 [0,1,0,0,0,1|1,0,0]=3 3947 B12R1.27 O=C(CF)CSc1ccccn1 1458a_100000156281_100015361967 [0,1,0,0,0,1|2,0,0]=4 3948 B12R1.27 O=C(CF)CSc1ccncc1 1458a_100000211328_100015361967 [0,1,0,0,0,1|2,0,0]=4 3949 B12R1.27 O=C(CO)CCc1ccccc1 1458a_100000210174_100000765856 [0,1,0,0,0,1|1,0,0]=3 3950 B12R1.27 O=C(CO)CCc1ccccn1 1458a_100000210174_100015183660 [0,1,0,0,0,1|2,0,0]=4 3951 B12R1.27 O=C(CO)CCc1cccnc1 1458a_100000210174_200011713674 [0,1,0,0,0,1|2,0,0]=4 3952 B12R1.27 O=C(CO)CCc1ccncc1 1458a_100000210174_100000723409 [0,1,0,0,0,1|2,0,0]=4 3953 B12R1.27 O=C(CO)NCc1ccccc1 240690a_100015324214_100000210174 [0,1,0,0,0,1|1,0,0]=3 3954 B12R1.27 O=C(CO)NCc1ccccc1 527a_100015324214_100000210174 [0,1,0,0,0,1|1,0,0]=3 3955 B12R1.27 O=C(CO)NCc1ccccn1 240690a_100000210449_100000210174 [0,1,0,0,0,1|2,0,0]=4 3956 B12R1.27 O=C(CO)NCc1ccccn1 527a_100000210449_100000210174 [0,1,0,0,0,1|2,0,0]=4 3957 B12R1.27 O=C(CO)NCc1cccnc1 240690a_100000210453_100000210174 [0,1,0,0,0,1|2,0,0]=4 3958 B12R1.27 O=C(CO)NCc1cccnc1 527a_100000210453_100000210174 [0,1,0,0,0,1|2,0,0]=4 3959 B12R1.27 O=C(CO)NCc1ccncc1 240690a_100000210450_100000210174 [0,1,0,0,0,1|2,0,0]=4 3960 B12R1.27 O=C(CO)NCc1ccncc1 527a_100000210450_100000210174 [0,1,0,0,0,1|2,0,0]=4 3961 B12R1.27 O=C(CO)NNc1ccccc1 22a_100015195140_100000210174 [0,1,0,0,0,1|2,0,0]=4 3962 B12R1.27 OCC(O)CNc1ccccc1 34a_100000106764_100011219619 [0,1,0,0,0,1|1,0,1]=4 3963 B12R1.27 OCC(O)COc1ccccc1 34a_100000210340_100011219619 [0,1,0,0,0,1|1,0,1]=4 3964 B12R1.27 OCC(O)COc1ccccc1 7a_100000210340_100011219619 [0,1,0,0,0,1|1,0,1]=4 3965 B12R1.27 OCC(O)CSc1ccccc1 62a_100000719477_100011219619 [0,1,0,0,0,1|1,0,1]=4 3966 B12R1.27 OCC(O)CSc1ccccc1 62a_100011219619_100000041952 [0,1,0,0,0,1|1,0,1]=4 3967 B12R1.27 OC[C@H](O)CNc1ccccc1 34a_100000106764_100009815848 [0,1,0,0,0,1|1,0,1]=4 3968 B12R1.27 OC[C@H](O)COc1ccccc1 34a_100000210340_100009815848 [0,1,0,0,0,1|1,0,1]=4 3969 B12R1.27 OC[C@H](O)COc1ccccc1 7a_100000210340_100009815848 [0,1,0,0,0,1|1,0,1]=4 3970 B12R1.27 OC[C@H](O)CSc1ccccc1 62a_100000719477_100009815848 [0,1,0,0,0,1|1,0,1]=4 3971 B12R1.27 OC[C@H](O)CSc1ccccc1 62a_100009815848_100000041952 [0,1,0,0,0,1|1,0,1]=4 3972 B12R1.27 O[C@@H](CF)CNc1ccccc1 34a_100000106764_100015614560 [0,1,0,0,0,1|1,0,1]=4 3973 B12R1.27 O[C@@H](CF)COc1ccccc1 34a_100000210340_100015614560 [0,1,0,0,0,1|1,0,1]=4 3974 B12R1.27 O[C@@H](CF)COc1ccccc1 7a_100000210340_100015614560 [0,1,0,0,0,1|1,0,1]=4 3975 B12R1.27 O[C@@H](CF)CSc1ccccc1 62a_100000719477_100015614560 [0,1,0,0,0,1|1,0,1]=4 3976 B12R1.27 O[C@@H](CF)CSc1ccccc1 62a_100015614560_100000041952 [0,1,0,0,0,1|1,0,1]=4 3977 B12R1.43 C/C(=C\c1ccccc1)/C(=O)[13CH3] 1458a_100016990649_200025704644 [0,1,0,0,0,1|1,0,1]=4 3978 B12R1.43 C=C(Br)C(=O)Nc1ccccc1 11a_100000106764_100009813364 [0,1,0,0,0,1|1,0,1]=4 3979 B12R1.43 C=C(Br)C(=O)Nc1ccccc1 1626a_100000106764_100009813364 [0,1,0,0,0,1|1,0,1]=4 3980 B12R1.43 C=C(C)C(=O)Cc1ccccc1 1458a_100000185857_100015291786 [0,1,0,0,0,1|0,0,0]=2 3981 B12R1.43 C=C(C)C(=O)Cc1ccccn1 1458a_100000185857_100000721315 [0,1,0,0,0,1|1,0,0]=3 3982 B12R1.43 C=C(C)C(=O)Cc1cccnc1 1458a_100000185857_100000733263 [0,1,0,0,0,1|1,0,0]=3 3983 B12R1.43 C=C(C)C(=O)Cc1cccnn1 1458a_100000185857_100016990269 [0,1,0,0,0,1|2,0,0]=4 3984 B12R1.43 C=C(C)C(=O)Cc1ccncc1 1458a_100000185857_100000705612 [0,1,0,0,0,1|1,0,0]=3 3985 B12R1.43 C=C(C)C(=O)Cc1cnccn1 1458a_100000185857_100016995436 [0,1,0,0,0,1|2,0,0]=4 3986 B12R1.43 C=C(C)C(=O)Cc1cncnc1 1458a_100000185857_100015196519 [0,1,0,0,0,1|2,0,0]=4 3987 B12R1.43 C=C(C)C(=O)Cc1ncccn1 1458a_100000185857_100000703007 [0,1,0,0,0,1|2,0,0]=4 3988 B12R1.43 C=C(C)C(=O)Nc1ccccc1 11a_100000106764_100000185857 [0,1,0,0,0,1|0,0,1]=3 3989 B12R1.43 C=C(C)C(=O)Nc1ccccc1 1626a_100000106764_100000185857 [0,1,0,0,0,1|0,0,1]=3 3990 B12R1.43 C=C(C)C(=O)Nc1ccccc1 22a_100000106764_100000185857 [0,1,0,0,0,1|0,0,1]=3 3991 B12R1.43 C=C(Cl)C(=O)Nc1ccccc1 11a_100000106764_100000039160 [0,1,0,0,0,1|1,0,1]=4 3992 B12R1.43 C=C(Cl)C(=O)Nc1ccccc1 1626a_100000106764_100000039160 [0,1,0,0,0,1|1,0,1]=4 3993 B12R1.43 C=C(Cl)C(=O)Nc1ccccc1 22a_100000106764_100000039160 [0,1,0,0,0,1|1,0,1]=4 3994 B12R1.43 C=C(F)C(=O)Nc1ccccc1 11a_100000106764_100000036797 [0,1,0,0,0,1|1,0,1]=4 3995 B12R1.43 C=C(F)C(=O)Nc1ccccc1 1626a_100000106764_100000036797 [0,1,0,0,0,1|1,0,1]=4 3996 B12R1.43 C=C(F)C(=O)Nc1ccccc1 22a_100000106764_100000036797 [0,1,0,0,0,1|1,0,1]=4 3997 B12R1.43 CC(=O)/C(=C/c1ccccc1)/C 1458a_100016990649_200000210301 [0,1,0,0,0,1|1,0,1]=4 3998 B12R1.43 CC(=O)/C(=C/c1ccccc1)/Cl 1458a_200020598536_200000210301 [0,1,0,0,0,1|1,0,1]=4 3999 B12R1.43 CC(=O)/C(=C\c1ccccc1)/F 1458a_100020889036_200000210301 [0,1,0,0,0,1|1,0,1]=4 4000 B12R1.43 CC(=O)C(=O)Nc1ccccc1 1458a_100000738435_200000210301 [0,1,0,0,0,1|1,0,1]=4 4001 B12R1.43 CC(=O)C(C)Cc1ccccc1 1458a_100000070787_200011218536 [0,1,0,0,0,1|1,0,0]=3 4002 B12R1.43 CC(=O)C(C)Cc1ccccc1 1458a_100000754839_200000210301 [0,1,0,0,0,1|1,0,0]=3 4003 B12R1.43 CC(=O)C(C)Cc1ccccn1 1458a_100012000792_200000210301 [0,1,0,0,0,1|2,0,0]=4 4004 B12R1.43 CC(=O)C(C)Oc1ccccc1 1458a_100000188414_200000210301 [0,1,0,0,0,1|1,0,0]=3 4005 B12R1.43 CC(=O)C(C)Oc1ccccc1 7a_100000210340_100000179758 [0,1,0,0,0,1|1,0,0]=3 4006 B12R1.43 CC(=O)C(C)Oc1cccnc1 7a_100000210849_100000179758 [0,1,0,0,0,1|2,0,0]=4 4007 B12R1.43 CC(=O)C(C)Sc1ccccc1 1458a_100000199063_200000210301 [0,1,0,0,0,1|1,0,0]=3 4008 B12R1.43 CC(=O)C(C)Sc1ccccc1 62a_100000719477_100009814033 [0,1,0,0,0,1|1,0,0]=3 4009 B12R1.43 CC(=O)C(C)Sc1ccccc1 62a_100009814033_100000041952 [0,1,0,0,0,1|1,0,0]=3 4010 B12R1.43 CC(=O)C(C)Sc1ccccn1 1458a_100000156770_200000210301 [0,1,0,0,0,1|2,0,0]=4 4011 B12R1.43 CC(=O)C(C)Sc1ccccn1 62a_100009814033_100011216584 [0,1,0,0,0,1|2,0,0]=4 4012 B12R1.43 CC(=O)C(C)Sc1ccccn1 62a_100011216584_100009814033 [0,1,0,0,0,1|2,0,0]=4 4013 B12R1.43 CC(=O)C(C)Sc1cccnc1 62a_100000210063_100009814033 [0,1,0,0,0,1|2,0,0]=4 4014 B12R1.43 CC(=O)C(C)Sc1cccnc1 62a_100009814033_100000210063 [0,1,0,0,0,1|2,0,0]=4 4015 B12R1.43 CC(=O)C(C)Sc1ccncc1 62a_100000728582_100009814033 [0,1,0,0,0,1|2,0,0]=4 4016 B12R1.43 CC(=O)C(C)Sc1ccncc1 62a_100009814033_100000728582 [0,1,0,0,0,1|2,0,0]=4 4017 B12R1.43 CC(=O)N(C)Cc1ccccc1 11a_100000186898_100015343762 [0,1,0,0,0,1|1,0,0]=3 4018 B12R1.43 CC(=O)N(C)Cc1ccccc1 1626a_100000186898_100015343762 [0,1,0,0,0,1|1,0,0]=3 4019 B12R1.43 CC(=O)N(C)Cc1ccccc1 240690a_100000186898_100015343762 [0,1,0,0,0,1|1,0,0]=3 4020 B12R1.43 CC(=O)N(C)Cc1ccccc1 527a_100000186898_100103153847 [0,1,0,0,0,1|1,0,0]=3 4021 B12R1.43 CC(=O)N(C)Cc1ccccn1 11a_100000207498_100015343762 [0,1,0,0,0,1|2,0,0]=4 4022 B12R1.43 CC(=O)N(C)Cc1ccccn1 240690a_100000207498_100015343762 [0,1,0,0,0,1|2,0,0]=4 4023 B12R1.43 CC(=O)N(C)Cc1ccccn1 527a_100000207498_100103153847 [0,1,0,0,0,1|2,0,0]=4 4024 B12R1.43 CC(=O)N(C)Cc1cccnc1 11a_100000184577_100015343762 [0,1,0,0,0,1|2,0,0]=4 4025 B12R1.43 CC(=O)N(C)Cc1cccnc1 240690a_100000184577_100015343762 [0,1,0,0,0,1|2,0,0]=4 4026 B12R1.43 CC(=O)N(C)Cc1cccnc1 527a_100000184577_100103153847 [0,1,0,0,0,1|2,0,0]=4 4027 B12R1.43 CC(=O)N(C)Cc1ccncc1 11a_100000187231_100015343762 [0,1,0,0,0,1|2,0,0]=4 4028 B12R1.43 CC(=O)N(C)Cc1ccncc1 240690a_100000187231_100015343762 [0,1,0,0,0,1|2,0,0]=4 4029 B12R1.43 CC(=O)N(C)Cc1ccncc1 527a_100000187231_100103153847 [0,1,0,0,0,1|2,0,0]=4 4030 B12R1.43 CC(=O)[C@H](O)Cc1ccccc1 1458a_100009816399_200000210301 [0,1,0,0,0,1|1,0,0]=3 4031 B12R1.43 CC(C)C(=O)Cc1ccccc1 1458a_100000210198_100015291786 [0,1,0,0,0,1|0,0,2]=4 4032 B12R1.43 CC(C)N(C)Cc1ccccc1 2230a_100000068392_200000210301 [0,1,0,0,0,1|0,0,2]=4 4033 B12R1.43 CC(C)N(C)Cc1ccccc1 2230a_100000186898_100000210206 [0,1,0,0,0,1|0,0,2]=4 4034 B12R1.43 CC(C)N(C)Cc1ccccc1 269982a_100000068392_200000210301 [0,1,0,0,0,1|0,0,2]=4 4035 B12R1.43 CC(C)N(C)Cc1ccccc1 269982a_100000186898_100000210206 [0,1,0,0,0,1|0,0,2]=4 4036 B12R1.43 CC(C)N(C)Cc1ccccc1 269982a_200000211004_100000211182 [0,1,0,0,0,1|0,0,2]=4 4037 B12R1.43 CC(C)N(C)Cc1ccccc1 270004a_200000211004_100015611070 [0,1,0,0,0,1|0,0,2]=4 4038 B12R1.43 CC(C)N([13CH3])Cc1ccccc1 2230a_100000068392_200025704644 [0,1,0,0,0,1|0,0,2]=4 4039 B12R1.43 CC(C)N([13CH3])Cc1ccccc1 269982a_100000068392_200025704644 [0,1,0,0,0,1|0,0,2]=4 4040 B12R1.43 CC(Cc1ccccc1)C(=O)[13CH3] 1458a_100000754839_200025704644 [0,1,0,0,0,1|1,0,0]=3 4041 B12R1.43 CC(Cc1ccccc1)N(C)C 269982a_100102631434_200011218536 [0,1,0,0,0,1|1,0,1]=4 4042 B12R1.43 CC(Cc1ccccn1)C(=O)[13CH3] 1458a_100012000792_200025704644 [0,1,0,0,0,1|2,0,0]=4 4043 B12R1.43 CC(F)C(=O)Cc1ccccc1 1458a_100000062450_100015291786 [0,1,0,0,0,1|1,0,1]=4 4044 B12R1.43 CC(Nc1ccccc1)C(=O)N 34a_100000106764_100000702099 [0,1,0,0,0,1|2,0,0]=4 4045 B12R1.43 CC(Oc1ccccc1)C(=O)N 34a_100000210340_100000702099 [0,1,0,0,0,1|2,0,0]=4 4046 B12R1.43 CC(Oc1ccccc1)C(=O)N 7a_100000210340_100000702099 [0,1,0,0,0,1|2,0,0]=4 4047 B12R1.43 CC(Oc1ccccc1)C(=O)[13CH3] 1458a_100000188414_200025704644 [0,1,0,0,0,1|1,0,0]=3 4048 B12R1.43 CC(Sc1ccccc1)C(=O)N 62a_100000702099_100000041952 [0,1,0,0,0,1|2,0,0]=4 4049 B12R1.43 CC(Sc1ccccc1)C(=O)N 62a_100000719477_100000702099 [0,1,0,0,0,1|2,0,0]=4 4050 B12R1.43 CC(Sc1ccccc1)C(=O)[13CH3] 1458a_100000199063_200025704644 [0,1,0,0,0,1|1,0,0]=3 4051 B12R1.43 CC(Sc1ccccn1)C(=O)[13CH3] 1458a_100000156770_200025704644 [0,1,0,0,0,1|2,0,0]=4 4052 B12R1.43 C[C@@H](O)C(=O)Cc1ccccc1 1458a_100000717761_100015291786 [0,1,0,0,0,1|1,0,1]=4 4053 B12R1.43 C[C@H](O)C(=O)Cc1ccccc1 1458a_217856618621_100015291786 [0,1,0,0,0,1|1,0,1]=4 4054 B12R1.43 NC(=O)C(F)Nc1ccccc1 34a_100000106764_100009813875 [0,1,0,0,0,1|2,0,0]=4 4055 B12R1.43 NC(=O)C(F)Oc1ccccc1 34a_100000210340_100009813875 [0,1,0,0,0,1|2,0,0]=4 4056 B12R1.43 NC(=O)C(F)Oc1ccccc1 7a_100000210340_100009813875 [0,1,0,0,0,1|2,0,0]=4 4057 B12R1.43 NC(=O)C(F)Sc1ccccc1 62a_100000719477_100009813875 [0,1,0,0,0,1|2,0,0]=4 4058 B12R1.43 NC(=O)C(F)Sc1ccccc1 62a_100009813875_100000041952 [0,1,0,0,0,1|2,0,0]=4 4059 B12R1.43 O=C([O-])C(F)Nc1ccccc1 34a_100000106764_100020610796 [0,1,0,0,0,1|2,0,0]=4 4060 B12R1.43 O=C([O-])C(F)Oc1ccccc1 34a_100000210340_100020610796 [0,1,0,0,0,1|2,0,0]=4 4061 B12R1.43 O=C([O-])C(F)Sc1ccccc1 62a_100000719477_100020610796 [0,1,0,0,0,1|2,0,0]=4 4062 B12R1.43 O=C([O-])C(F)Sc1ccccc1 62a_100020610796_100000041952 [0,1,0,0,0,1|2,0,0]=4 4063 B12R1.43 [13CH3]C(=O)/C(=C/c1ccccc1)/Cl 1458a_200020598536_200025704644 [0,1,0,0,0,1|1,0,1]=4 4064 B12R1.43 [13CH3]C(=O)/C(=C\c1ccccc1)/F 1458a_100020889036_200025704644 [0,1,0,0,0,1|1,0,1]=4 4065 B12R1.43 [13CH3]C(=O)C(=O)Nc1ccccc1 1458a_100000738435_200025704644 [0,1,0,0,0,1|1,0,1]=4 4066 B12R1.43 [13CH3]C(=O)[C@H](O)Cc1ccccc1 1458a_100009816399_200025704644 [0,1,0,0,0,1|1,0,0]=3 4067 B12R1.107 C=C(C)CC(=O)c1ccccc1 1458a_100000185807_100000748629 [0,1,0,0,0,1|0,0,0]=2 4068 B12R1.107 C=C(C)CN(C)c1ccccc1 2230a_100000210012_100000748629 [0,1,0,0,0,1|0,0,0]=2 4069 B12R1.107 C=C(C)CN(C)c1ccccc1 269982a_100000210012_100000748629 [0,1,0,0,0,1|0,0,0]=2 4070 B12R1.107 C=C(C)CN(C)c1ccccc1 34a_100000210012_100000748629 [0,1,0,0,0,1|0,0,0]=2 4071 B12R1.107 C=C(C)CN(C)c1cccnn1 27a_100000225649_100016991348 [0,1,0,0,0,1|2,0,0]=4 4072 B12R1.107 C=C(C)CN(C)c1ccncn1 27a_100000225649_100000703185 [0,1,0,0,0,1|2,0,0]=4 4073 B12R1.107 C=C(C)CN(C)c1cnccn1 27a_100000225649_100000211759 [0,1,0,0,0,1|2,0,0]=4 4074 B12R1.107 C=C(C)CN(C)c1ncccn1 27a_100000225649_100000211032 [0,1,0,0,0,1|2,0,0]=4 4075 B12R1.107 C=C(F)CC(=O)c1ccccc1 1458a_100000185807_100009893438 [0,1,0,0,0,1|1,0,0]=3 4076 B12R1.107 C=C(F)CN(C)c1ccccc1 2230a_100000210012_100009893438 [0,1,0,0,0,1|1,0,0]=3 4077 B12R1.107 C=C(F)CN(C)c1ccccc1 269982a_100000210012_100009893438 [0,1,0,0,0,1|1,0,0]=3 4078 B12R1.107 C=C(F)CN(C)c1ccccc1 34a_100000210012_100009893438 [0,1,0,0,0,1|1,0,0]=3 4079 B12R1.107 CC(=CC(=O)[13CH3])c1ccccc1 1458a_100000743005_200025704644 [0,1,0,0,0,1|1,0,1]=4 4080 B12R1.107 CC(=O)C=C(C)c1ccccc1 1458a_100000743005_200000210301 [0,1,0,0,0,1|1,0,1]=4 4081 B12R1.107 CC(=O)CC(=O)c1ccccc1 1458a_100000070787_100000211460 [0,1,0,0,0,1|1,0,0]=3 4082 B12R1.107 CC(=O)CC(=O)c1ccccn1 1458a_100000070787_100000027445 [0,1,0,0,0,1|2,0,0]=4 4083 B12R1.107 CC(=O)CC(=O)c1cccnc1 1458a_100000070787_100015188593 [0,1,0,0,0,1|2,0,0]=4 4084 B12R1.107 CC(=O)CC(=O)c1ccncc1 1458a_100000070787_100000027454 [0,1,0,0,0,1|2,0,0]=4 4085 B12R1.107 CC(=O)CC(C)c1ccccc1 1458a_100000070787_100000756946 [0,1,0,0,0,1|1,0,0]=3 4086 B12R1.107 CC(=O)CC(C)c1ccccc1 1458a_100000183687_200000210301 [0,1,0,0,0,1|1,0,0]=3 4087 B12R1.107 CC(=O)CC(O)c1ccccc1 1458a_100000070787_100000185958 [0,1,0,0,0,1|1,0,0]=3 4088 B12R1.107 CC(=O)CC(O)c1ccccc1 1458a_100000690199_200000210301 [0,1,0,0,0,1|1,0,0]=3 4089 B12R1.107 CC(=O)CN(C)c1ccccc1 1458a_100000745425_200000210301 [0,1,0,0,0,1|1,0,0]=3 4090 B12R1.107 CC(=O)C[C@@H](O)c1ccccc1 1458a_100000070787_100011933945 [0,1,0,0,0,1|1,0,0]=3 4091 B12R1.107 CC(=O)NC(C)c1ccccn1 11a_100000181244_100015343762 [0,1,0,0,0,1|2,0,0]=4 4092 B12R1.107 CC(=O)NC(C)c1ccccn1 1626a_100000181244_100015343762 [0,1,0,0,0,1|2,0,0]=4 4093 B12R1.107 CC(=O)NC(C)c1ccccn1 240690a_100000181244_100015343762 [0,1,0,0,0,1|2,0,0]=4 4094 B12R1.107 CC(=O)NC(C)c1ccccn1 527a_100000181244_100103153847 [0,1,0,0,0,1|2,0,0]=4 4095 B12R1.107 CC(=O)NC(C)c1cccnc1 11a_100000195435_100015343762 [0,1,0,0,0,1|2,0,0]=4 4096 B12R1.107 CC(=O)NC(C)c1cccnc1 240690a_100000195435_100015343762 [0,1,0,0,0,1|2,0,0]=4 4097 B12R1.107 CC(=O)NC(C)c1cccnc1 527a_100000195435_100103153847 [0,1,0,0,0,1|2,0,0]=4 4098 B12R1.107 CC(=O)NC(C)c1ccncc1 240690a_100000181269_100015343762 [0,1,0,0,0,1|2,0,0]=4 4099 B12R1.107 CC(=O)NC(C)c1ccncc1 527a_100000181269_100103153847 [0,1,0,0,0,1|2,0,0]=4 4100 B12R1.107 CC(=O)N[C@H](C)c1ccccc1 11a_100000751104_100015343762 [0,1,0,0,0,1|1,0,0]=3 4101 B12R1.107 CC(=O)N[C@H](C)c1ccccc1 1626a_100000751104_100015343762 [0,1,0,0,0,1|1,0,0]=3 4102 B12R1.107 CC(=O)N[C@H](C)c1ccccc1 240690a_100000751104_100015343762 [0,1,0,0,0,1|1,0,0]=3 4103 B12R1.107 CC(=O)N[C@H](C)c1ccccc1 527a_100000751104_100103153847 [0,1,0,0,0,1|1,0,0]=3 4104 B12R1.107 CC(C)CC(=O)c1ccccc1 1458a_100000185807_100000210624 [0,1,0,0,0,1|0,0,2]=4 4105 B12R1.107 CC(C)CN(C)c1ccccc1 2230a_100000210012_100000210760 [0,1,0,0,0,1|0,0,2]=4 4106 B12R1.107 CC(C)CN(C)c1ccccc1 269982a_100000210012_100000210624 [0,1,0,0,0,1|0,0,2]=4 4107 B12R1.107 CC(C)CN(C)c1ccccc1 34a_100000210012_100000210624 [0,1,0,0,0,1|0,0,2]=4 4108 B12R1.107 CC(C)C[C@H](N)c1ccccc1 271570a_100015190218_100000210277 [0,1,0,0,0,1|0,0,2]=4 4109 B12R1.107 CC(C)NC(C)c1ccccc1 2230a_100138425928_100000230085 [0,1,0,0,0,1|0,0,2]=4 4110 B12R1.107 CC(C)NC(C)c1ccccc1 34a_100138425928_100000211855 [0,1,0,0,0,1|0,0,2]=4 4111 B12R1.107 CC(C)N[C@H](C)c1ccccc1 2230a_100000751104_100000210206 [0,1,0,0,0,1|0,0,2]=4 4112 B12R1.107 CC(C)OC(C)c1ccccc1 34a_100000212225_100000211855 [0,1,0,0,0,1|0,0,2]=4 4113 B12R1.107 CC(C)O[C@H](C)c1ccccc1 34a_100000761318_100000210206 [0,1,0,0,0,1|0,0,2]=4 4114 B12R1.107 CC(C)O[C@H](C)c1ccccc1 7a_100000761318_100000210206 [0,1,0,0,0,1|0,0,2]=4 4115 B12R1.107 CC(C)SC(C)c1ccccc1 62a_100000210206_100000230085 [0,1,0,0,0,1|0,0,2]=4 4116 B12R1.107 CC(C)SC(C)c1ccccc1 62a_100000230085_100000210206 [0,1,0,0,0,1|0,0,2]=4 4117 B12R1.107 CC(CC(=O)[13CH3])c1ccccc1 1458a_100000183687_200025704644 [0,1,0,0,0,1|1,0,0]=3 4118 B12R1.107 CC(CN(C)C)c1ccccc1 2230a_100102631434_100000756946 [0,1,0,0,0,1|1,0,1]=4 4119 B12R1.107 CC(CN(C)C)c1ccccc1 269982a_100102631434_100000756946 [0,1,0,0,0,1|1,0,1]=4 4120 B12R1.107 CC(CN(C)C)c1ccccc1 270004a_100102631434_100000212034 [0,1,0,0,0,1|1,0,1]=4 4121 B12R1.107 CC(O)CC(=O)c1ccccc1 1458a_100000185807_100011218427 [0,1,0,0,0,1|1,0,1]=4 4122 B12R1.107 CC(O)CN(C)c1ccccc1 2230a_100000210012_100011218427 [0,1,0,0,0,1|1,0,1]=4 4123 B12R1.107 CC(O)CN(C)c1ccccc1 269982a_100000210012_100011218427 [0,1,0,0,0,1|1,0,1]=4 4124 B12R1.107 CC(O)CN(C)c1ccccc1 34a_100000210012_100011218427 [0,1,0,0,0,1|1,0,1]=4 4125 B12R1.107 CN(C)CC(=O)c1ccccc1 269982a_100102631434_100000211460 [0,1,0,0,0,1|1,0,1]=4 4126 B12R1.107 CN(C)CC(O)c1ccccc1 2230a_100000227976_200000210301 [0,1,0,0,0,1|1,0,1]=4 4127 B12R1.107 CN(C)CC(O)c1ccccc1 2230a_100102631434_100000185958 [0,1,0,0,0,1|1,0,1]=4 4128 B12R1.107 CN(C)CC(O)c1ccccc1 269982a_100000227976_200000210301 [0,1,0,0,0,1|1,0,1]=4 4129 B12R1.107 CN(C)CS(=O)c1ccccc1 269982a_100102631434_100000031784 [0,1,0,0,0,1|1,0,1]=4 4130 B12R1.107 CN(C)C[C@@H](O)c1ccccc1 2230a_100102631434_100011933945 [0,1,0,0,0,1|1,0,1]=4 4131 B12R1.107 CN(CC(=O)N)c1ccccc1 2230a_100000210012_100000747473 [0,1,0,0,0,1|2,0,0]=4 4132 B12R1.107 CN(CC(=O)N)c1ccccc1 2230a_100000212578_200000210301 [0,1,0,0,0,1|2,0,0]=4 4133 B12R1.107 CN(CC(=O)N)c1ccccc1 269982a_100000210012_100000187820 [0,1,0,0,0,1|2,0,0]=4 4134 B12R1.107 CN(CC(=O)N)c1ccccc1 269982a_100000212578_200000210301 [0,1,0,0,0,1|2,0,0]=4 4135 B12R1.107 CN(CC(=O)N)c1ccccc1 34a_100000210012_100000187820 [0,1,0,0,0,1|2,0,0]=4 4136 B12R1.107 CN(CC(=O)O)c1ccccc1 269956a_100000212060_200000210301 [0,1,0,0,0,1|2,0,0]=4 4137 B12R1.107 CN(CC(=O)[13CH3])c1ccccc1 1458a_100000745425_200025704644 [0,1,0,0,0,1|1,0,0]=3 4138 B12R1.107 CN(CC(=O)[O-])c1ccccc1 269982a_100000210012_100020667443 [0,1,0,0,0,1|2,0,0]=4 4139 B12R1.107 CN(CC(=O)[O-])c1ccccc1 34a_100000210012_100020667443 [0,1,0,0,0,1|2,0,0]=4 4140 B12R1.107 CN([13CH3])CC(O)c1ccccc1 2230a_100000227976_200025704644 [0,1,0,0,0,1|1,0,1]=4 4141 B12R1.107 CN([13CH3])CC(O)c1ccccc1 269982a_100000227976_200025704644 [0,1,0,0,0,1|1,0,1]=4 4142 B12R1.107 C[C@@H](O)CN(C)c1ccccc1 2230a_100000210012_100009817552 [0,1,0,0,0,1|1,0,1]=4 4143 B12R1.107 C[C@@H](O)CN(C)c1ccccc1 269982a_100000210012_100009817552 [0,1,0,0,0,1|1,0,1]=4 4144 B12R1.107 C[C@@H](O)CN(C)c1ccccc1 34a_100000210012_100009817552 [0,1,0,0,0,1|1,0,1]=4 4145 B12R1.107 NC(=O)CC(=O)c1ccccc1 1458a_100000185807_100000187820 [0,1,0,0,0,1|2,0,0]=4 4146 B12R1.107 O=C([O-])CC(=O)c1ccccc1 1458a_100000185807_100020667443 [0,1,0,0,0,1|2,0,0]=4 4147 B12R1.107 [13CH3]C(=O)CC(O)c1ccccc1 1458a_100000690199_200025704644 [0,1,0,0,0,1|1,0,0]=3 4148 B12R1.107 [13CH3]N(CC(=O)N)c1ccccc1 2230a_100000212578_200025704644 [0,1,0,0,0,1|2,0,0]=4 4149 B12R1.107 [13CH3]N(CC(=O)N)c1ccccc1 269982a_100000212578_200025704644 [0,1,0,0,0,1|2,0,0]=4 4150 B12R1.107 [13CH3]N(CC(=O)O)c1ccccc1 269956a_100000212060_200025704644 [0,1,0,0,0,1|2,0,0]=4 4151 B12R1.125 C=C(C)CNc1ccccc1Br 34a_100000210017_100000748629 [0,1,0,0,0,1|0,0,0]=2 4152 B12R1.125 C=C(C)CNc1ccccc1C 34a_100015192222_100000748629 [0,1,0,0,0,1|0,0,0]=2 4153 B12R1.125 C=C(C)CNc1ccccc1Cl 34a_100000185783_100000748629 [0,1,0,0,0,1|0,0,0]=2 4154 B12R1.125 C=C(C)CNc1ccccc1F 34a_100000210422_100000748629 [0,1,0,0,0,1|0,0,0]=2 4155 B12R1.125 C=C(C)CNc1ccccc1I 34a_100000210053_100000748629 [0,1,0,0,0,1|0,0,0]=2 4156 B12R1.125 C=C(C)CNc1ccccc1O 34a_100000185747_100000748629 [0,1,0,0,0,1|0,0,0]=2 4157 B12R1.125 C=C(C)CNc1ccn[nH]c1=O 27a_100000765925_100000087129 [0,1,0,0,0,1|2,0,0]=4 4158 B12R1.125 C=C(C)CNc1ccncc1Br 27a_100000765925_100000726257 [0,1,0,0,0,1|1,0,0]=3 4159 B12R1.125 C=C(C)CNc1ccncc1C 27a_100000765925_100000765111 [0,1,0,0,0,1|1,0,0]=3 4160 B12R1.125 C=C(C)CNc1ccncc1F 27a_100000765925_100000035921 [0,1,0,0,0,1|1,0,0]=3 4161 B12R1.125 C=C(C)CNc1ncccc1Br 27a_100000765925_100000696092 [0,1,0,0,0,1|1,0,0]=3 4162 B12R1.125 C=C(C)CNc1nccnc1C 27a_100000765925_100011999405 [0,1,0,0,0,1|2,0,0]=4 4163 B12R1.125 C=C(C)CNc1nccnc1F 27a_100000765925_200010125657 [0,1,0,0,0,1|2,0,0]=4 4164 B12R1.125 C=C(C)CNc1ncncc1C 27a_100000765925_100011998708 [0,1,0,0,0,1|2,0,0]=4 4165 B12R1.125 C=C(C)CNc1ncncc1F 27a_100000765925_100000069762 [0,1,0,0,0,1|2,0,0]=4 4166 B12R1.125 C=C(C)CNc1ncncc1N 27a_100000765925_100000709731 [0,1,0,0,0,1|2,0,0]=4 4167 B12R1.125 C=C(C)CNc1nnccc1C 27a_100000765925_100000089043 [0,1,0,0,0,1|2,0,0]=4 4168 B12R1.125 C=C(C)COc1cccc[n+]1[O-] 7a_100000211761_100000748629 [0,1,0,0,0,1|1,0,0]=3 4169 B12R1.125 C=C(C)COc1ccccc1Br 34a_100000181306_100000748629 [0,1,0,0,0,1|0,0,0]=2 4170 B12R1.125 C=C(C)COc1ccccc1Br 7a_100000181306_100000748629 [0,1,0,0,0,1|0,0,0]=2 4171 B12R1.125 C=C(C)COc1ccccc1C 34a_100000210338_100000748629 [0,1,0,0,0,1|0,0,0]=2 4172 B12R1.125 C=C(C)COc1ccccc1C 7a_100000210338_100000748629 [0,1,0,0,0,1|0,0,0]=2 4173 B12R1.125 C=C(C)COc1ccccc1Cl 34a_100000210172_100000748629 [0,1,0,0,0,1|0,0,0]=2 4174 B12R1.125 C=C(C)COc1ccccc1Cl 7a_100000210172_100000748629 [0,1,0,0,0,1|0,0,0]=2 4175 B12R1.125 C=C(C)COc1ccccc1F 34a_100000210171_100000748629 [0,1,0,0,0,1|0,0,0]=2 4176 B12R1.125 C=C(C)COc1ccccc1F 7a_100000210171_100000748629 [0,1,0,0,0,1|0,0,0]=2 4177 B12R1.125 C=C(C)COc1ccccc1I 34a_100000739446_100000748629 [0,1,0,0,0,1|0,0,0]=2 4178 B12R1.125 C=C(C)COc1ccccc1I 7a_100000739446_100000748629 [0,1,0,0,0,1|0,0,0]=2 4179 B12R1.125 C=C(C)COc1ccccc1N 34a_100000185747_100000748629 [0,1,0,0,0,1|0,0,0]=2 4180 B12R1.125 C=C(C)COc1ccccc1N 7a_100000185747_100000748629 [0,1,0,0,0,1|0,0,0]=2 4181 B12R1.125 C=C(C)COc1cccnc1Br 34a_100000744436_100000748629 [0,1,0,0,0,1|1,0,0]=3 4182 B12R1.125 C=C(C)COc1cccnc1Br 7a_100000744436_100000748629 [0,1,0,0,0,1|1,0,0]=3 4183 B12R1.125 C=C(C)COc1cccnc1C 34a_100000745507_100000748629 [0,1,0,0,0,1|1,0,0]=3 4184 B12R1.125 C=C(C)COc1cccnc1C 7a_100000745507_100000748629 [0,1,0,0,0,1|1,0,0]=3 4185 B12R1.125 C=C(C)COc1cccnc1Cl 34a_100000757616_100000748629 [0,1,0,0,0,1|1,0,0]=3 4186 B12R1.125 C=C(C)COc1cccnc1Cl 7a_100000757616_100000748629 [0,1,0,0,0,1|1,0,0]=3 4187 B12R1.125 C=C(C)COc1cccnc1F 34a_100000061740_100000748629 [0,1,0,0,0,1|1,0,0]=3 4188 B12R1.125 C=C(C)COc1cccnc1F 7a_100000061740_100000748629 [0,1,0,0,0,1|1,0,0]=3 4189 B12R1.125 C=C(C)COc1cccnc1I 34a_100000034122_100000748629 [0,1,0,0,0,1|1,0,0]=3 4190 B12R1.125 C=C(C)COc1cccnc1I 7a_100000034122_100000748629 [0,1,0,0,0,1|1,0,0]=3 4191 B12R1.125 C=C(C)COc1cccnc1N 34a_100000211975_100000748629 [0,1,0,0,0,1|1,0,0]=3 4192 B12R1.125 C=C(C)COc1cccnc1N 7a_100000211975_100000748629 [0,1,0,0,0,1|1,0,0]=3 4193 B12R1.125 C=C(C)COc1cccoc1=O 34a_100000077404_100000748629 [0,1,0,0,0,1|1,0,0]=3 4194 B12R1.125 C=C(C)COc1cccoc1=O 7a_100000077404_100000748629 [0,1,0,0,0,1|1,0,0]=3 4195 B12R1.125 C=C(C)COc1ccncc1Br 34a_100011996408_100000748629 [0,1,0,0,0,1|1,0,0]=3 4196 B12R1.125 C=C(C)COc1ccncc1C 34a_100000694293_100000748629 [0,1,0,0,0,1|1,0,0]=3 4197 B12R1.125 C=C(C)COc1ccncc1Cl 34a_100011997054_100000748629 [0,1,0,0,0,1|1,0,0]=3 4198 B12R1.125 C=C(C)COc1ccncc1F 34a_200000081243_100000748629 [0,1,0,0,0,1|1,0,0]=3 4199 B12R1.125 C=C(C)COc1cnccc1C 34a_100011997053_100000748629 [0,1,0,0,0,1|1,0,0]=3 4200 B12R1.125 C=C(C)COc1cnccc1C 7a_100011997053_100000748629 [0,1,0,0,0,1|1,0,0]=3 4201 B12R1.125 C=C(C)COc1cnccc1Cl 34a_100011996695_100000748629 [0,1,0,0,0,1|1,0,0]=3 4202 B12R1.125 C=C(C)COc1cnccc1I 34a_100000050107_100000748629 [0,1,0,0,0,1|1,0,0]=3 4203 B12R1.125 C=C(C)COc1cnccc1N 34a_100000753702_100000748629 [0,1,0,0,0,1|1,0,0]=3 4204 B12R1.125 C=C(C)COc1cncnc1N 7a_100000112926_100000748629 [0,1,0,0,0,1|2,0,0]=4 4205 B12R1.125 C=C(C)COc1coccc1=O 34a_100000060831_100000748629 [0,1,0,0,0,1|1,0,0]=3 4206 B12R1.125 C=C(C)COc1ncccc1Cl 34a_100011290957_100000748629 [0,1,0,0,0,1|1,0,0]=3 4207 B12R1.125 C=C(C)COc1ncccc1F 34a_100011219419_100000748629 [0,1,0,0,0,1|1,0,0]=3 4208 B12R1.125 C=C(C)COc1ncccc1N 34a_100000746358_100000748629 [0,1,0,0,0,1|1,0,0]=3 4209 B12R1.125 C=C(C)COc1nccnc1C 34a_100000766352_100000748629 [0,1,0,0,0,1|2,0,0]=4 4210 B12R1.125 C=C(C)CSc1c[nH]ccc1=O 62a_100000748629_100009998708 [0,1,0,0,0,1|1,0,0]=3 4211 B12R1.125 C=C(C)CSc1c[nH]ccc1=O 62a_100009998708_100000211660 [0,1,0,0,0,1|1,0,0]=3 4212 B12R1.125 C=C(C)CSc1c[nH]ccc1=S 62a_100000748629_200012280681 [0,1,0,0,0,1|1,0,0]=3 4213 B12R1.125 C=C(C)CSc1c[nH]ccc1=S 62a_200012280681_100000211660 [0,1,0,0,0,1|1,0,0]=3 4214 B12R1.125 C=C(C)CSc1cccc[n+]1C 62a_100000748629_100000212160 [0,1,0,0,0,1|1,0,0]=3 4215 B12R1.125 C=C(C)CSc1cccc[n+]1[O-] 62a_100000748629_200000042595 [0,1,0,0,0,1|1,0,0]=3 4216 B12R1.125 C=C(C)CSc1ccccc1Br 62a_100000695589_100000211660 [0,1,0,0,0,1|0,0,0]=2 4217 B12R1.125 C=C(C)CSc1ccccc1Br 62a_100000748629_100000695589 [0,1,0,0,0,1|0,0,0]=2 4218 B12R1.125 C=C(C)CSc1ccccc1C 62a_100000210755_100000211660 [0,1,0,0,0,1|0,0,0]=2 4219 B12R1.125 C=C(C)CSc1ccccc1C 62a_100000748629_100000210755 [0,1,0,0,0,1|0,0,0]=2 4220 B12R1.125 C=C(C)CSc1ccccc1Cl 62a_100000748629_100000764095 [0,1,0,0,0,1|0,0,0]=2 4221 B12R1.125 C=C(C)CSc1ccccc1Cl 62a_100000764095_100000211660 [0,1,0,0,0,1|0,0,0]=2 4222 B12R1.125 C=C(C)CSc1ccccc1F 62a_100000748629_100011215700 [0,1,0,0,0,1|0,0,0]=2 4223 B12R1.125 C=C(C)CSc1ccccc1F 62a_100011215700_100000211660 [0,1,0,0,0,1|0,0,0]=2 4224 B12R1.125 C=C(C)CSc1ccccc1N 62a_100000210017_100000211660 [0,1,0,0,0,1|0,0,0]=2 4225 B12R1.125 C=C(C)CSc1ccccc1N 62a_100000748629_100000210017 [0,1,0,0,0,1|0,0,0]=2 4226 B12R1.125 C=C(C)CSc1ccccc1O 62a_100000739446_100000211660 [0,1,0,0,0,1|0,0,0]=2 4227 B12R1.125 C=C(C)CSc1ccccc1O 62a_100000748629_100000739446 [0,1,0,0,0,1|0,0,0]=2 4228 B12R1.125 C=C(C)CSc1cccnc1Br 62a_100000748629_100010202626 [0,1,0,0,0,1|1,0,0]=3 4229 B12R1.125 C=C(C)CSc1cccnc1Br 62a_100010202626_100000211660 [0,1,0,0,0,1|1,0,0]=3 4230 B12R1.125 C=C(C)CSc1cccnc1C 62a_100000748629_100000751574 [0,1,0,0,0,1|1,0,0]=3 4231 B12R1.125 C=C(C)CSc1cccnc1C 62a_100000751574_100000211660 [0,1,0,0,0,1|1,0,0]=3 4232 B12R1.125 C=C(C)CSc1cccnc1Cl 62a_100000036424_100000211660 [0,1,0,0,0,1|1,0,0]=3 4233 B12R1.125 C=C(C)CSc1cccnc1Cl 62a_100000748629_100000036424 [0,1,0,0,0,1|1,0,0]=3 4234 B12R1.125 C=C(C)CSc1cccnc1F 62a_100000748629_100009816115 [0,1,0,0,0,1|1,0,0]=3 4235 B12R1.125 C=C(C)CSc1cccnc1F 62a_100009816115_100000211660 [0,1,0,0,0,1|1,0,0]=3 4236 B12R1.125 C=C(C)CSc1cccnc1N 62a_100000045569_100000211660 [0,1,0,0,0,1|1,0,0]=3 4237 B12R1.125 C=C(C)CSc1cccnc1N 62a_100000748629_100000045569 [0,1,0,0,0,1|1,0,0]=3 4238 B12R1.125 C=C(C)CSc1cccnc1O 62a_100000748629_100000760158 [0,1,0,0,0,1|1,0,0]=3 4239 B12R1.125 C=C(C)CSc1cccnc1O 62a_100000760158_100000211660 [0,1,0,0,0,1|1,0,0]=3 4240 B12R1.125 C=C(C)CSc1ccn[nH]c1=O 62a_100000748629_100000087129 [0,1,0,0,0,1|2,0,0]=4 4241 B12R1.125 C=C(C)CSc1ccncc1Br 62a_100000726257_100000211660 [0,1,0,0,0,1|1,0,0]=3 4242 B12R1.125 C=C(C)CSc1ccncc1Br 62a_100000748629_100000726257 [0,1,0,0,0,1|1,0,0]=3 4243 B12R1.125 C=C(C)CSc1ccncc1C 62a_100000748629_100000765111 [0,1,0,0,0,1|1,0,0]=3 4244 B12R1.125 C=C(C)CSc1ccncc1C 62a_100000765111_100000211660 [0,1,0,0,0,1|1,0,0]=3 4245 B12R1.125 C=C(C)CSc1ccncc1Cl 62a_100000708259_100000211660 [0,1,0,0,0,1|1,0,0]=3 4246 B12R1.125 C=C(C)CSc1ccncc1Cl 62a_100000748629_100000708259 [0,1,0,0,0,1|1,0,0]=3 4247 B12R1.125 C=C(C)CSc1ccncc1F 62a_100000047030_100000211660 [0,1,0,0,0,1|1,0,0]=3 4248 B12R1.125 C=C(C)CSc1ccncc1F 62a_100000748629_100000047030 [0,1,0,0,0,1|1,0,0]=3 4249 B12R1.125 C=C(C)CSc1ccncc1N 62a_100000748629_100000756074 [0,1,0,0,0,1|1,0,0]=3 4250 B12R1.125 C=C(C)CSc1ccncc1N 62a_100000756074_100000211660 [0,1,0,0,0,1|1,0,0]=3 4251 B12R1.125 C=C(C)CSc1ccncc1O 62a_100000748629_100009817591 [0,1,0,0,0,1|1,0,0]=3 4252 B12R1.125 C=C(C)CSc1ccncc1O 62a_100009817591_100000211660 [0,1,0,0,0,1|1,0,0]=3 4253 B12R1.125 C=C(C)CSc1cnccc1Br 62a_100000748629_100010138639 [0,1,0,0,0,1|1,0,0]=3 4254 B12R1.125 C=C(C)CSc1cnccc1Br 62a_100010138639_100000211660 [0,1,0,0,0,1|1,0,0]=3 4255 B12R1.125 C=C(C)CSc1cnccc1C 62a_100000748629_100000761580 [0,1,0,0,0,1|1,0,0]=3 4256 B12R1.125 C=C(C)CSc1cnccc1C 62a_100000761580_100000211660 [0,1,0,0,0,1|1,0,0]=3 4257 B12R1.125 C=C(C)CSc1cnccc1Cl 62a_100000748629_100009995489 [0,1,0,0,0,1|1,0,0]=3 4258 B12R1.125 C=C(C)CSc1cnccc1Cl 62a_100009995489_100000211660 [0,1,0,0,0,1|1,0,0]=3 4259 B12R1.125 C=C(C)CSc1cnccc1F 62a_100000748629_100009820683 [0,1,0,0,0,1|1,0,0]=3 4260 B12R1.125 C=C(C)CSc1cnccc1F 62a_100009820683_100000211660 [0,1,0,0,0,1|1,0,0]=3 4261 B12R1.125 C=C(C)CSc1cnccc1N 62a_100000047001_100000211660 [0,1,0,0,0,1|1,0,0]=3 4262 B12R1.125 C=C(C)CSc1cnccc1N 62a_100000748629_100000047001 [0,1,0,0,0,1|1,0,0]=3 4263 B12R1.125 C=C(C)CSc1cncnc1Br 62a_100000748629_200012461658 [0,1,0,0,0,1|2,0,0]=4 4264 B12R1.125 C=C(C)CSc1cncnc1Br 62a_200012461658_100000211660 [0,1,0,0,0,1|2,0,0]=4 4265 B12R1.125 C=C(C)CSc1cncnc1C 62a_100000748629_100009819671 [0,1,0,0,0,1|2,0,0]=4 4266 B12R1.125 C=C(C)CSc1cncnc1C 62a_100009819671_100000211660 [0,1,0,0,0,1|2,0,0]=4 4267 B12R1.125 C=C(C)CSc1cncnc1Cl 62a_100000748629_100000758962 [0,1,0,0,0,1|2,0,0]=4 4268 B12R1.125 C=C(C)CSc1cncnc1Cl 62a_100000758962_100000211660 [0,1,0,0,0,1|2,0,0]=4 4269 B12R1.125 C=C(C)CSc1cncnc1N 62a_100000748629_100011996079 [0,1,0,0,0,1|2,0,0]=4 4270 B12R1.125 C=C(C)CSc1cncnc1N 62a_100011996079_100000211660 [0,1,0,0,0,1|2,0,0]=4 4271 B12R1.125 C=C(C)CSc1cncnc1O 62a_100000748629_100000751107 [0,1,0,0,0,1|2,0,0]=4 4272 B12R1.125 C=C(C)CSc1cncnc1O 62a_100000751107_100000211660 [0,1,0,0,0,1|2,0,0]=4 4273 B12R1.125 C=C(C)CSc1cnncc1N 62a_100000748629_100009829405 [0,1,0,0,0,1|2,0,0]=4 4274 B12R1.125 C=C(C)CSc1cnncc1N 62a_100009829405_100000211660 [0,1,0,0,0,1|2,0,0]=4 4275 B12R1.125 C=C(C)CSc1ncc[nH]c1=O 62a_100000748629_100000763361 [0,1,0,0,0,1|2,0,0]=4 4276 B12R1.125 C=C(C)CSc1ncccc1Br 62a_100000696092_100000211660 [0,1,0,0,0,1|1,0,0]=3 4277 B12R1.125 C=C(C)CSc1ncccc1Br 62a_100000748629_100000696092 [0,1,0,0,0,1|1,0,0]=3 4278 B12R1.125 C=C(C)CSc1ncccc1C 62a_100000748629_100000751373 [0,1,0,0,0,1|1,0,0]=3 4279 B12R1.125 C=C(C)CSc1ncccc1C 62a_100000751373_100000211660 [0,1,0,0,0,1|1,0,0]=3 4280 B12R1.125 C=C(C)CSc1ncccc1Cl 62a_100000748629_100011356963 [0,1,0,0,0,1|1,0,0]=3 4281 B12R1.125 C=C(C)CSc1ncccc1Cl 62a_100011356963_100000211660 [0,1,0,0,0,1|1,0,0]=3 4282 B12R1.125 C=C(C)CSc1ncccc1F 62a_100000685392_100000211660 [0,1,0,0,0,1|1,0,0]=3 4283 B12R1.125 C=C(C)CSc1ncccc1F 62a_100000748629_100000685392 [0,1,0,0,0,1|1,0,0]=3 4284 B12R1.125 C=C(C)CSc1ncccc1N 62a_100000688686_100000211660 [0,1,0,0,0,1|1,0,0]=3 4285 B12R1.125 C=C(C)CSc1ncccc1N 62a_100000748629_100000688686 [0,1,0,0,0,1|1,0,0]=3 4286 B12R1.125 C=C(C)CSc1ncccc1O 62a_100000034122_100000211660 [0,1,0,0,0,1|1,0,0]=3 4287 B12R1.125 C=C(C)CSc1ncccc1O 62a_100000748629_100000034122 [0,1,0,0,0,1|1,0,0]=3 4288 B12R1.125 C=C(C)CSc1nccnc1C 62a_100000748629_100011999405 [0,1,0,0,0,1|2,0,0]=4 4289 B12R1.125 C=C(C)CSc1nccnc1C 62a_100011999405_100000211660 [0,1,0,0,0,1|2,0,0]=4 4290 B12R1.125 C=C(C)CSc1nccnc1Cl 62a_100000748629_100010886584 [0,1,0,0,0,1|2,0,0]=4 4291 B12R1.125 C=C(C)CSc1nccnc1Cl 62a_100010886584_100000211660 [0,1,0,0,0,1|2,0,0]=4 4292 B12R1.125 C=C(C)CSc1nccnc1F 62a_100000748629_200010125657 [0,1,0,0,0,1|2,0,0]=4 4293 B12R1.125 C=C(C)CSc1nccnc1F 62a_200010125657_100000211660 [0,1,0,0,0,1|2,0,0]=4 4294 B12R1.125 C=C(C)CSc1nccnc1N 62a_100000747729_100000211660 [0,1,0,0,0,1|2,0,0]=4 4295 B12R1.125 C=C(C)CSc1nccnc1N 62a_100000748629_100000747729 [0,1,0,0,0,1|2,0,0]=4 4296 B12R1.125 C=C(C)CSc1ncncc1C 62a_100000748629_100011998708 [0,1,0,0,0,1|2,0,0]=4 4297 B12R1.125 C=C(C)CSc1ncncc1C 62a_100011998708_100000211660 [0,1,0,0,0,1|2,0,0]=4 4298 B12R1.125 C=C(C)CSc1ncncc1F 62a_100000069762_100000211660 [0,1,0,0,0,1|2,0,0]=4 4299 B12R1.125 C=C(C)CSc1ncncc1F 62a_100000748629_100000069762 [0,1,0,0,0,1|2,0,0]=4 4300 B12R1.125 C=C(C)CSc1ncncc1N 62a_100000709731_100000211660 [0,1,0,0,0,1|2,0,0]=4 4301 B12R1.125 C=C(C)CSc1ncncc1N 62a_100000748629_100000709731 [0,1,0,0,0,1|2,0,0]=4 4302 B12R1.125 C=C(C)CSc1nnccc1C 62a_100000748629_100000089043 [0,1,0,0,0,1|2,0,0]=4 4303 B12R1.125 C=C(F)CNc1ccccc1Br 34a_100000210017_100009893438 [0,1,0,0,0,1|1,0,0]=3 4304 B12R1.125 C=C(F)CNc1ccccc1C 34a_100015192222_100009893438 [0,1,0,0,0,1|1,0,0]=3 4305 B12R1.125 C=C(F)CNc1ccccc1Cl 34a_100000185783_100009893438 [0,1,0,0,0,1|1,0,0]=3 4306 B12R1.125 C=C(F)CNc1ccccc1F 34a_100000210422_100009893438 [0,1,0,0,0,1|1,0,0]=3 4307 B12R1.125 C=C(F)CNc1ccccc1I 34a_100000210053_100009893438 [0,1,0,0,0,1|1,0,0]=3 4308 B12R1.125 C=C(F)CNc1ccccc1O 34a_100000185747_100009893438 [0,1,0,0,0,1|1,0,0]=3 4309 B12R1.125 C=C(F)COc1cccc[n+]1[O-] 7a_100000211761_100000042424 [0,1,0,0,0,1|2,0,0]=4 4310 B12R1.125 C=C(F)COc1ccccc1Br 34a_100000181306_100009893438 [0,1,0,0,0,1|1,0,0]=3 4311 B12R1.125 C=C(F)COc1ccccc1Br 7a_100000181306_100000042424 [0,1,0,0,0,1|1,0,0]=3 4312 B12R1.125 C=C(F)COc1ccccc1C 34a_100000210338_100009893438 [0,1,0,0,0,1|1,0,0]=3 4313 B12R1.125 C=C(F)COc1ccccc1C 7a_100000210338_100000042424 [0,1,0,0,0,1|1,0,0]=3 4314 B12R1.125 C=C(F)COc1ccccc1Cl 34a_100000210172_100009893438 [0,1,0,0,0,1|1,0,0]=3 4315 B12R1.125 C=C(F)COc1ccccc1Cl 7a_100000210172_100000042424 [0,1,0,0,0,1|1,0,0]=3 4316 B12R1.125 C=C(F)COc1ccccc1F 34a_100000210171_100009893438 [0,1,0,0,0,1|1,0,0]=3 4317 B12R1.125 C=C(F)COc1ccccc1F 7a_100000210171_100000042424 [0,1,0,0,0,1|1,0,0]=3 4318 B12R1.125 C=C(F)COc1ccccc1I 34a_100000739446_100009893438 [0,1,0,0,0,1|1,0,0]=3 4319 B12R1.125 C=C(F)COc1ccccc1I 7a_100000739446_100000042424 [0,1,0,0,0,1|1,0,0]=3 4320 B12R1.125 C=C(F)COc1ccccc1N 34a_100000185747_100009893438 [0,1,0,0,0,1|1,0,0]=3 4321 B12R1.125 C=C(F)COc1ccccc1N 7a_100000185747_100000042424 [0,1,0,0,0,1|1,0,0]=3 4322 B12R1.125 C=C(F)COc1cccnc1Br 34a_100000744436_100009893438 [0,1,0,0,0,1|2,0,0]=4 4323 B12R1.125 C=C(F)COc1cccnc1Br 7a_100000744436_100000042424 [0,1,0,0,0,1|2,0,0]=4 4324 B12R1.125 C=C(F)COc1cccnc1C 34a_100000745507_100009893438 [0,1,0,0,0,1|2,0,0]=4 4325 B12R1.125 C=C(F)COc1cccnc1C 7a_100000745507_100000042424 [0,1,0,0,0,1|2,0,0]=4 4326 B12R1.125 C=C(F)COc1cccnc1Cl 34a_100000757616_100009893438 [0,1,0,0,0,1|2,0,0]=4 4327 B12R1.125 C=C(F)COc1cccnc1Cl 7a_100000757616_100000042424 [0,1,0,0,0,1|2,0,0]=4 4328 B12R1.125 C=C(F)COc1cccnc1F 34a_100000061740_100009893438 [0,1,0,0,0,1|2,0,0]=4 4329 B12R1.125 C=C(F)COc1cccnc1F 7a_100000061740_100000042424 [0,1,0,0,0,1|2,0,0]=4 4330 B12R1.125 C=C(F)COc1cccnc1I 34a_100000034122_100009893438 [0,1,0,0,0,1|2,0,0]=4 4331 B12R1.125 C=C(F)COc1cccnc1I 7a_100000034122_100000042424 [0,1,0,0,0,1|2,0,0]=4 4332 B12R1.125 C=C(F)COc1cccnc1N 34a_100000211975_100009893438 [0,1,0,0,0,1|2,0,0]=4 4333 B12R1.125 C=C(F)COc1cccnc1N 7a_100000211975_100000042424 [0,1,0,0,0,1|2,0,0]=4 4334 B12R1.125 C=C(F)COc1cccoc1=O 34a_100000077404_100009893438 [0,1,0,0,0,1|2,0,0]=4 4335 B12R1.125 C=C(F)COc1cccoc1=O 7a_100000077404_100000042424 [0,1,0,0,0,1|2,0,0]=4 4336 B12R1.125 C=C(F)COc1ccncc1Br 34a_100011996408_100009893438 [0,1,0,0,0,1|2,0,0]=4 4337 B12R1.125 C=C(F)COc1ccncc1C 34a_100000694293_100009893438 [0,1,0,0,0,1|2,0,0]=4 4338 B12R1.125 C=C(F)COc1ccncc1Cl 34a_100011997054_100009893438 [0,1,0,0,0,1|2,0,0]=4 4339 B12R1.125 C=C(F)COc1ccncc1F 34a_200000081243_100009893438 [0,1,0,0,0,1|2,0,0]=4 4340 B12R1.125 C=C(F)COc1cnccc1C 34a_100011997053_100009893438 [0,1,0,0,0,1|2,0,0]=4 4341 B12R1.125 C=C(F)COc1cnccc1C 7a_100011997053_100000042424 [0,1,0,0,0,1|2,0,0]=4 4342 B12R1.125 C=C(F)COc1cnccc1Cl 34a_100011996695_100009893438 [0,1,0,0,0,1|2,0,0]=4 4343 B12R1.125 C=C(F)COc1cnccc1I 34a_100000050107_100009893438 [0,1,0,0,0,1|2,0,0]=4 4344 B12R1.125 C=C(F)COc1cnccc1N 34a_100000753702_100009893438 [0,1,0,0,0,1|2,0,0]=4 4345 B12R1.125 C=C(F)COc1coccc1=O 34a_100000060831_100009893438 [0,1,0,0,0,1|2,0,0]=4 4346 B12R1.125 C=C(F)COc1ncccc1Cl 34a_100011290957_100009893438 [0,1,0,0,0,1|2,0,0]=4 4347 B12R1.125 C=C(F)COc1ncccc1F 34a_100011219419_100009893438 [0,1,0,0,0,1|2,0,0]=4 4348 B12R1.125 C=C(F)COc1ncccc1N 34a_100000746358_100009893438 [0,1,0,0,0,1|2,0,0]=4 4349 B12R1.125 C=C(F)CSc1c[nH]ccc1=O 62a_100000042424_100009998708 [0,1,0,0,0,1|2,0,0]=4 4350 B12R1.125 C=C(F)CSc1c[nH]ccc1=O 62a_100009998708_100000042424 [0,1,0,0,0,1|2,0,0]=4 4351 B12R1.125 C=C(F)CSc1c[nH]ccc1=S 62a_100000042424_200012280681 [0,1,0,0,0,1|2,0,0]=4 4352 B12R1.125 C=C(F)CSc1c[nH]ccc1=S 62a_200012280681_100000042424 [0,1,0,0,0,1|2,0,0]=4 4353 B12R1.125 C=C(F)CSc1cccc[n+]1C 62a_100000042424_100000212160 [0,1,0,0,0,1|2,0,0]=4 4354 B12R1.125 C=C(F)CSc1cccc[n+]1[O-] 62a_100000042424_200000042595 [0,1,0,0,0,1|2,0,0]=4 4355 B12R1.125 C=C(F)CSc1ccccc1Br 62a_100000042424_100000695589 [0,1,0,0,0,1|1,0,0]=3 4356 B12R1.125 C=C(F)CSc1ccccc1Br 62a_100000695589_100000042424 [0,1,0,0,0,1|1,0,0]=3 4357 B12R1.125 C=C(F)CSc1ccccc1C 62a_100000042424_100000210755 [0,1,0,0,0,1|1,0,0]=3 4358 B12R1.125 C=C(F)CSc1ccccc1C 62a_100000210755_100000042424 [0,1,0,0,0,1|1,0,0]=3 4359 B12R1.125 C=C(F)CSc1ccccc1Cl 62a_100000042424_100000764095 [0,1,0,0,0,1|1,0,0]=3 4360 B12R1.125 C=C(F)CSc1ccccc1Cl 62a_100000764095_100000042424 [0,1,0,0,0,1|1,0,0]=3 4361 B12R1.125 C=C(F)CSc1ccccc1F 62a_100000042424_100011215700 [0,1,0,0,0,1|1,0,0]=3 4362 B12R1.125 C=C(F)CSc1ccccc1F 62a_100011215700_100000042424 [0,1,0,0,0,1|1,0,0]=3 4363 B12R1.125 C=C(F)CSc1ccccc1N 62a_100000042424_100000210017 [0,1,0,0,0,1|1,0,0]=3 4364 B12R1.125 C=C(F)CSc1ccccc1N 62a_100000210017_100000042424 [0,1,0,0,0,1|1,0,0]=3 4365 B12R1.125 C=C(F)CSc1ccccc1O 62a_100000042424_100000739446 [0,1,0,0,0,1|1,0,0]=3 4366 B12R1.125 C=C(F)CSc1ccccc1O 62a_100000739446_100000042424 [0,1,0,0,0,1|1,0,0]=3 4367 B12R1.125 C=C(F)CSc1cccnc1Br 62a_100000042424_100010202626 [0,1,0,0,0,1|2,0,0]=4 4368 B12R1.125 C=C(F)CSc1cccnc1Br 62a_100010202626_100000042424 [0,1,0,0,0,1|2,0,0]=4 4369 B12R1.125 C=C(F)CSc1cccnc1C 62a_100000042424_100000751574 [0,1,0,0,0,1|2,0,0]=4 4370 B12R1.125 C=C(F)CSc1cccnc1C 62a_100000751574_100000042424 [0,1,0,0,0,1|2,0,0]=4 4371 B12R1.125 C=C(F)CSc1cccnc1Cl 62a_100000036424_100000042424 [0,1,0,0,0,1|2,0,0]=4 4372 B12R1.125 C=C(F)CSc1cccnc1Cl 62a_100000042424_100000036424 [0,1,0,0,0,1|2,0,0]=4 4373 B12R1.125 C=C(F)CSc1cccnc1F 62a_100000042424_100009816115 [0,1,0,0,0,1|2,0,0]=4 4374 B12R1.125 C=C(F)CSc1cccnc1F 62a_100009816115_100000042424 [0,1,0,0,0,1|2,0,0]=4 4375 B12R1.125 C=C(F)CSc1cccnc1N 62a_100000042424_100000045569 [0,1,0,0,0,1|2,0,0]=4 4376 B12R1.125 C=C(F)CSc1cccnc1N 62a_100000045569_100000042424 [0,1,0,0,0,1|2,0,0]=4 4377 B12R1.125 C=C(F)CSc1cccnc1O 62a_100000042424_100000760158 [0,1,0,0,0,1|2,0,0]=4 4378 B12R1.125 C=C(F)CSc1cccnc1O 62a_100000760158_100000042424 [0,1,0,0,0,1|2,0,0]=4 4379 B12R1.125 C=C(F)CSc1ccncc1Br 62a_100000042424_100000726257 [0,1,0,0,0,1|2,0,0]=4 4380 B12R1.125 C=C(F)CSc1ccncc1Br 62a_100000726257_100000042424 [0,1,0,0,0,1|2,0,0]=4 4381 B12R1.125 C=C(F)CSc1ccncc1C 62a_100000042424_100000765111 [0,1,0,0,0,1|2,0,0]=4 4382 B12R1.125 C=C(F)CSc1ccncc1C 62a_100000765111_100000042424 [0,1,0,0,0,1|2,0,0]=4 4383 B12R1.125 C=C(F)CSc1ccncc1Cl 62a_100000042424_100000708259 [0,1,0,0,0,1|2,0,0]=4 4384 B12R1.125 C=C(F)CSc1ccncc1Cl 62a_100000708259_100000042424 [0,1,0,0,0,1|2,0,0]=4 4385 B12R1.125 C=C(F)CSc1ccncc1F 62a_100000042424_100000047030 [0,1,0,0,0,1|2,0,0]=4 4386 B12R1.125 C=C(F)CSc1ccncc1F 62a_100000047030_100000042424 [0,1,0,0,0,1|2,0,0]=4 4387 B12R1.125 C=C(F)CSc1ccncc1N 62a_100000042424_100000756074 [0,1,0,0,0,1|2,0,0]=4 4388 B12R1.125 C=C(F)CSc1ccncc1N 62a_100000756074_100000042424 [0,1,0,0,0,1|2,0,0]=4 4389 B12R1.125 C=C(F)CSc1ccncc1O 62a_100000042424_100009817591 [0,1,0,0,0,1|2,0,0]=4 4390 B12R1.125 C=C(F)CSc1ccncc1O 62a_100009817591_100000042424 [0,1,0,0,0,1|2,0,0]=4 4391 B12R1.125 C=C(F)CSc1cnccc1Br 62a_100000042424_100010138639 [0,1,0,0,0,1|2,0,0]=4 4392 B12R1.125 C=C(F)CSc1cnccc1Br 62a_100010138639_100000042424 [0,1,0,0,0,1|2,0,0]=4 4393 B12R1.125 C=C(F)CSc1cnccc1C 62a_100000042424_100000761580 [0,1,0,0,0,1|2,0,0]=4 4394 B12R1.125 C=C(F)CSc1cnccc1C 62a_100000761580_100000042424 [0,1,0,0,0,1|2,0,0]=4 4395 B12R1.125 C=C(F)CSc1cnccc1Cl 62a_100000042424_100009995489 [0,1,0,0,0,1|2,0,0]=4 4396 B12R1.125 C=C(F)CSc1cnccc1Cl 62a_100009995489_100000042424 [0,1,0,0,0,1|2,0,0]=4 4397 B12R1.125 C=C(F)CSc1cnccc1F 62a_100000042424_100009820683 [0,1,0,0,0,1|2,0,0]=4 4398 B12R1.125 C=C(F)CSc1cnccc1F 62a_100009820683_100000042424 [0,1,0,0,0,1|2,0,0]=4 4399 B12R1.125 C=C(F)CSc1cnccc1N 62a_100000042424_100000047001 [0,1,0,0,0,1|2,0,0]=4 4400 B12R1.125 C=C(F)CSc1cnccc1N 62a_100000047001_100000042424 [0,1,0,0,0,1|2,0,0]=4 4401 B12R1.125 C=C(F)CSc1ncccc1Br 62a_100000042424_100000696092 [0,1,0,0,0,1|2,0,0]=4 4402 B12R1.125 C=C(F)CSc1ncccc1Br 62a_100000696092_100000042424 [0,1,0,0,0,1|2,0,0]=4 4403 B12R1.125 C=C(F)CSc1ncccc1C 62a_100000042424_100000751373 [0,1,0,0,0,1|2,0,0]=4 4404 B12R1.125 C=C(F)CSc1ncccc1C 62a_100000751373_100000042424 [0,1,0,0,0,1|2,0,0]=4 4405 B12R1.125 C=C(F)CSc1ncccc1Cl 62a_100000042424_100011356963 [0,1,0,0,0,1|2,0,0]=4 4406 B12R1.125 C=C(F)CSc1ncccc1Cl 62a_100011356963_100000042424 [0,1,0,0,0,1|2,0,0]=4 4407 B12R1.125 C=C(F)CSc1ncccc1F 62a_100000042424_100000685392 [0,1,0,0,0,1|2,0,0]=4 4408 B12R1.125 C=C(F)CSc1ncccc1F 62a_100000685392_100000042424 [0,1,0,0,0,1|2,0,0]=4 4409 B12R1.125 C=C(F)CSc1ncccc1N 62a_100000042424_100000688686 [0,1,0,0,0,1|2,0,0]=4 4410 B12R1.125 C=C(F)CSc1ncccc1N 62a_100000688686_100000042424 [0,1,0,0,0,1|2,0,0]=4 4411 B12R1.125 C=C(F)CSc1ncccc1O 62a_100000034122_100000042424 [0,1,0,0,0,1|2,0,0]=4 4412 B12R1.125 C=C(F)CSc1ncccc1O 62a_100000042424_100000034122 [0,1,0,0,0,1|2,0,0]=4 4413 B12R1.125 CC(=O)C#Cc1ccccc1F 1458a_100011892747_200000210301 [0,1,0,0,0,1|1,0,1]=4 4414 B12R1.125 CC(=O)C=Cc1ccccc1Br 1458a_100000719032_200000210301 [0,1,0,0,0,1|1,0,1]=4 4415 B12R1.125 CC(=O)C=Cc1ccccc1Cl 1458a_100000720304_200000210301 [0,1,0,0,0,1|1,0,1]=4 4416 B12R1.125 CC(=O)C=Cc1ccccc1F 1458a_100016256065_200000210301 [0,1,0,0,0,1|1,0,1]=4 4417 B12R1.125 CC(=O)C=Cc1ccccc1O 1458a_100016263591_200000210301 [0,1,0,0,0,1|1,0,1]=4 4418 B12R1.125 CC(=O)CCc1ccccc1Br 1458a_100000070787_100012161201 [0,1,0,0,0,1|1,0,0]=3 4419 B12R1.125 CC(=O)CCc1ccccc1Br 1458a_100000740810_200000210301 [0,1,0,0,0,1|1,0,0]=3 4420 B12R1.125 CC(=O)CCc1ccccc1C 1458a_100000070787_100011713688 [0,1,0,0,0,1|1,0,0]=3 4421 B12R1.125 CC(=O)CCc1ccccc1C 1458a_100000748742_200000210301 [0,1,0,0,0,1|1,0,0]=3 4422 B12R1.125 CC(=O)CCc1ccccc1Cl 1458a_100000070787_100011713703 [0,1,0,0,0,1|1,0,0]=3 4423 B12R1.125 CC(=O)CCc1ccccc1Cl 1458a_100000184300_200000210301 [0,1,0,0,0,1|1,0,0]=3 4424 B12R1.125 CC(=O)CCc1ccccc1F 1458a_100000070787_100000720011 [0,1,0,0,0,1|1,0,0]=3 4425 B12R1.125 CC(=O)CCc1ccccc1F 1458a_100000189703_200000210301 [0,1,0,0,0,1|1,0,0]=3 4426 B12R1.125 CC(=O)CCc1ccccc1I 1458a_100000037306_200000210301 [0,1,0,0,0,1|1,0,0]=3 4427 B12R1.125 CC(=O)CCc1ccccc1O 1458a_100000070787_100000722297 [0,1,0,0,0,1|1,0,0]=3 4428 B12R1.125 CC(=O)CCc1ccccc1O 1458a_100000181328_200000210301 [0,1,0,0,0,1|1,0,0]=3 4429 B12R1.125 CC(=O)CCn1ccccc1=O 1458a_100000738505_200000210301 [0,1,0,0,0,1|2,0,0]=4 4430 B12R1.125 CC(=O)COc1ccccc1Br 1458a_100000216496_200000210301 [0,1,0,0,0,1|1,0,0]=3 4431 B12R1.125 CC(=O)COc1ccccc1C 1458a_100000182418_200000210301 [0,1,0,0,0,1|1,0,0]=3 4432 B12R1.125 CC(=O)COc1ccccc1Cl 1458a_100000185159_200000210301 [0,1,0,0,0,1|1,0,0]=3 4433 B12R1.125 CC(=O)COc1ccccc1F 1458a_100000182486_200000210301 [0,1,0,0,0,1|1,0,0]=3 4434 B12R1.125 CC(=O)COc1ccccc1O 1458a_100000183020_200000210301 [0,1,0,0,0,1|1,0,0]=3 4435 B12R1.125 CC(=O)CSc1ccccc1C 1458a_100000183026_200000210301 [0,1,0,0,0,1|1,0,0]=3 4436 B12R1.125 CC(=O)CSc1ccccc1F 1458a_100000179528_200000210301 [0,1,0,0,0,1|1,0,0]=3 4437 B12R1.125 CC(=O)CSc1ccccc1O 1458a_100000695322_200000210301 [0,1,0,0,0,1|1,0,0]=3 4438 B12R1.125 CC(=O)NCc1ccccc1Br 11a_100000689332_100015343762 [0,1,0,0,0,1|1,0,0]=3 4439 B12R1.125 CC(=O)NCc1ccccc1Br 1626a_100000689332_100015343762 [0,1,0,0,0,1|1,0,0]=3 4440 B12R1.125 CC(=O)NCc1ccccc1Br 240690a_100000689332_100015343762 [0,1,0,0,0,1|1,0,0]=3 4441 B12R1.125 CC(=O)NCc1ccccc1Br 527a_100000689332_100103153847 [0,1,0,0,0,1|1,0,0]=3 4442 B12R1.125 CC(=O)NCc1ccccc1C 11a_100000174972_100015343762 [0,1,0,0,0,1|1,0,0]=3 4443 B12R1.125 CC(=O)NCc1ccccc1C 1626a_100000174972_100015343762 [0,1,0,0,0,1|1,0,0]=3 4444 B12R1.125 CC(=O)NCc1ccccc1C 240690a_100000174972_100015343762 [0,1,0,0,0,1|1,0,0]=3 4445 B12R1.125 CC(=O)NCc1ccccc1C 527a_100000174972_100103153847 [0,1,0,0,0,1|1,0,0]=3 4446 B12R1.125 CC(=O)NCc1ccccc1Cl 11a_100000174879_100015343762 [0,1,0,0,0,1|1,0,0]=3 4447 B12R1.125 CC(=O)NCc1ccccc1Cl 1626a_100000174879_100015343762 [0,1,0,0,0,1|1,0,0]=3 4448 B12R1.125 CC(=O)NCc1ccccc1Cl 240690a_100000174879_100015343762 [0,1,0,0,0,1|1,0,0]=3 4449 B12R1.125 CC(=O)NCc1ccccc1Cl 527a_100000174879_100103153847 [0,1,0,0,0,1|1,0,0]=3 4450 B12R1.125 CC(=O)NCc1ccccc1F 11a_100000174869_100015343762 [0,1,0,0,0,1|1,0,0]=3 4451 B12R1.125 CC(=O)NCc1ccccc1F 1626a_100000174869_100015343762 [0,1,0,0,0,1|1,0,0]=3 4452 B12R1.125 CC(=O)NCc1ccccc1F 240690a_100000174869_100015343762 [0,1,0,0,0,1|1,0,0]=3 4453 B12R1.125 CC(=O)NCc1ccccc1F 527a_100000174869_100103153847 [0,1,0,0,0,1|1,0,0]=3 4454 B12R1.125 CC(=O)NCc1ccccc1I 11a_100015347259_100015343762 [0,1,0,0,0,1|1,0,0]=3 4455 B12R1.125 CC(=O)NCc1ccccc1I 1626a_100015347259_100015343762 [0,1,0,0,0,1|1,0,0]=3 4456 B12R1.125 CC(=O)NCc1ccccc1I 240690a_100015347259_100015343762 [0,1,0,0,0,1|1,0,0]=3 4457 B12R1.125 CC(=O)NCc1ccccc1I 527a_100015347259_100103153847 [0,1,0,0,0,1|1,0,0]=3 4458 B12R1.125 CC(=O)NCc1ccccc1O 240690a_100000185550_100015343762 [0,1,0,0,0,1|1,0,0]=3 4459 B12R1.125 CC(=O)NCc1ccccc1O 271570a_203496583355_100011237613 [0,1,0,0,0,1|1,0,0]=3 4460 B12R1.125 CC(=O)NCc1ccccc1O 527a_100000185550_100103153847 [0,1,0,0,0,1|1,0,0]=3 4461 B12R1.125 CC(=O)NCc1cccnc1Br 11a_100009818023_100015343762 [0,1,0,0,0,1|2,0,0]=4 4462 B12R1.125 CC(=O)NCc1cccnc1Br 240690a_100009818023_100015343762 [0,1,0,0,0,1|2,0,0]=4 4463 B12R1.125 CC(=O)NCc1cccnc1Br 527a_100009818023_100103153847 [0,1,0,0,0,1|2,0,0]=4 4464 B12R1.125 CC(=O)NCc1cccnc1Cl 11a_100015189234_100015343762 [0,1,0,0,0,1|2,0,0]=4 4465 B12R1.125 CC(=O)NCc1cccnc1Cl 1626a_100015189234_100015343762 [0,1,0,0,0,1|2,0,0]=4 4466 B12R1.125 CC(=O)NCc1cccnc1Cl 240690a_100015189234_100015343762 [0,1,0,0,0,1|2,0,0]=4 4467 B12R1.125 CC(=O)NCc1cccnc1Cl 527a_100015189234_100103153847 [0,1,0,0,0,1|2,0,0]=4 4468 B12R1.125 CC(=O)NCc1cccnc1F 11a_100000724633_100015343762 [0,1,0,0,0,1|2,0,0]=4 4469 B12R1.125 CC(=O)NCc1cccnc1F 1626a_100000724633_100015343762 [0,1,0,0,0,1|2,0,0]=4 4470 B12R1.125 CC(=O)NCc1cccnc1F 240690a_100000724633_100015343762 [0,1,0,0,0,1|2,0,0]=4 4471 B12R1.125 CC(=O)NCc1cccnc1F 527a_100000724633_100103153847 [0,1,0,0,0,1|2,0,0]=4 4472 B12R1.125 CC(=O)NCc1ccncc1Br 11a_100020640021_100015343762 [0,1,0,0,0,1|2,0,0]=4 4473 B12R1.125 CC(=O)NCc1ccncc1Br 240690a_100020640021_100015343762 [0,1,0,0,0,1|2,0,0]=4 4474 B12R1.125 CC(=O)NCc1ccncc1Br 527a_100020640021_100103153847 [0,1,0,0,0,1|2,0,0]=4 4475 B12R1.125 CC(=O)NCc1ccncc1C 11a_100000708811_100015343762 [0,1,0,0,0,1|2,0,0]=4 4476 B12R1.125 CC(=O)NCc1ccncc1C 1626a_100000708811_100015343762 [0,1,0,0,0,1|2,0,0]=4 4477 B12R1.125 CC(=O)NCc1ccncc1C 240690a_100000708811_100015343762 [0,1,0,0,0,1|2,0,0]=4 4478 B12R1.125 CC(=O)NCc1ccncc1C 527a_100000708811_100103153847 [0,1,0,0,0,1|2,0,0]=4 4479 B12R1.125 CC(=O)NCc1ccncc1F 11a_100011935246_100015343762 [0,1,0,0,0,1|2,0,0]=4 4480 B12R1.125 CC(=O)NCc1ccncc1F 1626a_100011935246_100015343762 [0,1,0,0,0,1|2,0,0]=4 4481 B12R1.125 CC(=O)NCc1ccncc1F 240690a_100011935246_100015343762 [0,1,0,0,0,1|2,0,0]=4 4482 B12R1.125 CC(=O)NCc1ccncc1F 527a_100011935246_100103153847 [0,1,0,0,0,1|2,0,0]=4 4483 B12R1.125 CC(=O)NCc1cnccc1C 11a_100011997553_100015343762 [0,1,0,0,0,1|2,0,0]=4 4484 B12R1.125 CC(=O)NCc1cnccc1C 240690a_100011997553_100015343762 [0,1,0,0,0,1|2,0,0]=4 4485 B12R1.125 CC(=O)NCc1cnccc1C 527a_100011997553_100103153847 [0,1,0,0,0,1|2,0,0]=4 4486 B12R1.125 CC(=O)NCc1ncccc1Br 11a_100020591323_100015343762 [0,1,0,0,0,1|2,0,0]=4 4487 B12R1.125 CC(=O)NCc1ncccc1Br 240690a_100020591323_100015343762 [0,1,0,0,0,1|2,0,0]=4 4488 B12R1.125 CC(=O)NCc1ncccc1Br 527a_100020591323_100103153847 [0,1,0,0,0,1|2,0,0]=4 4489 B12R1.125 CC(=O)NCc1ncccc1C 11a_100011223789_100015343762 [0,1,0,0,0,1|2,0,0]=4 4490 B12R1.125 CC(=O)NCc1ncccc1C 1626a_100011223789_100015343762 [0,1,0,0,0,1|2,0,0]=4 4491 B12R1.125 CC(=O)NCc1ncccc1C 240690a_100011223789_100015343762 [0,1,0,0,0,1|2,0,0]=4 4492 B12R1.125 CC(=O)NCc1ncccc1C 527a_100011223789_100103153847 [0,1,0,0,0,1|2,0,0]=4 4493 B12R1.125 CC(=O)NCc1ncccc1Cl 11a_100015189233_100015343762 [0,1,0,0,0,1|2,0,0]=4 4494 B12R1.125 CC(=O)NCc1ncccc1Cl 1626a_100015189233_100015343762 [0,1,0,0,0,1|2,0,0]=4 4495 B12R1.125 CC(=O)NCc1ncccc1Cl 240690a_100015189233_100015343762 [0,1,0,0,0,1|2,0,0]=4 4496 B12R1.125 CC(=O)NCc1ncccc1Cl 527a_100015189233_100103153847 [0,1,0,0,0,1|2,0,0]=4 4497 B12R1.125 CC(=O)NCc1ncccc1F 11a_100000690088_100015343762 [0,1,0,0,0,1|2,0,0]=4 4498 B12R1.125 CC(=O)NCc1ncccc1F 1626a_100000690088_100015343762 [0,1,0,0,0,1|2,0,0]=4 4499 B12R1.125 CC(=O)NCc1ncccc1F 240690a_100000690088_100015343762 [0,1,0,0,0,1|2,0,0]=4 4500 B12R1.125 CC(=O)NCc1ncccc1F 527a_100000690088_100103153847 [0,1,0,0,0,1|2,0,0]=4 4501 B12R1.125 CC(=O)NNc1ccccc1Br 22a_100000241748_100000070787 [0,1,0,0,0,1|2,0,0]=4 4502 B12R1.125 CC(=O)NNc1ccccc1C 22a_100000184220_100000070787 [0,1,0,0,0,1|2,0,0]=4 4503 B12R1.125 CC(=O)NNc1ccccc1Cl 22a_100000683529_100000070787 [0,1,0,0,0,1|2,0,0]=4 4504 B12R1.125 CC(=O)NNc1ccccc1F 22a_100000239246_100000070787 [0,1,0,0,0,1|2,0,0]=4 4505 B12R1.125 CC(=O)NNc1ccccc1I 22a_100011218156_100000070787 [0,1,0,0,0,1|2,0,0]=4 4506 B12R1.125 CC(C)CNc1ccccc1Br 34a_100000210017_100000210624 [0,1,0,0,0,1|0,0,2]=4 4507 B12R1.125 CC(C)CNc1ccccc1Cl 34a_100000185783_100000210624 [0,1,0,0,0,1|0,0,2]=4 4508 B12R1.125 CC(C)CNc1ccccc1F 34a_100000210422_100000210624 [0,1,0,0,0,1|0,0,2]=4 4509 B12R1.125 CC(C)CNc1ccccc1I 34a_100000210053_100000210624 [0,1,0,0,0,1|0,0,2]=4 4510 B12R1.125 CC(C)CNc1ccccc1O 34a_100000185747_100000210624 [0,1,0,0,0,1|0,0,2]=4 4511 B12R1.125 CC(C)COc1ccccc1Br 34a_100000181306_100000210624 [0,1,0,0,0,1|0,0,2]=4 4512 B12R1.125 CC(C)COc1ccccc1Br 7a_100000181306_100000210760 [0,1,0,0,0,1|0,0,2]=4 4513 B12R1.125 CC(C)COc1ccccc1Cl 34a_100000210172_100000210624 [0,1,0,0,0,1|0,0,2]=4 4514 B12R1.125 CC(C)COc1ccccc1Cl 7a_100000210172_100000210760 [0,1,0,0,0,1|0,0,2]=4 4515 B12R1.125 CC(C)COc1ccccc1F 34a_100000210171_100000210624 [0,1,0,0,0,1|0,0,2]=4 4516 B12R1.125 CC(C)COc1ccccc1F 7a_100000210171_100000210760 [0,1,0,0,0,1|0,0,2]=4 4517 B12R1.125 CC(C)COc1ccccc1I 34a_100000739446_100000210624 [0,1,0,0,0,1|0,0,2]=4 4518 B12R1.125 CC(C)COc1ccccc1I 7a_100000739446_100000210760 [0,1,0,0,0,1|0,0,2]=4 4519 B12R1.125 CC(C)COc1ccccc1N 34a_100000185747_100000210624 [0,1,0,0,0,1|0,0,2]=4 4520 B12R1.125 CC(C)COc1ccccc1N 7a_100000185747_100000210760 [0,1,0,0,0,1|0,0,2]=4 4521 B12R1.125 CC(C)CSc1ccccc1Br 62a_100000210624_100000695589 [0,1,0,0,0,1|0,0,2]=4 4522 B12R1.125 CC(C)CSc1ccccc1Br 62a_100000695589_100000210760 [0,1,0,0,0,1|0,0,2]=4 4523 B12R1.125 CC(C)CSc1ccccc1Cl 62a_100000210624_100000764095 [0,1,0,0,0,1|0,0,2]=4 4524 B12R1.125 CC(C)CSc1ccccc1Cl 62a_100000764095_100000210760 [0,1,0,0,0,1|0,0,2]=4 4525 B12R1.125 CC(C)CSc1ccccc1F 62a_100000210624_100011215700 [0,1,0,0,0,1|0,0,2]=4 4526 B12R1.125 CC(C)CSc1ccccc1F 62a_100011215700_100000210760 [0,1,0,0,0,1|0,0,2]=4 4527 B12R1.125 CC(C)CSc1ccccc1N 62a_100000210017_100000210760 [0,1,0,0,0,1|0,0,2]=4 4528 B12R1.125 CC(C)CSc1ccccc1N 62a_100000210624_100000210017 [0,1,0,0,0,1|0,0,2]=4 4529 B12R1.125 CC(C)CSc1ccccc1O 62a_100000210624_100000739446 [0,1,0,0,0,1|0,0,2]=4 4530 B12R1.125 CC(C)CSc1ccccc1O 62a_100000739446_100000210760 [0,1,0,0,0,1|0,0,2]=4 4531 B12R1.125 CC(C)NCc1ccccc1Br 207a_100138425928_100000211189 [0,1,0,0,0,1|0,0,2]=4 4532 B12R1.125 CC(C)NCc1ccccc1Br 2230a_100000689332_100000210206 [0,1,0,0,0,1|0,0,2]=4 4533 B12R1.125 CC(C)NCc1ccccc1Br 2230a_100138425928_100000184730 [0,1,0,0,0,1|0,0,2]=4 4534 B12R1.125 CC(C)NCc1ccccc1Br 34a_100000689332_100000210206 [0,1,0,0,0,1|0,0,2]=4 4535 B12R1.125 CC(C)NCc1ccccc1Br 34a_100138425928_100000184730 [0,1,0,0,0,1|0,0,2]=4 4536 B12R1.125 CC(C)NCc1ccccc1Cl 207a_100138425928_100000210073 [0,1,0,0,0,1|0,0,2]=4 4537 B12R1.125 CC(C)NCc1ccccc1Cl 2230a_100000174879_100000210206 [0,1,0,0,0,1|0,0,2]=4 4538 B12R1.125 CC(C)NCc1ccccc1Cl 2230a_100138425928_100000187162 [0,1,0,0,0,1|0,0,2]=4 4539 B12R1.125 CC(C)NCc1ccccc1Cl 34a_100000174879_100000210206 [0,1,0,0,0,1|0,0,2]=4 4540 B12R1.125 CC(C)NCc1ccccc1Cl 34a_100138425928_100000187162 [0,1,0,0,0,1|0,0,2]=4 4541 B12R1.125 CC(C)NCc1ccccc1F 207a_100138425928_100000210811 [0,1,0,0,0,1|0,0,2]=4 4542 B12R1.125 CC(C)NCc1ccccc1F 2230a_100138425928_100000211605 [0,1,0,0,0,1|0,0,2]=4 4543 B12R1.125 CC(C)NCc1ccccc1F 34a_100000174869_100000210206 [0,1,0,0,0,1|0,0,2]=4 4544 B12R1.125 CC(C)NCc1ccccc1F 34a_100138425928_100000211605 [0,1,0,0,0,1|0,0,2]=4 4545 B12R1.125 CC(C)NCc1ccccc1I 207a_100138425928_100000010305 [0,1,0,0,0,1|0,0,2]=4 4546 B12R1.125 CC(C)NCc1ccccc1I 2230a_100138425928_100011215278 [0,1,0,0,0,1|0,0,2]=4 4547 B12R1.125 CC(C)NCc1ccccc1I 34a_100138425928_100011215278 [0,1,0,0,0,1|0,0,2]=4 4548 B12R1.125 CC(C)NCc1ccccc1O 271570a_203496583355_100000195800 [0,1,0,0,0,1|0,0,2]=4 4549 B12R1.125 CC(C)NCc1ccccc1O 34a_100000185550_100000210206 [0,1,0,0,0,1|0,0,2]=4 4550 B12R1.125 CC(C)OCc1ccccc1Br 34a_100000212225_100000184730 [0,1,0,0,0,1|0,0,2]=4 4551 B12R1.125 CC(C)OCc1ccccc1Br 34a_100000756307_100000210206 [0,1,0,0,0,1|0,0,2]=4 4552 B12R1.125 CC(C)OCc1ccccc1Br 7a_100000756307_100000210206 [0,1,0,0,0,1|0,0,2]=4 4553 B12R1.125 CC(C)OCc1ccccc1Cl 34a_100000210847_100000210206 [0,1,0,0,0,1|0,0,2]=4 4554 B12R1.125 CC(C)OCc1ccccc1Cl 34a_100000212225_100000187162 [0,1,0,0,0,1|0,0,2]=4 4555 B12R1.125 CC(C)OCc1ccccc1Cl 7a_100000210847_100000210206 [0,1,0,0,0,1|0,0,2]=4 4556 B12R1.125 CC(C)OCc1ccccc1F 34a_100000211962_100000210206 [0,1,0,0,0,1|0,0,2]=4 4557 B12R1.125 CC(C)OCc1ccccc1F 34a_100000212225_100000211605 [0,1,0,0,0,1|0,0,2]=4 4558 B12R1.125 CC(C)OCc1ccccc1F 7a_100000211962_100000210206 [0,1,0,0,0,1|0,0,2]=4 4559 B12R1.125 CC(C)OCc1ccccc1I 34a_100000187465_100000210206 [0,1,0,0,0,1|0,0,2]=4 4560 B12R1.125 CC(C)OCc1ccccc1I 34a_100000212225_100011215278 [0,1,0,0,0,1|0,0,2]=4 4561 B12R1.125 CC(C)OCc1ccccc1I 7a_100000187465_100000210206 [0,1,0,0,0,1|0,0,2]=4 4562 B12R1.125 CC(C)OCc1ccccc1N 34a_100000212039_100000210206 [0,1,0,0,0,1|0,0,2]=4 4563 B12R1.125 CC(C)SCc1ccccc1Br 62a_100000184730_100000210206 [0,1,0,0,0,1|0,0,2]=4 4564 B12R1.125 CC(C)SCc1ccccc1Br 62a_100000210206_100000184730 [0,1,0,0,0,1|0,0,2]=4 4565 B12R1.125 CC(C)SCc1ccccc1Cl 62a_100000187162_100000210206 [0,1,0,0,0,1|0,0,2]=4 4566 B12R1.125 CC(C)SCc1ccccc1Cl 62a_100000210206_100000187162 [0,1,0,0,0,1|0,0,2]=4 4567 B12R1.125 CC(C)SCc1ccccc1F 62a_100000210206_100000211605 [0,1,0,0,0,1|0,0,2]=4 4568 B12R1.125 CC(C)SCc1ccccc1F 62a_100000211605_100000210206 [0,1,0,0,0,1|0,0,2]=4 4569 B12R1.125 CC(C)SCc1ccccc1I 62a_100000210206_100011216222 [0,1,0,0,0,1|0,0,2]=4 4570 B12R1.125 CC(C)SCc1ccccc1I 62a_100011216222_100000210206 [0,1,0,0,0,1|0,0,2]=4 4571 B12R1.125 CC(C)SCc1ccccc1O 271570a_203496583355_200000173093 [0,1,0,0,0,1|0,0,2]=4 4572 B12R1.125 CC(O)CNc1ccccc1Br 34a_100000210017_100011218427 [0,1,0,0,0,1|1,0,1]=4 4573 B12R1.125 CC(O)CNc1ccccc1Cl 34a_100000185783_100011218427 [0,1,0,0,0,1|1,0,1]=4 4574 B12R1.125 CC(O)CNc1ccccc1F 34a_100000210422_100011218427 [0,1,0,0,0,1|1,0,1]=4 4575 B12R1.125 CC(O)CNc1ccccc1I 34a_100000210053_100011218427 [0,1,0,0,0,1|1,0,1]=4 4576 B12R1.125 CC(O)CNc1ccccc1O 34a_100000185747_100011218427 [0,1,0,0,0,1|1,0,1]=4 4577 B12R1.125 CC(O)COc1ccccc1Br 34a_100000181306_100011218427 [0,1,0,0,0,1|1,0,1]=4 4578 B12R1.125 CC(O)COc1ccccc1Br 7a_100000181306_100011218427 [0,1,0,0,0,1|1,0,1]=4 4579 B12R1.125 CC(O)COc1ccccc1Cl 34a_100000210172_100011218427 [0,1,0,0,0,1|1,0,1]=4 4580 B12R1.125 CC(O)COc1ccccc1Cl 7a_100000210172_100011218427 [0,1,0,0,0,1|1,0,1]=4 4581 B12R1.125 CC(O)COc1ccccc1F 34a_100000210171_100011218427 [0,1,0,0,0,1|1,0,1]=4 4582 B12R1.125 CC(O)COc1ccccc1F 7a_100000210171_100011218427 [0,1,0,0,0,1|1,0,1]=4 4583 B12R1.125 CC(O)COc1ccccc1I 34a_100000739446_100011218427 [0,1,0,0,0,1|1,0,1]=4 4584 B12R1.125 CC(O)COc1ccccc1I 7a_100000739446_100011218427 [0,1,0,0,0,1|1,0,1]=4 4585 B12R1.125 CC(O)COc1ccccc1N 34a_100000185747_100011218427 [0,1,0,0,0,1|1,0,1]=4 4586 B12R1.125 CC(O)COc1ccccc1N 7a_100000185747_100011218427 [0,1,0,0,0,1|1,0,1]=4 4587 B12R1.125 CC(O)CSc1ccccc1Br 62a_100000695589_100011218427 [0,1,0,0,0,1|1,0,1]=4 4588 B12R1.125 CC(O)CSc1ccccc1Br 62a_100011218427_100000695589 [0,1,0,0,0,1|1,0,1]=4 4589 B12R1.125 CC(O)CSc1ccccc1Cl 62a_100000764095_100011218427 [0,1,0,0,0,1|1,0,1]=4 4590 B12R1.125 CC(O)CSc1ccccc1Cl 62a_100011218427_100000764095 [0,1,0,0,0,1|1,0,1]=4 4591 B12R1.125 CC(O)CSc1ccccc1F 62a_100011215700_100011218427 [0,1,0,0,0,1|1,0,1]=4 4592 B12R1.125 CC(O)CSc1ccccc1F 62a_100011218427_100011215700 [0,1,0,0,0,1|1,0,1]=4 4593 B12R1.125 CC(O)CSc1ccccc1N 62a_100000210017_100011218427 [0,1,0,0,0,1|1,0,1]=4 4594 B12R1.125 CC(O)CSc1ccccc1N 62a_100011218427_100000210017 [0,1,0,0,0,1|1,0,1]=4 4595 B12R1.125 CC(O)CSc1ccccc1O 62a_100000739446_100011218427 [0,1,0,0,0,1|1,0,1]=4 4596 B12R1.125 CC(O)CSc1ccccc1O 62a_100011218427_100000739446 [0,1,0,0,0,1|1,0,1]=4 4597 B12R1.125 CN(C)CCc1ccccc1Br 2230a_100102631434_100012161201 [0,1,0,0,0,1|1,0,1]=4 4598 B12R1.125 CN(C)CCc1ccccc1Br 269982a_100102631434_100012161201 [0,1,0,0,0,1|1,0,1]=4 4599 B12R1.125 CN(C)CCc1ccccc1Cl 2230a_100102631434_100011713703 [0,1,0,0,0,1|1,0,1]=4 4600 B12R1.125 CN(C)CCc1ccccc1Cl 269982a_100102631434_100011713703 [0,1,0,0,0,1|1,0,1]=4 4601 B12R1.125 CN(C)CCc1ccccc1Cl 270004a_100102631434_200011713468 [0,1,0,0,0,1|1,0,1]=4 4602 B12R1.125 CN(C)CCc1ccccc1F 2230a_100000232559_200000210301 [0,1,0,0,0,1|1,0,1]=4 4603 B12R1.125 CN(C)CCc1ccccc1F 2230a_100102631434_100011713696 [0,1,0,0,0,1|1,0,1]=4 4604 B12R1.125 CN(C)CCc1ccccc1F 269982a_100000232559_200000210301 [0,1,0,0,0,1|1,0,1]=4 4605 B12R1.125 CN(C)CCc1ccccc1F 269982a_100102631434_100011713696 [0,1,0,0,0,1|1,0,1]=4 4606 B12R1.125 CN(C)CCc1ccccc1F 34a_100000232559_200000210301 [0,1,0,0,0,1|1,0,1]=4 4607 B12R1.125 CN(C)CCc1ccccc1O 269982a_100102631434_100000722297 [0,1,0,0,0,1|1,0,1]=4 4608 B12R1.125 CN([13CH3])CCc1ccccc1F 2230a_100000232559_200025704644 [0,1,0,0,0,1|1,0,1]=4 4609 B12R1.125 CN([13CH3])CCc1ccccc1F 269982a_100000232559_200025704644 [0,1,0,0,0,1|1,0,1]=4 4610 B12R1.125 CN([13CH3])CCc1ccccc1F 34a_100000232559_200025704644 [0,1,0,0,0,1|1,0,1]=4 4611 B12R1.125 C[C@@H](O)CNc1ccccc1Br 34a_100000210017_100009817552 [0,1,0,0,0,1|1,0,1]=4 4612 B12R1.125 C[C@@H](O)CNc1ccccc1Cl 34a_100000185783_100009817552 [0,1,0,0,0,1|1,0,1]=4 4613 B12R1.125 C[C@@H](O)CNc1ccccc1F 34a_100000210422_100009817552 [0,1,0,0,0,1|1,0,1]=4 4614 B12R1.125 C[C@@H](O)CNc1ccccc1I 34a_100000210053_100009817552 [0,1,0,0,0,1|1,0,1]=4 4615 B12R1.125 C[C@@H](O)CNc1ccccc1O 34a_100000185747_100009817552 [0,1,0,0,0,1|1,0,1]=4 4616 B12R1.125 C[C@@H](O)COc1ccccc1Br 34a_100000181306_100009817552 [0,1,0,0,0,1|1,0,1]=4 4617 B12R1.125 C[C@@H](O)COc1ccccc1Br 7a_100000181306_100009817552 [0,1,0,0,0,1|1,0,1]=4 4618 B12R1.125 C[C@@H](O)COc1ccccc1Cl 34a_100000210172_100009817552 [0,1,0,0,0,1|1,0,1]=4 4619 B12R1.125 C[C@@H](O)COc1ccccc1Cl 7a_100000210172_100009817552 [0,1,0,0,0,1|1,0,1]=4 4620 B12R1.125 C[C@@H](O)COc1ccccc1F 34a_100000210171_100009817552 [0,1,0,0,0,1|1,0,1]=4 4621 B12R1.125 C[C@@H](O)COc1ccccc1F 7a_100000210171_100009817552 [0,1,0,0,0,1|1,0,1]=4 4622 B12R1.125 C[C@@H](O)COc1ccccc1I 34a_100000739446_100009817552 [0,1,0,0,0,1|1,0,1]=4 4623 B12R1.125 C[C@@H](O)COc1ccccc1I 7a_100000739446_100009817552 [0,1,0,0,0,1|1,0,1]=4 4624 B12R1.125 C[C@@H](O)COc1ccccc1N 34a_100000185747_100009817552 [0,1,0,0,0,1|1,0,1]=4 4625 B12R1.125 C[C@@H](O)COc1ccccc1N 7a_100000185747_100009817552 [0,1,0,0,0,1|1,0,1]=4 4626 B12R1.125 C[C@@H](O)CSc1ccccc1Br 62a_100000695589_100009817552 [0,1,0,0,0,1|1,0,1]=4 4627 B12R1.125 C[C@@H](O)CSc1ccccc1Br 62a_100009817552_100000695589 [0,1,0,0,0,1|1,0,1]=4 4628 B12R1.125 C[C@@H](O)CSc1ccccc1Cl 62a_100000764095_100009817552 [0,1,0,0,0,1|1,0,1]=4 4629 B12R1.125 C[C@@H](O)CSc1ccccc1Cl 62a_100009817552_100000764095 [0,1,0,0,0,1|1,0,1]=4 4630 B12R1.125 C[C@@H](O)CSc1ccccc1F 62a_100009817552_100011215700 [0,1,0,0,0,1|1,0,1]=4 4631 B12R1.125 C[C@@H](O)CSc1ccccc1F 62a_100011215700_100009817552 [0,1,0,0,0,1|1,0,1]=4 4632 B12R1.125 C[C@@H](O)CSc1ccccc1N 62a_100000210017_100009817552 [0,1,0,0,0,1|1,0,1]=4 4633 B12R1.125 C[C@@H](O)CSc1ccccc1N 62a_100009817552_100000210017 [0,1,0,0,0,1|1,0,1]=4 4634 B12R1.125 C[C@@H](O)CSc1ccccc1O 62a_100000739446_100009817552 [0,1,0,0,0,1|1,0,1]=4 4635 B12R1.125 C[C@@H](O)CSc1ccccc1O 62a_100009817552_100000739446 [0,1,0,0,0,1|1,0,1]=4 4636 B12R1.125 Cc1ccccc1CCC(=O)[13CH3] 1458a_100000748742_200025704644 [0,1,0,0,0,1|1,0,0]=3 4637 B12R1.125 Cc1ccccc1CCN(C)C 2230a_100102631434_100011713688 [0,1,0,0,0,1|1,0,1]=4 4638 B12R1.125 Cc1ccccc1CCN(C)C 269982a_100102631434_100011713688 [0,1,0,0,0,1|1,0,1]=4 4639 B12R1.125 Cc1ccccc1CNC(C)C 207a_100138425928_100000211143 [0,1,0,0,0,1|0,0,2]=4 4640 B12R1.125 Cc1ccccc1CNC(C)C 2230a_100138425928_100000211839 [0,1,0,0,0,1|0,0,2]=4 4641 B12R1.125 Cc1ccccc1CNC(C)C 34a_100000174972_100000210206 [0,1,0,0,0,1|0,0,2]=4 4642 B12R1.125 Cc1ccccc1CNC(C)C 34a_100138425928_100000211839 [0,1,0,0,0,1|0,0,2]=4 4643 B12R1.125 Cc1ccccc1COC(C)C 34a_100000212225_100000211839 [0,1,0,0,0,1|0,0,2]=4 4644 B12R1.125 Cc1ccccc1COC(C)C 34a_100000698903_100000210206 [0,1,0,0,0,1|0,0,2]=4 4645 B12R1.125 Cc1ccccc1COC(C)C 7a_100000698903_100000210206 [0,1,0,0,0,1|0,0,2]=4 4646 B12R1.125 Cc1ccccc1CSC(C)C 62a_100000210206_100000211839 [0,1,0,0,0,1|0,0,2]=4 4647 B12R1.125 Cc1ccccc1CSC(C)C 62a_100000211839_100000210206 [0,1,0,0,0,1|0,0,2]=4 4648 B12R1.125 Cc1ccccc1NCC(=O)N 34a_100015192222_100000187820 [0,1,0,0,0,1|2,0,0]=4 4649 B12R1.125 Cc1ccccc1NCC(=O)[O-] 34a_100015192222_100020667443 [0,1,0,0,0,1|2,0,0]=4 4650 B12R1.125 Cc1ccccc1NCC(C)C 34a_100015192222_100000210624 [0,1,0,0,0,1|0,0,2]=4 4651 B12R1.125 Cc1ccccc1NCC(C)O 34a_100015192222_100011218427 [0,1,0,0,0,1|1,0,1]=4 4652 B12R1.125 Cc1ccccc1NC[C@@H](C)O 34a_100015192222_100009817552 [0,1,0,0,0,1|1,0,1]=4 4653 B12R1.125 Cc1ccccc1OCC(=O)N 34a_100000210338_100000187820 [0,1,0,0,0,1|2,0,0]=4 4654 B12R1.125 Cc1ccccc1OCC(=O)N 7a_100000210338_100000187820 [0,1,0,0,0,1|2,0,0]=4 4655 B12R1.125 Cc1ccccc1OCC(=O)[13CH3] 1458a_100000182418_200025704644 [0,1,0,0,0,1|1,0,0]=3 4656 B12R1.125 Cc1ccccc1OCC(=O)[O-] 34a_100000210338_100020667443 [0,1,0,0,0,1|2,0,0]=4 4657 B12R1.125 Cc1ccccc1OCC(C)C 34a_100000210338_100000210624 [0,1,0,0,0,1|0,0,2]=4 4658 B12R1.125 Cc1ccccc1OCC(C)C 7a_100000210338_100000210760 [0,1,0,0,0,1|0,0,2]=4 4659 B12R1.125 Cc1ccccc1OCC(C)O 34a_100000210338_100011218427 [0,1,0,0,0,1|1,0,1]=4 4660 B12R1.125 Cc1ccccc1OCC(C)O 7a_100000210338_100011218427 [0,1,0,0,0,1|1,0,1]=4 4661 B12R1.125 Cc1ccccc1OC[C@@H](C)O 34a_100000210338_100009817552 [0,1,0,0,0,1|1,0,1]=4 4662 B12R1.125 Cc1ccccc1OC[C@@H](C)O 7a_100000210338_100009817552 [0,1,0,0,0,1|1,0,1]=4 4663 B12R1.125 Cc1ccccc1SCC(=O)N 62a_100000210755_100000747473 [0,1,0,0,0,1|2,0,0]=4 4664 B12R1.125 Cc1ccccc1SCC(=O)N 62a_100000747473_100000210755 [0,1,0,0,0,1|2,0,0]=4 4665 B12R1.125 Cc1ccccc1SCC(=O)[13CH3] 1458a_100000183026_200025704644 [0,1,0,0,0,1|1,0,0]=3 4666 B12R1.125 Cc1ccccc1SCC(=O)[O-] 62a_100000210755_100020667443 [0,1,0,0,0,1|2,0,0]=4 4667 B12R1.125 Cc1ccccc1SCC(=O)[O-] 62a_100020667443_100000210755 [0,1,0,0,0,1|2,0,0]=4 4668 B12R1.125 Cc1ccccc1SCC(C)C 62a_100000210624_100000210755 [0,1,0,0,0,1|0,0,2]=4 4669 B12R1.125 Cc1ccccc1SCC(C)C 62a_100000210755_100000210760 [0,1,0,0,0,1|0,0,2]=4 4670 B12R1.125 Cc1ccccc1SCC(C)O 62a_100000210755_100011218427 [0,1,0,0,0,1|1,0,1]=4 4671 B12R1.125 Cc1ccccc1SCC(C)O 62a_100011218427_100000210755 [0,1,0,0,0,1|1,0,1]=4 4672 B12R1.125 Cc1ccccc1SC[C@@H](C)O 62a_100000210755_100009817552 [0,1,0,0,0,1|1,0,1]=4 4673 B12R1.125 Cc1ccccc1SC[C@@H](C)O 62a_100009817552_100000210755 [0,1,0,0,0,1|1,0,1]=4 4674 B12R1.125 NC(=O)CCc1ccccc1O 271570a_203496583355_100009814947 [0,1,0,0,0,1|2,0,0]=4 4675 B12R1.125 NC(=O)CNc1ccccc1Br 34a_100000210017_100000187820 [0,1,0,0,0,1|2,0,0]=4 4676 B12R1.125 NC(=O)CNc1ccccc1Cl 34a_100000185783_100000187820 [0,1,0,0,0,1|2,0,0]=4 4677 B12R1.125 NC(=O)CNc1ccccc1F 34a_100000210422_100000187820 [0,1,0,0,0,1|2,0,0]=4 4678 B12R1.125 NC(=O)CNc1ccccc1I 34a_100000210053_100000187820 [0,1,0,0,0,1|2,0,0]=4 4679 B12R1.125 NC(=O)CNc1ccccc1O 34a_100000185747_100000187820 [0,1,0,0,0,1|2,0,0]=4 4680 B12R1.125 NC(=O)COc1ccccc1Br 34a_100000181306_100000187820 [0,1,0,0,0,1|2,0,0]=4 4681 B12R1.125 NC(=O)COc1ccccc1Br 7a_100000181306_100000187820 [0,1,0,0,0,1|2,0,0]=4 4682 B12R1.125 NC(=O)COc1ccccc1Cl 34a_100000210172_100000187820 [0,1,0,0,0,1|2,0,0]=4 4683 B12R1.125 NC(=O)COc1ccccc1Cl 7a_100000210172_100000187820 [0,1,0,0,0,1|2,0,0]=4 4684 B12R1.125 NC(=O)COc1ccccc1F 34a_100000210171_100000187820 [0,1,0,0,0,1|2,0,0]=4 4685 B12R1.125 NC(=O)COc1ccccc1F 7a_100000210171_100000187820 [0,1,0,0,0,1|2,0,0]=4 4686 B12R1.125 NC(=O)COc1ccccc1I 34a_100000739446_100000187820 [0,1,0,0,0,1|2,0,0]=4 4687 B12R1.125 NC(=O)COc1ccccc1I 7a_100000739446_100000187820 [0,1,0,0,0,1|2,0,0]=4 4688 B12R1.125 NC(=O)COc1ccccc1N 34a_100000185747_100000187820 [0,1,0,0,0,1|2,0,0]=4 4689 B12R1.125 NC(=O)COc1ccccc1N 7a_100000185747_100000187820 [0,1,0,0,0,1|2,0,0]=4 4690 B12R1.125 NC(=O)COc1ccccc1O 271570a_203496583355_200000148491 [0,1,0,0,0,1|2,0,0]=4 4691 B12R1.125 NC(=O)CSc1ccccc1Br 62a_100000695589_100000747473 [0,1,0,0,0,1|2,0,0]=4 4692 B12R1.125 NC(=O)CSc1ccccc1Br 62a_100000747473_100000695589 [0,1,0,0,0,1|2,0,0]=4 4693 B12R1.125 NC(=O)CSc1ccccc1Cl 62a_100000747473_100000764095 [0,1,0,0,0,1|2,0,0]=4 4694 B12R1.125 NC(=O)CSc1ccccc1Cl 62a_100000764095_100000747473 [0,1,0,0,0,1|2,0,0]=4 4695 B12R1.125 NC(=O)CSc1ccccc1F 62a_100000747473_100011215700 [0,1,0,0,0,1|2,0,0]=4 4696 B12R1.125 NC(=O)CSc1ccccc1F 62a_100011215700_100000747473 [0,1,0,0,0,1|2,0,0]=4 4697 B12R1.125 NC(=O)CSc1ccccc1N 62a_100000210017_100000747473 [0,1,0,0,0,1|2,0,0]=4 4698 B12R1.125 NC(=O)CSc1ccccc1N 62a_100000747473_100000210017 [0,1,0,0,0,1|2,0,0]=4 4699 B12R1.125 NC(=O)CSc1ccccc1O 62a_100000739446_100000747473 [0,1,0,0,0,1|2,0,0]=4 4700 B12R1.125 NC(=O)CSc1ccccc1O 62a_100000747473_100000739446 [0,1,0,0,0,1|2,0,0]=4 4701 B12R1.125 Nc1ccccc1OCC(=O)[O-] 34a_100000185747_100020667443 [0,1,0,0,0,1|2,0,0]=4 4702 B12R1.125 Nc1ccccc1SCC(=O)[O-] 62a_100000210017_100020667443 [0,1,0,0,0,1|2,0,0]=4 4703 B12R1.125 Nc1ccccc1SCC(=O)[O-] 62a_100020667443_100000210017 [0,1,0,0,0,1|2,0,0]=4 4704 B12R1.125 O=C([O-])CNc1ccccc1Br 34a_100000210017_100020667443 [0,1,0,0,0,1|2,0,0]=4 4705 B12R1.125 O=C([O-])CNc1ccccc1Cl 34a_100000185783_100020667443 [0,1,0,0,0,1|2,0,0]=4 4706 B12R1.125 O=C([O-])CNc1ccccc1F 34a_100000210422_100020667443 [0,1,0,0,0,1|2,0,0]=4 4707 B12R1.125 O=C([O-])CNc1ccccc1I 34a_100000210053_100020667443 [0,1,0,0,0,1|2,0,0]=4 4708 B12R1.125 O=C([O-])CNc1ccccc1O 34a_100000185747_100020667443 [0,1,0,0,0,1|2,0,0]=4 4709 B12R1.125 O=C([O-])COc1ccccc1Br 34a_100000181306_100020667443 [0,1,0,0,0,1|2,0,0]=4 4710 B12R1.125 O=C([O-])COc1ccccc1Cl 34a_100000210172_100020667443 [0,1,0,0,0,1|2,0,0]=4 4711 B12R1.125 O=C([O-])COc1ccccc1F 34a_100000210171_100020667443 [0,1,0,0,0,1|2,0,0]=4 4712 B12R1.125 O=C([O-])COc1ccccc1I 34a_100000739446_100020667443 [0,1,0,0,0,1|2,0,0]=4 4713 B12R1.125 O=C([O-])CSc1ccccc1Br 62a_100000695589_100020667443 [0,1,0,0,0,1|2,0,0]=4 4714 B12R1.125 O=C([O-])CSc1ccccc1Br 62a_100020667443_100000695589 [0,1,0,0,0,1|2,0,0]=4 4715 B12R1.125 O=C([O-])CSc1ccccc1Cl 62a_100000764095_100020667443 [0,1,0,0,0,1|2,0,0]=4 4716 B12R1.125 O=C([O-])CSc1ccccc1Cl 62a_100020667443_100000764095 [0,1,0,0,0,1|2,0,0]=4 4717 B12R1.125 O=C([O-])CSc1ccccc1F 62a_100011215700_100020667443 [0,1,0,0,0,1|2,0,0]=4 4718 B12R1.125 O=C([O-])CSc1ccccc1F 62a_100020667443_100011215700 [0,1,0,0,0,1|2,0,0]=4 4719 B12R1.125 O=C([O-])CSc1ccccc1O 62a_100000739446_100020667443 [0,1,0,0,0,1|2,0,0]=4 4720 B12R1.125 O=C([O-])CSc1ccccc1O 62a_100020667443_100000739446 [0,1,0,0,0,1|2,0,0]=4 4721 B12R1.125 [13CH3]C(=O)C#Cc1ccccc1F 1458a_100011892747_200025704644 [0,1,0,0,0,1|1,0,1]=4 4722 B12R1.125 [13CH3]C(=O)C=Cc1ccccc1Br 1458a_100000719032_200025704644 [0,1,0,0,0,1|1,0,1]=4 4723 B12R1.125 [13CH3]C(=O)C=Cc1ccccc1Cl 1458a_100000720304_200025704644 [0,1,0,0,0,1|1,0,1]=4 4724 B12R1.125 [13CH3]C(=O)C=Cc1ccccc1F 1458a_100016256065_200025704644 [0,1,0,0,0,1|1,0,1]=4 4725 B12R1.125 [13CH3]C(=O)C=Cc1ccccc1O 1458a_100016263591_200025704644 [0,1,0,0,0,1|1,0,1]=4 4726 B12R1.125 [13CH3]C(=O)CCc1ccccc1Br 1458a_100000740810_200025704644 [0,1,0,0,0,1|1,0,0]=3 4727 B12R1.125 [13CH3]C(=O)CCc1ccccc1Cl 1458a_100000184300_200025704644 [0,1,0,0,0,1|1,0,0]=3 4728 B12R1.125 [13CH3]C(=O)CCc1ccccc1F 1458a_100000189703_200025704644 [0,1,0,0,0,1|1,0,0]=3 4729 B12R1.125 [13CH3]C(=O)CCc1ccccc1I 1458a_100000037306_200025704644 [0,1,0,0,0,1|1,0,0]=3 4730 B12R1.125 [13CH3]C(=O)CCc1ccccc1O 1458a_100000181328_200025704644 [0,1,0,0,0,1|1,0,0]=3 4731 B12R1.125 [13CH3]C(=O)CCn1ccccc1=O 1458a_100000738505_200025704644 [0,1,0,0,0,1|2,0,0]=4 4732 B12R1.125 [13CH3]C(=O)COc1ccccc1Br 1458a_100000216496_200025704644 [0,1,0,0,0,1|1,0,0]=3 4733 B12R1.125 [13CH3]C(=O)COc1ccccc1Cl 1458a_100000185159_200025704644 [0,1,0,0,0,1|1,0,0]=3 4734 B12R1.125 [13CH3]C(=O)COc1ccccc1F 1458a_100000182486_200025704644 [0,1,0,0,0,1|1,0,0]=3 4735 B12R1.125 [13CH3]C(=O)COc1ccccc1O 1458a_100000183020_200025704644 [0,1,0,0,0,1|1,0,0]=3 4736 B12R1.125 [13CH3]C(=O)CSc1ccccc1F 1458a_100000179528_200025704644 [0,1,0,0,0,1|1,0,0]=3 4737 B12R1.125 [13CH3]C(=O)CSc1ccccc1O 1458a_100000695322_200025704644 [0,1,0,0,0,1|1,0,0]=3 4738 B12R1.226 C=C(C)CNc1c[n+](ccn1)[O-] 27a_100000765925_100009880115 [0,1,0,0,0,1|2,0,0]=4 4739 B12R1.226 C=C(C)CNc1cc(ccn1)F 27a_100000765925_100000764206 [0,1,0,0,0,1|1,0,0]=3 4740 B12R1.226 C=C(C)CNc1cc(cnn1)C 27a_100000765925_100000070100 [0,1,0,0,0,1|2,0,0]=4 4741 B12R1.226 C=C(C)CNc1cc(ncn1)C 27a_100000765925_100000744208 [0,1,0,0,0,1|2,0,0]=4 4742 B12R1.226 C=C(C)CNc1cc(ncn1)F 27a_100000765925_200009880791 [0,1,0,0,0,1|2,0,0]=4 4743 B12R1.226 C=C(C)CNc1cc(ncn1)N 27a_100000765925_100000701291 [0,1,0,0,0,1|2,0,0]=4 4744 B12R1.226 C=C(C)CNc1cc(ncn1)O 27a_100000765925_100000765262 [0,1,0,0,0,1|2,0,0]=4 4745 B12R1.226 C=C(C)CNc1cc[nH]c(=O)c1 27a_100000765925_100000061649 [0,1,0,0,0,1|1,0,0]=3 4746 B12R1.226 C=C(C)CNc1cc[nH]c(=O)n1 27a_100000765925_200000134032 [0,1,0,0,0,1|2,0,0]=4 4747 B12R1.226 C=C(C)CNc1cccc(c1)Br 34a_100000210019_100000748629 [0,1,0,0,0,1|0,0,0]=2 4748 B12R1.226 C=C(C)CNc1cccc(c1)C 2230a_100000188690_100000748629 [0,1,0,0,0,1|0,0,0]=2 4749 B12R1.226 C=C(C)CNc1cccc(c1)C 34a_100000188690_100000748629 [0,1,0,0,0,1|0,0,0]=2 4750 B12R1.226 C=C(C)CNc1cccc(c1)Cl 34a_100000185859_100000748629 [0,1,0,0,0,1|0,0,0]=2 4751 B12R1.226 C=C(C)CNc1cccc(c1)F 34a_100000210047_100000748629 [0,1,0,0,0,1|0,0,0]=2 4752 B12R1.226 C=C(C)CNc1cccc(c1)I 34a_100000211102_100000748629 [0,1,0,0,0,1|0,0,0]=2 4753 B12R1.226 C=C(C)CNc1cccc(c1)O 34a_100000210217_100000748629 [0,1,0,0,0,1|0,0,0]=2 4754 B12R1.226 C=C(C)CNc1cccc(n1)F 27a_100000765925_100009815982 [0,1,0,0,0,1|1,0,0]=3 4755 B12R1.226 C=C(C)CNc1ccnc(c1)C 27a_100000765925_100000758586 [0,1,0,0,0,1|1,0,0]=3 4756 B12R1.226 C=C(C)CNc1ccnc(c1)F 27a_100000765925_100009816116 [0,1,0,0,0,1|1,0,0]=3 4757 B12R1.226 C=C(C)CNc1ccnc(n1)C 27a_100000765925_100000749937 [0,1,0,0,0,1|2,0,0]=4 4758 B12R1.226 C=C(C)CNc1ccnc(n1)N 27a_100000765925_100000055538 [0,1,0,0,0,1|2,0,0]=4 4759 B12R1.226 C=C(C)CNc1cncc(n1)C 27a_100000765925_100000754123 [0,1,0,0,0,1|2,0,0]=4 4760 B12R1.226 C=C(C)CNc1cncc(n1)Cl 27a_100000765925_100010892449 [0,1,0,0,0,1|2,0,0]=4 4761 B12R1.226 C=C(C)CNc1cncc(n1)F 27a_100000765925_200009863489 [0,1,0,0,0,1|2,0,0]=4 4762 B12R1.226 C=C(C)CNc1nccc(n1)C 27a_100000765925_100000750684 [0,1,0,0,0,1|2,0,0]=4 4763 B12R1.226 C=C(C)CNc1nccc(n1)N 27a_100000765925_100000757536 [0,1,0,0,0,1|2,0,0]=4 4764 B12R1.226 C=C(C)CNc1nccc(n1)O 27a_100000765925_100011649813 [0,1,0,0,0,1|2,0,0]=4 4765 B12R1.226 C=C(C)COc1cc(cnn1)C 34a_100000766097_100000748629 [0,1,0,0,0,1|2,0,0]=4 4766 B12R1.226 C=C(C)COc1cc[nH]c(=O)c1 34a_100000032262_100000748629 [0,1,0,0,0,1|1,0,0]=3 4767 B12R1.226 C=C(C)COc1ccc[n+](c1)[O-] 34a_100000039713_100000748629 [0,1,0,0,0,1|1,0,0]=3 4768 B12R1.226 C=C(C)COc1ccc[n+](c1)[O-] 7a_100000039713_100000748629 [0,1,0,0,0,1|1,0,0]=3 4769 B12R1.226 C=C(C)COc1cccc(=O)[nH]1 34a_100000033347_100000748629 [0,1,0,0,0,1|1,0,0]=3 4770 B12R1.226 C=C(C)COc1cccc(c1)Br 34a_100000210342_100000748629 [0,1,0,0,0,1|0,0,0]=2 4771 B12R1.226 C=C(C)COc1cccc(c1)Br 7a_100000210342_100000748629 [0,1,0,0,0,1|0,0,0]=2 4772 B12R1.226 C=C(C)COc1cccc(c1)C 34a_100000210337_100000748629 [0,1,0,0,0,1|0,0,0]=2 4773 B12R1.226 C=C(C)COc1cccc(c1)C 7a_100000210337_100000748629 [0,1,0,0,0,1|0,0,0]=2 4774 B12R1.226 C=C(C)COc1cccc(c1)Cl 34a_100000210295_100000748629 [0,1,0,0,0,1|0,0,0]=2 4775 B12R1.226 C=C(C)COc1cccc(c1)Cl 7a_100000210295_100000748629 [0,1,0,0,0,1|0,0,0]=2 4776 B12R1.226 C=C(C)COc1cccc(c1)F 34a_100000210426_100000748629 [0,1,0,0,0,1|0,0,0]=2 4777 B12R1.226 C=C(C)COc1cccc(c1)F 7a_100000210426_100000748629 [0,1,0,0,0,1|0,0,0]=2 4778 B12R1.226 C=C(C)COc1cccc(c1)I 34a_100000211634_100000748629 [0,1,0,0,0,1|0,0,0]=2 4779 B12R1.226 C=C(C)COc1cccc(c1)I 7a_100000211634_100000748629 [0,1,0,0,0,1|0,0,0]=2 4780 B12R1.226 C=C(C)COc1cccc(c1)N 34a_100000210217_100000748629 [0,1,0,0,0,1|0,0,0]=2 4781 B12R1.226 C=C(C)COc1cccc(n1)F 34a_100011432558_100000748629 [0,1,0,0,0,1|1,0,0]=3 4782 B12R1.226 C=C(C)COc1ccnc(c1)C 34a_100000688365_100000748629 [0,1,0,0,0,1|1,0,0]=3 4783 B12R1.226 C=C(C)COc1ccnc(c1)Cl 34a_100000762945_100000748629 [0,1,0,0,0,1|1,0,0]=3 4784 B12R1.226 C=C(C)COc1ccnc(c1)F 34a_100000732698_100000748629 [0,1,0,0,0,1|1,0,0]=3 4785 B12R1.226 C=C(C)COc1ccnc(c1)N 34a_100011834064_100000748629 [0,1,0,0,0,1|1,0,0]=3 4786 B12R1.226 C=C(C)COc1cncc(c1)Br 34a_100000754920_100000748629 [0,1,0,0,0,1|1,0,0]=3 4787 B12R1.226 C=C(C)COc1cncc(c1)Br 7a_100000754920_100000748629 [0,1,0,0,0,1|1,0,0]=3 4788 B12R1.226 C=C(C)COc1cncc(c1)C 34a_100011830280_100000748629 [0,1,0,0,0,1|1,0,0]=3 4789 B12R1.226 C=C(C)COc1cncc(c1)C 7a_100011830280_100000748629 [0,1,0,0,0,1|1,0,0]=3 4790 B12R1.226 C=C(C)COc1cncc(c1)Cl 7a_100000032511_100000748629 [0,1,0,0,0,1|1,0,0]=3 4791 B12R1.226 C=C(C)COc1cncc(c1)F 34a_100011830296_100000748629 [0,1,0,0,0,1|1,0,0]=3 4792 B12R1.226 C=C(C)COc1cncc(c1)F 7a_100011830296_100000748629 [0,1,0,0,0,1|1,0,0]=3 4793 B12R1.226 C=C(C)COc1cncc(c1)N 34a_100011997051_100000748629 [0,1,0,0,0,1|1,0,0]=3 4794 B12R1.226 C=C(C)COc1cnnc(c1)Cl 34a_200010734679_100000748629 [0,1,0,0,0,1|2,0,0]=4 4795 B12R1.226 C=C(C)COc1cnnc(c1)N 34a_200015193112_100000748629 [0,1,0,0,0,1|2,0,0]=4 4796 B12R1.226 C=C(C)CSc1c[n+](ccn1)[O-] 62a_100000748629_100009880115 [0,1,0,0,0,1|2,0,0]=4 4797 B12R1.226 C=C(C)CSc1cc(=O)[nH]cn1 62a_100012002517_100000211660 [0,1,0,0,0,1|2,0,0]=4 4798 B12R1.226 C=C(C)CSc1cc(=O)cc[nH]1 62a_100009817434_100000211660 [0,1,0,0,0,1|1,0,0]=3 4799 B12R1.226 C=C(C)CSc1cc(ccn1)C 62a_100000748629_100000750283 [0,1,0,0,0,1|1,0,0]=3 4800 B12R1.226 C=C(C)CSc1cc(ccn1)C 62a_100000750283_100000211660 [0,1,0,0,0,1|1,0,0]=3 4801 B12R1.226 C=C(C)CSc1cc(ccn1)Cl 62a_100000748629_100010167805 [0,1,0,0,0,1|1,0,0]=3 4802 B12R1.226 C=C(C)CSc1cc(ccn1)Cl 62a_100010167805_100000211660 [0,1,0,0,0,1|1,0,0]=3 4803 B12R1.226 C=C(C)CSc1cc(ccn1)F 62a_100000748629_100000764206 [0,1,0,0,0,1|1,0,0]=3 4804 B12R1.226 C=C(C)CSc1cc(ccn1)F 62a_100000764206_100000211660 [0,1,0,0,0,1|1,0,0]=3 4805 B12R1.226 C=C(C)CSc1cc(ccn1)N 62a_100000748629_100009814236 [0,1,0,0,0,1|1,0,0]=3 4806 B12R1.226 C=C(C)CSc1cc(ccn1)N 62a_100009814236_100000211660 [0,1,0,0,0,1|1,0,0]=3 4807 B12R1.226 C=C(C)CSc1cc(ccn1)O 62a_100000748629_100000762945 [0,1,0,0,0,1|1,0,0]=3 4808 B12R1.226 C=C(C)CSc1cc(cnn1)C 62a_100000070100_100000211660 [0,1,0,0,0,1|2,0,0]=4 4809 B12R1.226 C=C(C)CSc1cc(cnn1)C 62a_100000748629_100000070100 [0,1,0,0,0,1|2,0,0]=4 4810 B12R1.226 C=C(C)CSc1cc(cnn1)N 62a_100000748629_100011996757 [0,1,0,0,0,1|2,0,0]=4 4811 B12R1.226 C=C(C)CSc1cc(cnn1)N 62a_100011996757_100000211660 [0,1,0,0,0,1|2,0,0]=4 4812 B12R1.226 C=C(C)CSc1cc(cnn1)O 62a_100000748629_200010734679 [0,1,0,0,0,1|2,0,0]=4 4813 B12R1.226 C=C(C)CSc1cc(ncn1)C 62a_100000744208_100000211660 [0,1,0,0,0,1|2,0,0]=4 4814 B12R1.226 C=C(C)CSc1cc(ncn1)C 62a_100000748629_100000744208 [0,1,0,0,0,1|2,0,0]=4 4815 B12R1.226 C=C(C)CSc1cc(ncn1)Cl 62a_100000748629_100010161198 [0,1,0,0,0,1|2,0,0]=4 4816 B12R1.226 C=C(C)CSc1cc(ncn1)Cl 62a_100010161198_100000211660 [0,1,0,0,0,1|2,0,0]=4 4817 B12R1.226 C=C(C)CSc1cc(ncn1)F 62a_100000748629_200009880791 [0,1,0,0,0,1|2,0,0]=4 4818 B12R1.226 C=C(C)CSc1cc(ncn1)F 62a_200009880791_100000211660 [0,1,0,0,0,1|2,0,0]=4 4819 B12R1.226 C=C(C)CSc1cc(ncn1)N 62a_100000701291_100000211660 [0,1,0,0,0,1|2,0,0]=4 4820 B12R1.226 C=C(C)CSc1cc(ncn1)N 62a_100000748629_100000701291 [0,1,0,0,0,1|2,0,0]=4 4821 B12R1.226 C=C(C)CSc1cc(ncn1)O 62a_100000748629_100000765262 [0,1,0,0,0,1|2,0,0]=4 4822 B12R1.226 C=C(C)CSc1cc[nH]c(=O)c1 62a_100000748629_100009816521 [0,1,0,0,0,1|1,0,0]=3 4823 B12R1.226 C=C(C)CSc1cc[nH]c(=O)c1 62a_100009816521_100000211660 [0,1,0,0,0,1|1,0,0]=3 4824 B12R1.226 C=C(C)CSc1cc[nH]c(=O)n1 62a_100000748629_200000134032 [0,1,0,0,0,1|2,0,0]=4 4825 B12R1.226 C=C(C)CSc1ccc[n+](c1)C 62a_100000748629_100009996589 [0,1,0,0,0,1|1,0,0]=3 4826 B12R1.226 C=C(C)CSc1ccc[n+](c1)C 62a_100009996589_100000211660 [0,1,0,0,0,1|1,0,0]=3 4827 B12R1.226 C=C(C)CSc1ccc[n+](c1)[O-] 62a_100000748629_100009815978 [0,1,0,0,0,1|1,0,0]=3 4828 B12R1.226 C=C(C)CSc1cccc(=O)[nH]1 62a_100000748629_100000752884 [0,1,0,0,0,1|1,0,0]=3 4829 B12R1.226 C=C(C)CSc1cccc(c1)Br 62a_100000691529_100000211660 [0,1,0,0,0,1|0,0,0]=2 4830 B12R1.226 C=C(C)CSc1cccc(c1)Br 62a_100000748629_100000691529 [0,1,0,0,0,1|0,0,0]=2 4831 B12R1.226 C=C(C)CSc1cccc(c1)C 62a_100000748629_100011215228 [0,1,0,0,0,1|0,0,0]=2 4832 B12R1.226 C=C(C)CSc1cccc(c1)C 62a_100011215228_100000211660 [0,1,0,0,0,1|0,0,0]=2 4833 B12R1.226 C=C(C)CSc1cccc(c1)Cl 62a_100000699651_100000211660 [0,1,0,0,0,1|0,0,0]=2 4834 B12R1.226 C=C(C)CSc1cccc(c1)Cl 62a_100000748629_100000699651 [0,1,0,0,0,1|0,0,0]=2 4835 B12R1.226 C=C(C)CSc1cccc(c1)F 62a_100000685547_100000211660 [0,1,0,0,0,1|0,0,0]=2 4836 B12R1.226 C=C(C)CSc1cccc(c1)F 62a_100000748629_100000685547 [0,1,0,0,0,1|0,0,0]=2 4837 B12R1.226 C=C(C)CSc1cccc(c1)N 62a_100000210019_100000211660 [0,1,0,0,0,1|0,0,0]=2 4838 B12R1.226 C=C(C)CSc1cccc(c1)N 62a_100000748629_100000210019 [0,1,0,0,0,1|0,0,0]=2 4839 B12R1.226 C=C(C)CSc1cccc(c1)O 62a_100000748629_100000211634 [0,1,0,0,0,1|0,0,0]=2 4840 B12R1.226 C=C(C)CSc1cccc(c1)[S] 62a_100000748629_114929384022 [0,1,0,0,0,1|0,0,0]=2 4841 B12R1.226 C=C(C)CSc1cccc(c1)[S] 62a_114929384022_100000211660 [0,1,0,0,0,1|0,0,0]=2 4842 B12R1.226 C=C(C)CSc1cccc(n1)Br 62a_100000684672_100000211660 [0,1,0,0,0,1|1,0,0]=3 4843 B12R1.226 C=C(C)CSc1cccc(n1)Br 62a_100000748629_100000684672 [0,1,0,0,0,1|1,0,0]=3 4844 B12R1.226 C=C(C)CSc1cccc(n1)C 62a_100000742759_100000211660 [0,1,0,0,0,1|1,0,0]=3 4845 B12R1.226 C=C(C)CSc1cccc(n1)C 62a_100000748629_100000742759 [0,1,0,0,0,1|1,0,0]=3 4846 B12R1.226 C=C(C)CSc1cccc(n1)Cl 62a_100000051397_100000211660 [0,1,0,0,0,1|1,0,0]=3 4847 B12R1.226 C=C(C)CSc1cccc(n1)Cl 62a_100000748629_100000051397 [0,1,0,0,0,1|1,0,0]=3 4848 B12R1.226 C=C(C)CSc1cccc(n1)F 62a_100000748629_100009815982 [0,1,0,0,0,1|1,0,0]=3 4849 B12R1.226 C=C(C)CSc1cccc(n1)F 62a_100009815982_100000211660 [0,1,0,0,0,1|1,0,0]=3 4850 B12R1.226 C=C(C)CSc1cccc(n1)N 62a_100000740741_100000211660 [0,1,0,0,0,1|1,0,0]=3 4851 B12R1.226 C=C(C)CSc1cccc(n1)N 62a_100000748629_100000740741 [0,1,0,0,0,1|1,0,0]=3 4852 B12R1.226 C=C(C)CSc1ccnc(c1)Br 62a_100000748629_100009814637 [0,1,0,0,0,1|1,0,0]=3 4853 B12R1.226 C=C(C)CSc1ccnc(c1)Br 62a_100009814637_100000211660 [0,1,0,0,0,1|1,0,0]=3 4854 B12R1.226 C=C(C)CSc1ccnc(c1)C 62a_100000748629_100000758586 [0,1,0,0,0,1|1,0,0]=3 4855 B12R1.226 C=C(C)CSc1ccnc(c1)C 62a_100000758586_100000211660 [0,1,0,0,0,1|1,0,0]=3 4856 B12R1.226 C=C(C)CSc1ccnc(c1)Cl 62a_100000035001_100000211660 [0,1,0,0,0,1|1,0,0]=3 4857 B12R1.226 C=C(C)CSc1ccnc(c1)Cl 62a_100000748629_100000035001 [0,1,0,0,0,1|1,0,0]=3 4858 B12R1.226 C=C(C)CSc1ccnc(c1)F 62a_100000748629_100009816116 [0,1,0,0,0,1|1,0,0]=3 4859 B12R1.226 C=C(C)CSc1ccnc(c1)F 62a_100009816116_100000211660 [0,1,0,0,0,1|1,0,0]=3 4860 B12R1.226 C=C(C)CSc1ccnc(c1)N 62a_100000049665_100000211660 [0,1,0,0,0,1|1,0,0]=3 4861 B12R1.226 C=C(C)CSc1ccnc(c1)N 62a_100000748629_100000049665 [0,1,0,0,0,1|1,0,0]=3 4862 B12R1.226 C=C(C)CSc1ccnc(n1)C 62a_100000748629_100000749937 [0,1,0,0,0,1|2,0,0]=4 4863 B12R1.226 C=C(C)CSc1ccnc(n1)C 62a_100000749937_100000211660 [0,1,0,0,0,1|2,0,0]=4 4864 B12R1.226 C=C(C)CSc1ccnc(n1)Cl 62a_100000748629_100010154678 [0,1,0,0,0,1|2,0,0]=4 4865 B12R1.226 C=C(C)CSc1ccnc(n1)Cl 62a_100010154678_100000211660 [0,1,0,0,0,1|2,0,0]=4 4866 B12R1.226 C=C(C)CSc1ccnc(n1)N 62a_100000055538_100000211660 [0,1,0,0,0,1|2,0,0]=4 4867 B12R1.226 C=C(C)CSc1ccnc(n1)N 62a_100000748629_100000055538 [0,1,0,0,0,1|2,0,0]=4 4868 B12R1.226 C=C(C)CSc1cn[nH]c(=O)c1 62a_100000748629_100010197405 [0,1,0,0,0,1|2,0,0]=4 4869 B12R1.226 C=C(C)CSc1cncc(c1)Br 62a_100000728054_100000211660 [0,1,0,0,0,1|1,0,0]=3 4870 B12R1.226 C=C(C)CSc1cncc(c1)Br 62a_100000748629_100000728054 [0,1,0,0,0,1|1,0,0]=3 4871 B12R1.226 C=C(C)CSc1cncc(c1)C 62a_100000748629_100000760492 [0,1,0,0,0,1|1,0,0]=3 4872 B12R1.226 C=C(C)CSc1cncc(c1)C 62a_100000760492_100000211660 [0,1,0,0,0,1|1,0,0]=3 4873 B12R1.226 C=C(C)CSc1cncc(c1)Cl 62a_100000049639_100000211660 [0,1,0,0,0,1|1,0,0]=3 4874 B12R1.226 C=C(C)CSc1cncc(c1)Cl 62a_100000748629_100000049639 [0,1,0,0,0,1|1,0,0]=3 4875 B12R1.226 C=C(C)CSc1cncc(c1)F 62a_100000744099_100000211660 [0,1,0,0,0,1|1,0,0]=3 4876 B12R1.226 C=C(C)CSc1cncc(c1)F 62a_100000748629_100000744099 [0,1,0,0,0,1|1,0,0]=3 4877 B12R1.226 C=C(C)CSc1cncc(c1)N 62a_100000687067_100000211660 [0,1,0,0,0,1|1,0,0]=3 4878 B12R1.226 C=C(C)CSc1cncc(c1)N 62a_100000748629_100000687067 [0,1,0,0,0,1|1,0,0]=3 4879 B12R1.226 C=C(C)CSc1cncc(c1)O 62a_100000748629_100000754920 [0,1,0,0,0,1|1,0,0]=3 4880 B12R1.226 C=C(C)CSc1cncc(c1)O 62a_100000754920_100000211660 [0,1,0,0,0,1|1,0,0]=3 4881 B12R1.226 C=C(C)CSc1cncc(n1)C 62a_100000748629_100000754123 [0,1,0,0,0,1|2,0,0]=4 4882 B12R1.226 C=C(C)CSc1cncc(n1)C 62a_100000754123_100000211660 [0,1,0,0,0,1|2,0,0]=4 4883 B12R1.226 C=C(C)CSc1cncc(n1)Cl 62a_100000748629_100010892449 [0,1,0,0,0,1|2,0,0]=4 4884 B12R1.226 C=C(C)CSc1cncc(n1)Cl 62a_100010892449_100000211660 [0,1,0,0,0,1|2,0,0]=4 4885 B12R1.226 C=C(C)CSc1cncc(n1)F 62a_100000748629_200009863489 [0,1,0,0,0,1|2,0,0]=4 4886 B12R1.226 C=C(C)CSc1cncc(n1)F 62a_200009863489_100000211660 [0,1,0,0,0,1|2,0,0]=4 4887 B12R1.226 C=C(C)CSc1cncc(n1)N 62a_100000747728_100000211660 [0,1,0,0,0,1|2,0,0]=4 4888 B12R1.226 C=C(C)CSc1cncc(n1)N 62a_100000748629_100000747728 [0,1,0,0,0,1|2,0,0]=4 4889 B12R1.226 C=C(C)CSc1cncc(n1)O 62a_100000748629_100011269956 [0,1,0,0,0,1|2,0,0]=4 4890 B12R1.226 C=C(C)CSc1cnnc(c1)N 62a_100000130277_100000211660 [0,1,0,0,0,1|2,0,0]=4 4891 B12R1.226 C=C(C)CSc1cnnc(c1)N 62a_100000748629_100000130277 [0,1,0,0,0,1|2,0,0]=4 4892 B12R1.226 C=C(C)CSc1nccc(n1)C 62a_100000748629_100011243806 [0,1,0,0,0,1|2,0,0]=4 4893 B12R1.226 C=C(C)CSc1nccc(n1)C 62a_100011243806_100000211660 [0,1,0,0,0,1|2,0,0]=4 4894 B12R1.226 C=C(C)CSc1nccc(n1)N 62a_100000748629_100000757536 [0,1,0,0,0,1|2,0,0]=4 4895 B12R1.226 C=C(C)CSc1nccc(n1)N 62a_100000757536_100000211660 [0,1,0,0,0,1|2,0,0]=4 4896 B12R1.226 C=C(C)CSc1nccc(n1)O 62a_100000748629_100011649813 [0,1,0,0,0,1|2,0,0]=4 4897 B12R1.226 C=C(F)CNc1cccc(c1)Br 34a_100000210019_100009893438 [0,1,0,0,0,1|1,0,0]=3 4898 B12R1.226 C=C(F)CNc1cccc(c1)C 2230a_100000188690_100009893438 [0,1,0,0,0,1|1,0,0]=3 4899 B12R1.226 C=C(F)CNc1cccc(c1)C 34a_100000188690_100009893438 [0,1,0,0,0,1|1,0,0]=3 4900 B12R1.226 C=C(F)CNc1cccc(c1)Cl 34a_100000185859_100009893438 [0,1,0,0,0,1|1,0,0]=3 4901 B12R1.226 C=C(F)CNc1cccc(c1)F 34a_100000210047_100009893438 [0,1,0,0,0,1|1,0,0]=3 4902 B12R1.226 C=C(F)CNc1cccc(c1)I 34a_100000211102_100009893438 [0,1,0,0,0,1|1,0,0]=3 4903 B12R1.226 C=C(F)CNc1cccc(c1)O 34a_100000210217_100009893438 [0,1,0,0,0,1|1,0,0]=3 4904 B12R1.226 C=C(F)COc1cc[nH]c(=O)c1 34a_100000032262_100009893438 [0,1,0,0,0,1|2,0,0]=4 4905 B12R1.226 C=C(F)COc1ccc[n+](c1)[O-] 34a_100000039713_100009893438 [0,1,0,0,0,1|2,0,0]=4 4906 B12R1.226 C=C(F)COc1ccc[n+](c1)[O-] 7a_100000039713_100000042424 [0,1,0,0,0,1|2,0,0]=4 4907 B12R1.226 C=C(F)COc1cccc(=O)[nH]1 34a_100000033347_100009893438 [0,1,0,0,0,1|2,0,0]=4 4908 B12R1.226 C=C(F)COc1cccc(c1)Br 34a_100000210342_100009893438 [0,1,0,0,0,1|1,0,0]=3 4909 B12R1.226 C=C(F)COc1cccc(c1)Br 7a_100000210342_100000042424 [0,1,0,0,0,1|1,0,0]=3 4910 B12R1.226 C=C(F)COc1cccc(c1)C 34a_100000210337_100009893438 [0,1,0,0,0,1|1,0,0]=3 4911 B12R1.226 C=C(F)COc1cccc(c1)C 7a_100000210337_100000042424 [0,1,0,0,0,1|1,0,0]=3 4912 B12R1.226 C=C(F)COc1cccc(c1)Cl 34a_100000210295_100009893438 [0,1,0,0,0,1|1,0,0]=3 4913 B12R1.226 C=C(F)COc1cccc(c1)Cl 7a_100000210295_100000042424 [0,1,0,0,0,1|1,0,0]=3 4914 B12R1.226 C=C(F)COc1cccc(c1)F 34a_100000210426_100009893438 [0,1,0,0,0,1|1,0,0]=3 4915 B12R1.226 C=C(F)COc1cccc(c1)F 7a_100000210426_100000042424 [0,1,0,0,0,1|1,0,0]=3 4916 B12R1.226 C=C(F)COc1cccc(c1)I 34a_100000211634_100009893438 [0,1,0,0,0,1|1,0,0]=3 4917 B12R1.226 C=C(F)COc1cccc(c1)I 7a_100000211634_100000042424 [0,1,0,0,0,1|1,0,0]=3 4918 B12R1.226 C=C(F)COc1cccc(c1)N 34a_100000210217_100009893438 [0,1,0,0,0,1|1,0,0]=3 4919 B12R1.226 C=C(F)COc1cccc(n1)F 34a_100011432558_100009893438 [0,1,0,0,0,1|2,0,0]=4 4920 B12R1.226 C=C(F)COc1ccnc(c1)C 34a_100000688365_100009893438 [0,1,0,0,0,1|2,0,0]=4 4921 B12R1.226 C=C(F)COc1ccnc(c1)Cl 34a_100000762945_100009893438 [0,1,0,0,0,1|2,0,0]=4 4922 B12R1.226 C=C(F)COc1ccnc(c1)F 34a_100000732698_100009893438 [0,1,0,0,0,1|2,0,0]=4 4923 B12R1.226 C=C(F)COc1ccnc(c1)N 34a_100011834064_100009893438 [0,1,0,0,0,1|2,0,0]=4 4924 B12R1.226 C=C(F)COc1cncc(c1)Br 34a_100000754920_100009893438 [0,1,0,0,0,1|2,0,0]=4 4925 B12R1.226 C=C(F)COc1cncc(c1)Br 7a_100000754920_100000042424 [0,1,0,0,0,1|2,0,0]=4 4926 B12R1.226 C=C(F)COc1cncc(c1)C 34a_100011830280_100009893438 [0,1,0,0,0,1|2,0,0]=4 4927 B12R1.226 C=C(F)COc1cncc(c1)C 7a_100011830280_100000042424 [0,1,0,0,0,1|2,0,0]=4 4928 B12R1.226 C=C(F)COc1cncc(c1)Cl 7a_100000032511_100000042424 [0,1,0,0,0,1|2,0,0]=4 4929 B12R1.226 C=C(F)COc1cncc(c1)F 34a_100011830296_100009893438 [0,1,0,0,0,1|2,0,0]=4 4930 B12R1.226 C=C(F)COc1cncc(c1)F 7a_100011830296_100000042424 [0,1,0,0,0,1|2,0,0]=4 4931 B12R1.226 C=C(F)COc1cncc(c1)N 34a_100011997051_100009893438 [0,1,0,0,0,1|2,0,0]=4 4932 B12R1.226 C=C(F)CSc1cc(=O)cc[nH]1 62a_100009817434_100000042424 [0,1,0,0,0,1|2,0,0]=4 4933 B12R1.226 C=C(F)CSc1cc(ccn1)C 62a_100000042424_100000750283 [0,1,0,0,0,1|2,0,0]=4 4934 B12R1.226 C=C(F)CSc1cc(ccn1)C 62a_100000750283_100000042424 [0,1,0,0,0,1|2,0,0]=4 4935 B12R1.226 C=C(F)CSc1cc(ccn1)Cl 62a_100000042424_100010167805 [0,1,0,0,0,1|2,0,0]=4 4936 B12R1.226 C=C(F)CSc1cc(ccn1)Cl 62a_100010167805_100000042424 [0,1,0,0,0,1|2,0,0]=4 4937 B12R1.226 C=C(F)CSc1cc(ccn1)F 62a_100000042424_100000764206 [0,1,0,0,0,1|2,0,0]=4 4938 B12R1.226 C=C(F)CSc1cc(ccn1)F 62a_100000764206_100000042424 [0,1,0,0,0,1|2,0,0]=4 4939 B12R1.226 C=C(F)CSc1cc(ccn1)N 62a_100000042424_100009814236 [0,1,0,0,0,1|2,0,0]=4 4940 B12R1.226 C=C(F)CSc1cc(ccn1)N 62a_100009814236_100000042424 [0,1,0,0,0,1|2,0,0]=4 4941 B12R1.226 C=C(F)CSc1cc(ccn1)O 62a_100000042424_100000762945 [0,1,0,0,0,1|2,0,0]=4 4942 B12R1.226 C=C(F)CSc1cc[nH]c(=O)c1 62a_100000042424_100009816521 [0,1,0,0,0,1|2,0,0]=4 4943 B12R1.226 C=C(F)CSc1cc[nH]c(=O)c1 62a_100009816521_100000042424 [0,1,0,0,0,1|2,0,0]=4 4944 B12R1.226 C=C(F)CSc1ccc[n+](c1)C 62a_100000042424_100009996589 [0,1,0,0,0,1|2,0,0]=4 4945 B12R1.226 C=C(F)CSc1ccc[n+](c1)C 62a_100009996589_100000042424 [0,1,0,0,0,1|2,0,0]=4 4946 B12R1.226 C=C(F)CSc1ccc[n+](c1)[O-] 62a_100000042424_100009815978 [0,1,0,0,0,1|2,0,0]=4 4947 B12R1.226 C=C(F)CSc1cccc(=O)[nH]1 62a_100000042424_100000752884 [0,1,0,0,0,1|2,0,0]=4 4948 B12R1.226 C=C(F)CSc1cccc(c1)Br 62a_100000042424_100000691529 [0,1,0,0,0,1|1,0,0]=3 4949 B12R1.226 C=C(F)CSc1cccc(c1)Br 62a_100000691529_100000042424 [0,1,0,0,0,1|1,0,0]=3 4950 B12R1.226 C=C(F)CSc1cccc(c1)C 62a_100000042424_100011215228 [0,1,0,0,0,1|1,0,0]=3 4951 B12R1.226 C=C(F)CSc1cccc(c1)C 62a_100011215228_100000042424 [0,1,0,0,0,1|1,0,0]=3 4952 B12R1.226 C=C(F)CSc1cccc(c1)Cl 62a_100000042424_100000699651 [0,1,0,0,0,1|1,0,0]=3 4953 B12R1.226 C=C(F)CSc1cccc(c1)Cl 62a_100000699651_100000042424 [0,1,0,0,0,1|1,0,0]=3 4954 B12R1.226 C=C(F)CSc1cccc(c1)F 62a_100000042424_100000685547 [0,1,0,0,0,1|1,0,0]=3 4955 B12R1.226 C=C(F)CSc1cccc(c1)F 62a_100000685547_100000042424 [0,1,0,0,0,1|1,0,0]=3 4956 B12R1.226 C=C(F)CSc1cccc(c1)N 62a_100000042424_100000210019 [0,1,0,0,0,1|1,0,0]=3 4957 B12R1.226 C=C(F)CSc1cccc(c1)N 62a_100000210019_100000042424 [0,1,0,0,0,1|1,0,0]=3 4958 B12R1.226 C=C(F)CSc1cccc(c1)O 62a_100000042424_100000211634 [0,1,0,0,0,1|1,0,0]=3 4959 B12R1.226 C=C(F)CSc1cccc(c1)[S] 62a_100000042424_114929384022 [0,1,0,0,0,1|1,0,0]=3 4960 B12R1.226 C=C(F)CSc1cccc(c1)[S] 62a_114929384022_100000042424 [0,1,0,0,0,1|1,0,0]=3 4961 B12R1.226 C=C(F)CSc1cccc(n1)Br 62a_100000042424_100000684672 [0,1,0,0,0,1|2,0,0]=4 4962 B12R1.226 C=C(F)CSc1cccc(n1)Br 62a_100000684672_100000042424 [0,1,0,0,0,1|2,0,0]=4 4963 B12R1.226 C=C(F)CSc1cccc(n1)C 62a_100000042424_100000742759 [0,1,0,0,0,1|2,0,0]=4 4964 B12R1.226 C=C(F)CSc1cccc(n1)C 62a_100000742759_100000042424 [0,1,0,0,0,1|2,0,0]=4 4965 B12R1.226 C=C(F)CSc1cccc(n1)Cl 62a_100000042424_100000051397 [0,1,0,0,0,1|2,0,0]=4 4966 B12R1.226 C=C(F)CSc1cccc(n1)Cl 62a_100000051397_100000042424 [0,1,0,0,0,1|2,0,0]=4 4967 B12R1.226 C=C(F)CSc1cccc(n1)F 62a_100000042424_100009815982 [0,1,0,0,0,1|2,0,0]=4 4968 B12R1.226 C=C(F)CSc1cccc(n1)F 62a_100009815982_100000042424 [0,1,0,0,0,1|2,0,0]=4 4969 B12R1.226 C=C(F)CSc1cccc(n1)N 62a_100000042424_100000740741 [0,1,0,0,0,1|2,0,0]=4 4970 B12R1.226 C=C(F)CSc1cccc(n1)N 62a_100000740741_100000042424 [0,1,0,0,0,1|2,0,0]=4 4971 B12R1.226 C=C(F)CSc1ccnc(c1)Br 62a_100000042424_100009814637 [0,1,0,0,0,1|2,0,0]=4 4972 B12R1.226 C=C(F)CSc1ccnc(c1)Br 62a_100009814637_100000042424 [0,1,0,0,0,1|2,0,0]=4 4973 B12R1.226 C=C(F)CSc1ccnc(c1)C 62a_100000042424_100000758586 [0,1,0,0,0,1|2,0,0]=4 4974 B12R1.226 C=C(F)CSc1ccnc(c1)C 62a_100000758586_100000042424 [0,1,0,0,0,1|2,0,0]=4 4975 B12R1.226 C=C(F)CSc1ccnc(c1)Cl 62a_100000035001_100000042424 [0,1,0,0,0,1|2,0,0]=4 4976 B12R1.226 C=C(F)CSc1ccnc(c1)Cl 62a_100000042424_100000035001 [0,1,0,0,0,1|2,0,0]=4 4977 B12R1.226 C=C(F)CSc1ccnc(c1)F 62a_100000042424_100009816116 [0,1,0,0,0,1|2,0,0]=4 4978 B12R1.226 C=C(F)CSc1ccnc(c1)F 62a_100009816116_100000042424 [0,1,0,0,0,1|2,0,0]=4 4979 B12R1.226 C=C(F)CSc1ccnc(c1)N 62a_100000042424_100000049665 [0,1,0,0,0,1|2,0,0]=4 4980 B12R1.226 C=C(F)CSc1ccnc(c1)N 62a_100000049665_100000042424 [0,1,0,0,0,1|2,0,0]=4 4981 B12R1.226 C=C(F)CSc1cncc(c1)Br 62a_100000042424_100000728054 [0,1,0,0,0,1|2,0,0]=4 4982 B12R1.226 C=C(F)CSc1cncc(c1)Br 62a_100000728054_100000042424 [0,1,0,0,0,1|2,0,0]=4 4983 B12R1.226 C=C(F)CSc1cncc(c1)C 62a_100000042424_100000760492 [0,1,0,0,0,1|2,0,0]=4 4984 B12R1.226 C=C(F)CSc1cncc(c1)C 62a_100000760492_100000042424 [0,1,0,0,0,1|2,0,0]=4 4985 B12R1.226 C=C(F)CSc1cncc(c1)Cl 62a_100000042424_100000049639 [0,1,0,0,0,1|2,0,0]=4 4986 B12R1.226 C=C(F)CSc1cncc(c1)Cl 62a_100000049639_100000042424 [0,1,0,0,0,1|2,0,0]=4 4987 B12R1.226 C=C(F)CSc1cncc(c1)F 62a_100000042424_100000744099 [0,1,0,0,0,1|2,0,0]=4 4988 B12R1.226 C=C(F)CSc1cncc(c1)F 62a_100000744099_100000042424 [0,1,0,0,0,1|2,0,0]=4 4989 B12R1.226 C=C(F)CSc1cncc(c1)N 62a_100000042424_100000687067 [0,1,0,0,0,1|2,0,0]=4 4990 B12R1.226 C=C(F)CSc1cncc(c1)N 62a_100000687067_100000042424 [0,1,0,0,0,1|2,0,0]=4 4991 B12R1.226 C=C(F)CSc1cncc(c1)O 62a_100000042424_100000754920 [0,1,0,0,0,1|2,0,0]=4 4992 B12R1.226 C=C(F)CSc1cncc(c1)O 62a_100000754920_100000042424 [0,1,0,0,0,1|2,0,0]=4 4993 B12R1.226 CC(=O)/C=C/c1cccc(c1)O 271570a_203496583355_200016266566 [0,1,0,0,0,1|1,0,1]=4 4994 B12R1.226 CC(=O)C#Cc1cccc(c1)Br 1458a_100012100324_200000210301 [0,1,0,0,0,1|1,0,1]=4 4995 B12R1.226 CC(=O)C#Cc1cccc(c1)C 1458a_100011892726_200000210301 [0,1,0,0,0,1|1,0,1]=4 4996 B12R1.226 CC(=O)C#Cc1cccc(c1)Cl 1458a_100011892777_200000210301 [0,1,0,0,0,1|1,0,1]=4 4997 B12R1.226 CC(=O)C#Cc1cccc(c1)F 1458a_100011892744_200000210301 [0,1,0,0,0,1|1,0,1]=4 4998 B12R1.226 CC(=O)C#Cc1cccc(c1)O 1458a_200009909484_200000210301 [0,1,0,0,0,1|1,0,1]=4 4999 B12R1.226 CC(=O)C=Cc1cccc(c1)Br 1458a_100016258244_200000210301 [0,1,0,0,0,1|1,0,1]=4 5000 B12R1.226 CC(=O)C=Cc1cccc(c1)C 1458a_100000690095_200000210301 [0,1,0,0,0,1|1,0,1]=4 5001 B12R1.226 CC(=O)C=Cc1cccc(c1)Cl 1458a_100000184502_200000210301 [0,1,0,0,0,1|1,0,1]=4 5002 B12R1.226 CC(=O)C=Cc1cccc(c1)F 1458a_100000718793_200000210301 [0,1,0,0,0,1|1,0,1]=4 5003 B12R1.226 CC(=O)C=Cc1cccc(c1)I 1458a_100020647043_200000210301 [0,1,0,0,0,1|1,0,1]=4 5004 B12R1.226 CC(=O)CCc1cccc(c1)Br 1458a_100000070787_100011740638 [0,1,0,0,0,1|1,0,0]=3 5005 B12R1.226 CC(=O)CCc1cccc(c1)Br 1458a_100000184314_200000210301 [0,1,0,0,0,1|1,0,0]=3 5006 B12R1.226 CC(=O)CCc1cccc(c1)C 1458a_100000070787_100011713685 [0,1,0,0,0,1|1,0,0]=3 5007 B12R1.226 CC(=O)CCc1cccc(c1)C 1458a_100000234952_200000210301 [0,1,0,0,0,1|1,0,0]=3 5008 B12R1.226 CC(=O)CCc1cccc(c1)Cl 1458a_100000070787_100011713710 [0,1,0,0,0,1|1,0,0]=3 5009 B12R1.226 CC(=O)CCc1cccc(c1)Cl 1458a_100000235675_200000210301 [0,1,0,0,0,1|1,0,0]=3 5010 B12R1.226 CC(=O)CCc1cccc(c1)F 1458a_100000070787_100011217235 [0,1,0,0,0,1|1,0,0]=3 5011 B12R1.226 CC(=O)CCc1cccc(c1)F 1458a_100000235673_200000210301 [0,1,0,0,0,1|1,0,0]=3 5012 B12R1.226 CC(=O)CCc1cccc(c1)I 1458a_100010007846_200000210301 [0,1,0,0,0,1|1,0,0]=3 5013 B12R1.226 CC(=O)CCc1cccc(c1)O 1458a_100011216126_200000210301 [0,1,0,0,0,1|1,0,0]=3 5014 B12R1.226 CC(=O)CCc1cccc(c1)O 271570a_203496583355_100011279149 [0,1,0,0,0,1|1,0,0]=3 5015 B12R1.226 CC(=O)COc1cccc(c1)Br 1458a_100000182359_200000210301 [0,1,0,0,0,1|1,0,0]=3 5016 B12R1.226 CC(=O)COc1cccc(c1)C 1458a_100000183606_200000210301 [0,1,0,0,0,1|1,0,0]=3 5017 B12R1.226 CC(=O)COc1cccc(c1)Cl 1458a_100000184978_200000210301 [0,1,0,0,0,1|1,0,0]=3 5018 B12R1.226 CC(=O)COc1cccc(c1)F 1458a_100000182781_200000210301 [0,1,0,0,0,1|1,0,0]=3 5019 B12R1.226 CC(=O)CSc1cccc(c1)Br 1458a_100000760868_200000210301 [0,1,0,0,0,1|1,0,0]=3 5020 B12R1.226 CC(=O)NCc1cc(ccn1)Br 11a_100009818019_100015343762 [0,1,0,0,0,1|2,0,0]=4 5021 B12R1.226 CC(=O)NCc1cc(ccn1)Br 1626a_100009818019_100015343762 [0,1,0,0,0,1|2,0,0]=4 5022 B12R1.226 CC(=O)NCc1cc(ccn1)Br 240690a_100009818019_100015343762 [0,1,0,0,0,1|2,0,0]=4 5023 B12R1.226 CC(=O)NCc1cc(ccn1)Br 527a_100009818019_100103153847 [0,1,0,0,0,1|2,0,0]=4 5024 B12R1.226 CC(=O)NCc1cc(ccn1)C 11a_100011934573_100015343762 [0,1,0,0,0,1|2,0,0]=4 5025 B12R1.226 CC(=O)NCc1cc(ccn1)C 1626a_100011934573_100015343762 [0,1,0,0,0,1|2,0,0]=4 5026 B12R1.226 CC(=O)NCc1cc(ccn1)C 240690a_100011934573_100015343762 [0,1,0,0,0,1|2,0,0]=4 5027 B12R1.226 CC(=O)NCc1cc(ccn1)C 527a_100011934573_100103153847 [0,1,0,0,0,1|2,0,0]=4 5028 B12R1.226 CC(=O)NCc1cc(ccn1)Cl 11a_100000085674_100015343762 [0,1,0,0,0,1|2,0,0]=4 5029 B12R1.226 CC(=O)NCc1cc(ccn1)Cl 1626a_100000085674_100015343762 [0,1,0,0,0,1|2,0,0]=4 5030 B12R1.226 CC(=O)NCc1cc(ccn1)Cl 240690a_100000085674_100015343762 [0,1,0,0,0,1|2,0,0]=4 5031 B12R1.226 CC(=O)NCc1cc(ccn1)Cl 527a_100000085674_100103153847 [0,1,0,0,0,1|2,0,0]=4 5032 B12R1.226 CC(=O)NCc1cccc(=O)[nH]1 11a_100000696482_100015343762 [0,1,0,0,0,1|2,0,0]=4 5033 B12R1.226 CC(=O)NCc1cccc(=O)[nH]1 1626a_100000696482_100015343762 [0,1,0,0,0,1|2,0,0]=4 5034 B12R1.226 CC(=O)NCc1cccc(=O)[nH]1 240690a_100000696482_100015343762 [0,1,0,0,0,1|2,0,0]=4 5035 B12R1.226 CC(=O)NCc1cccc(=O)[nH]1 527a_100000696482_100103153847 [0,1,0,0,0,1|2,0,0]=4 5036 B12R1.226 CC(=O)NCc1cccc(c1)Br 11a_100000174977_100015343762 [0,1,0,0,0,1|1,0,0]=3 5037 B12R1.226 CC(=O)NCc1cccc(c1)Br 1626a_100000174977_100015343762 [0,1,0,0,0,1|1,0,0]=3 5038 B12R1.226 CC(=O)NCc1cccc(c1)Br 240690a_100000174977_100015343762 [0,1,0,0,0,1|1,0,0]=3 5039 B12R1.226 CC(=O)NCc1cccc(c1)Br 527a_100000174977_100103153847 [0,1,0,0,0,1|1,0,0]=3 5040 B12R1.226 CC(=O)NCc1cccc(c1)C 11a_100000185548_100015343762 [0,1,0,0,0,1|1,0,0]=3 5041 B12R1.226 CC(=O)NCc1cccc(c1)C 1626a_100000185548_100015343762 [0,1,0,0,0,1|1,0,0]=3 5042 B12R1.226 CC(=O)NCc1cccc(c1)C 240690a_100000185548_100015343762 [0,1,0,0,0,1|1,0,0]=3 5043 B12R1.226 CC(=O)NCc1cccc(c1)C 527a_100000185548_100103153847 [0,1,0,0,0,1|1,0,0]=3 5044 B12R1.226 CC(=O)NCc1cccc(c1)Cl 11a_100000174878_100015343762 [0,1,0,0,0,1|1,0,0]=3 5045 B12R1.226 CC(=O)NCc1cccc(c1)Cl 1626a_100000174878_100015343762 [0,1,0,0,0,1|1,0,0]=3 5046 B12R1.226 CC(=O)NCc1cccc(c1)Cl 240690a_100000174878_100015343762 [0,1,0,0,0,1|1,0,0]=3 5047 B12R1.226 CC(=O)NCc1cccc(c1)Cl 527a_100000174878_100103153847 [0,1,0,0,0,1|1,0,0]=3 5048 B12R1.226 CC(=O)NCc1cccc(c1)F 11a_100000174948_100015343762 [0,1,0,0,0,1|1,0,0]=3 5049 B12R1.226 CC(=O)NCc1cccc(c1)F 1626a_100000174948_100015343762 [0,1,0,0,0,1|1,0,0]=3 5050 B12R1.226 CC(=O)NCc1cccc(c1)F 240690a_100000174948_100015343762 [0,1,0,0,0,1|1,0,0]=3 5051 B12R1.226 CC(=O)NCc1cccc(c1)F 527a_100000174948_100103153847 [0,1,0,0,0,1|1,0,0]=3 5052 B12R1.226 CC(=O)NCc1cccc(c1)I 11a_100000106179_100015343762 [0,1,0,0,0,1|1,0,0]=3 5053 B12R1.226 CC(=O)NCc1cccc(c1)I 1626a_100000106179_100015343762 [0,1,0,0,0,1|1,0,0]=3 5054 B12R1.226 CC(=O)NCc1cccc(c1)I 240690a_100000106179_100015343762 [0,1,0,0,0,1|1,0,0]=3 5055 B12R1.226 CC(=O)NCc1cccc(c1)I 527a_100000106179_100103153847 [0,1,0,0,0,1|1,0,0]=3 5056 B12R1.226 CC(=O)NCc1cccc(c1)O 240690a_100000743036_100015343762 [0,1,0,0,0,1|1,0,0]=3 5057 B12R1.226 CC(=O)NCc1cccc(c1)O 271570a_203496583355_100000766983 [0,1,0,0,0,1|1,0,0]=3 5058 B12R1.226 CC(=O)NCc1cccc(c1)O 527a_100000743036_100103153847 [0,1,0,0,0,1|1,0,0]=3 5059 B12R1.226 CC(=O)NCc1cccc(n1)Br 11a_100016987751_100015343762 [0,1,0,0,0,1|2,0,0]=4 5060 B12R1.226 CC(=O)NCc1cccc(n1)Br 1626a_100016987751_100015343762 [0,1,0,0,0,1|2,0,0]=4 5061 B12R1.226 CC(=O)NCc1cccc(n1)Br 240690a_100016987751_100015343762 [0,1,0,0,0,1|2,0,0]=4 5062 B12R1.226 CC(=O)NCc1cccc(n1)Br 527a_100016987751_100103153847 [0,1,0,0,0,1|2,0,0]=4 5063 B12R1.226 CC(=O)NCc1cccc(n1)C 11a_100000701342_100015343762 [0,1,0,0,0,1|2,0,0]=4 5064 B12R1.226 CC(=O)NCc1cccc(n1)C 1626a_100000701342_100015343762 [0,1,0,0,0,1|2,0,0]=4 5065 B12R1.226 CC(=O)NCc1cccc(n1)C 240690a_100000701342_100015343762 [0,1,0,0,0,1|2,0,0]=4 5066 B12R1.226 CC(=O)NCc1cccc(n1)C 527a_100000701342_100103153847 [0,1,0,0,0,1|2,0,0]=4 5067 B12R1.226 CC(=O)NCc1cccc(n1)Cl 11a_100016990191_100015343762 [0,1,0,0,0,1|2,0,0]=4 5068 B12R1.226 CC(=O)NCc1cccc(n1)Cl 1626a_100016990191_100015343762 [0,1,0,0,0,1|2,0,0]=4 5069 B12R1.226 CC(=O)NCc1cccc(n1)Cl 240690a_100016990191_100015343762 [0,1,0,0,0,1|2,0,0]=4 5070 B12R1.226 CC(=O)NCc1cccc(n1)Cl 527a_100016990191_100103153847 [0,1,0,0,0,1|2,0,0]=4 5071 B12R1.226 CC(=O)NCc1cccc(n1)F 11a_100015188798_100015343762 [0,1,0,0,0,1|2,0,0]=4 5072 B12R1.226 CC(=O)NCc1cccc(n1)F 1626a_100015188798_100015343762 [0,1,0,0,0,1|2,0,0]=4 5073 B12R1.226 CC(=O)NCc1cccc(n1)F 240690a_100015188798_100015343762 [0,1,0,0,0,1|2,0,0]=4 5074 B12R1.226 CC(=O)NCc1cccc(n1)F 527a_100015188798_100103153847 [0,1,0,0,0,1|2,0,0]=4 5075 B12R1.226 CC(=O)NCc1ccnc(c1)Br 11a_100025757509_100015343762 [0,1,0,0,0,1|2,0,0]=4 5076 B12R1.226 CC(=O)NCc1ccnc(c1)Br 240690a_100025757509_100015343762 [0,1,0,0,0,1|2,0,0]=4 5077 B12R1.226 CC(=O)NCc1ccnc(c1)Br 527a_100025757509_100103153847 [0,1,0,0,0,1|2,0,0]=4 5078 B12R1.226 CC(=O)NCc1ccnc(c1)C 11a_100011934566_100015343762 [0,1,0,0,0,1|2,0,0]=4 5079 B12R1.226 CC(=O)NCc1ccnc(c1)C 1626a_100011934566_100015343762 [0,1,0,0,0,1|2,0,0]=4 5080 B12R1.226 CC(=O)NCc1ccnc(c1)C 240690a_100011934566_100015343762 [0,1,0,0,0,1|2,0,0]=4 5081 B12R1.226 CC(=O)NCc1ccnc(c1)C 527a_100011934566_100103153847 [0,1,0,0,0,1|2,0,0]=4 5082 B12R1.226 CC(=O)NCc1ccnc(c1)Cl 11a_100015205668_100015343762 [0,1,0,0,0,1|2,0,0]=4 5083 B12R1.226 CC(=O)NCc1ccnc(c1)Cl 1626a_100015205668_100015343762 [0,1,0,0,0,1|2,0,0]=4 5084 B12R1.226 CC(=O)NCc1ccnc(c1)Cl 240690a_100015205668_100015343762 [0,1,0,0,0,1|2,0,0]=4 5085 B12R1.226 CC(=O)NCc1ccnc(c1)Cl 527a_100015205668_100103153847 [0,1,0,0,0,1|2,0,0]=4 5086 B12R1.226 CC(=O)NCc1ccnc(c1)F 11a_100015188774_100015343762 [0,1,0,0,0,1|2,0,0]=4 5087 B12R1.226 CC(=O)NCc1ccnc(c1)F 1626a_100015188774_100015343762 [0,1,0,0,0,1|2,0,0]=4 5088 B12R1.226 CC(=O)NCc1ccnc(c1)F 240690a_100015188774_100015343762 [0,1,0,0,0,1|2,0,0]=4 5089 B12R1.226 CC(=O)NCc1ccnc(c1)F 527a_100015188774_100103153847 [0,1,0,0,0,1|2,0,0]=4 5090 B12R1.226 CC(=O)NCc1ccnc(c1)O 11a_100000748557_100015343762 [0,1,0,0,0,1|2,0,0]=4 5091 B12R1.226 CC(=O)NCc1ccnc(c1)O 240690a_100000748557_100015343762 [0,1,0,0,0,1|2,0,0]=4 5092 B12R1.226 CC(=O)NCc1ccnc(c1)O 527a_100000748557_100103153847 [0,1,0,0,0,1|2,0,0]=4 5093 B12R1.226 CC(=O)NCc1cncc(c1)Br 11a_100011249555_100015343762 [0,1,0,0,0,1|2,0,0]=4 5094 B12R1.226 CC(=O)NCc1cncc(c1)Br 240690a_100011249555_100015343762 [0,1,0,0,0,1|2,0,0]=4 5095 B12R1.226 CC(=O)NCc1cncc(c1)Br 527a_100011249555_100103153847 [0,1,0,0,0,1|2,0,0]=4 5096 B12R1.226 CC(=O)NCc1cncc(c1)C 11a_100000692839_100015343762 [0,1,0,0,0,1|2,0,0]=4 5097 B12R1.226 CC(=O)NCc1cncc(c1)C 1626a_100000692839_100015343762 [0,1,0,0,0,1|2,0,0]=4 5098 B12R1.226 CC(=O)NCc1cncc(c1)C 240690a_100000692839_100015343762 [0,1,0,0,0,1|2,0,0]=4 5099 B12R1.226 CC(=O)NCc1cncc(c1)C 527a_100000692839_100103153847 [0,1,0,0,0,1|2,0,0]=4 5100 B12R1.226 CC(=O)NCc1cncc(c1)Cl 11a_200020614424_100015343762 [0,1,0,0,0,1|2,0,0]=4 5101 B12R1.226 CC(=O)NCc1cncc(c1)Cl 1626a_200020614424_100015343762 [0,1,0,0,0,1|2,0,0]=4 5102 B12R1.226 CC(=O)NCc1cncc(c1)Cl 240690a_200020614424_100015343762 [0,1,0,0,0,1|2,0,0]=4 5103 B12R1.226 CC(=O)NCc1cncc(c1)Cl 527a_200020614424_100103153847 [0,1,0,0,0,1|2,0,0]=4 5104 B12R1.226 CC(=O)NCc1cncc(c1)F 11a_100011962886_100015343762 [0,1,0,0,0,1|2,0,0]=4 5105 B12R1.226 CC(=O)NCc1cncc(c1)F 1626a_100011962886_100015343762 [0,1,0,0,0,1|2,0,0]=4 5106 B12R1.226 CC(=O)NCc1cncc(c1)F 240690a_100011962886_100015343762 [0,1,0,0,0,1|2,0,0]=4 5107 B12R1.226 CC(=O)NCc1cncc(c1)F 527a_100011962886_100103153847 [0,1,0,0,0,1|2,0,0]=4 5108 B12R1.226 CC(=O)NNc1cccc(c1)Br 22a_100000217339_100000070787 [0,1,0,0,0,1|2,0,0]=4 5109 B12R1.226 CC(=O)NNc1cccc(c1)C 22a_100000681630_100000070787 [0,1,0,0,0,1|2,0,0]=4 5110 B12R1.226 CC(=O)NNc1cccc(c1)Cl 22a_100000184277_100000070787 [0,1,0,0,0,1|2,0,0]=4 5111 B12R1.226 CC(=O)NNc1cccc(c1)F 22a_100000745080_100000070787 [0,1,0,0,0,1|2,0,0]=4 5112 B12R1.226 CC(=O)NNc1cccc(c1)I 22a_100020605690_100000070787 [0,1,0,0,0,1|2,0,0]=4 5113 B12R1.226 CC(C)CNc1cccc(c1)Br 34a_100000210019_100000210624 [0,1,0,0,0,1|0,0,2]=4 5114 B12R1.226 CC(C)CNc1cccc(c1)Cl 34a_100000185859_100000210624 [0,1,0,0,0,1|0,0,2]=4 5115 B12R1.226 CC(C)CNc1cccc(c1)F 34a_100000210047_100000210624 [0,1,0,0,0,1|0,0,2]=4 5116 B12R1.226 CC(C)CNc1cccc(c1)I 34a_100000211102_100000210624 [0,1,0,0,0,1|0,0,2]=4 5117 B12R1.226 CC(C)CNc1cccc(c1)O 34a_100000210217_100000210624 [0,1,0,0,0,1|0,0,2]=4 5118 B12R1.226 CC(C)COc1cccc(c1)Br 34a_100000210342_100000210624 [0,1,0,0,0,1|0,0,2]=4 5119 B12R1.226 CC(C)COc1cccc(c1)Br 7a_100000210342_100000210760 [0,1,0,0,0,1|0,0,2]=4 5120 B12R1.226 CC(C)COc1cccc(c1)Cl 34a_100000210295_100000210624 [0,1,0,0,0,1|0,0,2]=4 5121 B12R1.226 CC(C)COc1cccc(c1)Cl 7a_100000210295_100000210760 [0,1,0,0,0,1|0,0,2]=4 5122 B12R1.226 CC(C)COc1cccc(c1)F 34a_100000210426_100000210624 [0,1,0,0,0,1|0,0,2]=4 5123 B12R1.226 CC(C)COc1cccc(c1)F 7a_100000210426_100000210760 [0,1,0,0,0,1|0,0,2]=4 5124 B12R1.226 CC(C)COc1cccc(c1)I 34a_100000211634_100000210624 [0,1,0,0,0,1|0,0,2]=4 5125 B12R1.226 CC(C)COc1cccc(c1)I 7a_100000211634_100000210760 [0,1,0,0,0,1|0,0,2]=4 5126 B12R1.226 CC(C)COc1cccc(c1)N 34a_100000210217_100000210624 [0,1,0,0,0,1|0,0,2]=4 5127 B12R1.226 CC(C)COc1cccc(c1)O 271570a_203496583355_200000170005 [0,1,0,0,0,1|0,0,2]=4 5128 B12R1.226 CC(C)CSc1cccc(c1)Br 62a_100000210624_100000691529 [0,1,0,0,0,1|0,0,2]=4 5129 B12R1.226 CC(C)CSc1cccc(c1)Br 62a_100000691529_100000210760 [0,1,0,0,0,1|0,0,2]=4 5130 B12R1.226 CC(C)CSc1cccc(c1)Cl 62a_100000210624_100000699651 [0,1,0,0,0,1|0,0,2]=4 5131 B12R1.226 CC(C)CSc1cccc(c1)Cl 62a_100000699651_100000210760 [0,1,0,0,0,1|0,0,2]=4 5132 B12R1.226 CC(C)CSc1cccc(c1)F 62a_100000210624_100000685547 [0,1,0,0,0,1|0,0,2]=4 5133 B12R1.226 CC(C)CSc1cccc(c1)F 62a_100000685547_100000210760 [0,1,0,0,0,1|0,0,2]=4 5134 B12R1.226 CC(C)CSc1cccc(c1)N 62a_100000210019_100000210760 [0,1,0,0,0,1|0,0,2]=4 5135 B12R1.226 CC(C)CSc1cccc(c1)N 62a_100000210624_100000210019 [0,1,0,0,0,1|0,0,2]=4 5136 B12R1.226 CC(C)CSc1cccc(c1)O 62a_100000210624_100000211634 [0,1,0,0,0,1|0,0,2]=4 5137 B12R1.226 CC(C)CSc1cccc(c1)[S] 62a_100000210624_114929384022 [0,1,0,0,0,1|0,0,2]=4 5138 B12R1.226 CC(C)CSc1cccc(c1)[S] 62a_114929384022_100000210760 [0,1,0,0,0,1|0,0,2]=4 5139 B12R1.226 CC(C)NCc1cccc(c1)Br 207a_100138425928_100000210085 [0,1,0,0,0,1|0,0,2]=4 5140 B12R1.226 CC(C)NCc1cccc(c1)Br 2230a_100000174977_100000210206 [0,1,0,0,0,1|0,0,2]=4 5141 B12R1.226 CC(C)NCc1cccc(c1)Br 2230a_100138425928_100000698116 [0,1,0,0,0,1|0,0,2]=4 5142 B12R1.226 CC(C)NCc1cccc(c1)Br 34a_100000174977_100000210206 [0,1,0,0,0,1|0,0,2]=4 5143 B12R1.226 CC(C)NCc1cccc(c1)Br 34a_100138425928_100000698116 [0,1,0,0,0,1|0,0,2]=4 5144 B12R1.226 CC(C)NCc1cccc(c1)Cl 207a_100138425928_100000210801 [0,1,0,0,0,1|0,0,2]=4 5145 B12R1.226 CC(C)NCc1cccc(c1)Cl 2230a_100000174878_100000210206 [0,1,0,0,0,1|0,0,2]=4 5146 B12R1.226 CC(C)NCc1cccc(c1)Cl 2230a_100138425928_100000181238 [0,1,0,0,0,1|0,0,2]=4 5147 B12R1.226 CC(C)NCc1cccc(c1)Cl 34a_100000174878_100000210206 [0,1,0,0,0,1|0,0,2]=4 5148 B12R1.226 CC(C)NCc1cccc(c1)Cl 34a_100138425928_100000187163 [0,1,0,0,0,1|0,0,2]=4 5149 B12R1.226 CC(C)NCc1cccc(c1)F 207a_100138425928_100000210812 [0,1,0,0,0,1|0,0,2]=4 5150 B12R1.226 CC(C)NCc1cccc(c1)F 2230a_100000174948_100000210206 [0,1,0,0,0,1|0,0,2]=4 5151 B12R1.226 CC(C)NCc1cccc(c1)F 2230a_100138425928_100000230114 [0,1,0,0,0,1|0,0,2]=4 5152 B12R1.226 CC(C)NCc1cccc(c1)F 34a_100000174948_100000210206 [0,1,0,0,0,1|0,0,2]=4 5153 B12R1.226 CC(C)NCc1cccc(c1)F 34a_100138425928_100000187166 [0,1,0,0,0,1|0,0,2]=4 5154 B12R1.226 CC(C)NCc1cccc(c1)I 207a_100138425928_100000014684 [0,1,0,0,0,1|0,0,2]=4 5155 B12R1.226 CC(C)NCc1cccc(c1)I 2230a_100000106179_100000210206 [0,1,0,0,0,1|0,0,2]=4 5156 B12R1.226 CC(C)NCc1cccc(c1)I 2230a_100138425928_100011218688 [0,1,0,0,0,1|0,0,2]=4 5157 B12R1.226 CC(C)NCc1cccc(c1)I 34a_100000106179_100000210206 [0,1,0,0,0,1|0,0,2]=4 5158 B12R1.226 CC(C)NCc1cccc(c1)I 34a_100138425928_100011218688 [0,1,0,0,0,1|0,0,2]=4 5159 B12R1.226 CC(C)NCc1cccc(c1)O 207a_100138425928_100000188321 [0,1,0,0,0,1|0,0,2]=4 5160 B12R1.226 CC(C)NCc1cccc(c1)O 2230a_100000743036_100000210206 [0,1,0,0,0,1|0,0,2]=4 5161 B12R1.226 CC(C)NCc1cccc(c1)O 2230a_100138425928_100011660834 [0,1,0,0,0,1|0,0,2]=4 5162 B12R1.226 CC(C)NCc1cccc(c1)O 271570a_203496583355_100000195767 [0,1,0,0,0,1|0,0,2]=4 5163 B12R1.226 CC(C)NCc1cccc(c1)O 34a_100000743036_100000210206 [0,1,0,0,0,1|0,0,2]=4 5164 B12R1.226 CC(C)NCc1cccc(c1)O 34a_100138425928_100011660834 [0,1,0,0,0,1|0,0,2]=4 5165 B12R1.226 CC(C)OCc1cccc(c1)Br 34a_100000212225_100000698116 [0,1,0,0,0,1|0,0,2]=4 5166 B12R1.226 CC(C)OCc1cccc(c1)Br 34a_100000687537_100000210206 [0,1,0,0,0,1|0,0,2]=4 5167 B12R1.226 CC(C)OCc1cccc(c1)Br 7a_100000687537_100000210206 [0,1,0,0,0,1|0,0,2]=4 5168 B12R1.226 CC(C)OCc1cccc(c1)Cl 34a_100000212225_100000187163 [0,1,0,0,0,1|0,0,2]=4 5169 B12R1.226 CC(C)OCc1cccc(c1)Cl 34a_100000241301_100000210206 [0,1,0,0,0,1|0,0,2]=4 5170 B12R1.226 CC(C)OCc1cccc(c1)Cl 7a_100000241301_100000210206 [0,1,0,0,0,1|0,0,2]=4 5171 B12R1.226 CC(C)OCc1cccc(c1)F 34a_100000210976_100000210206 [0,1,0,0,0,1|0,0,2]=4 5172 B12R1.226 CC(C)OCc1cccc(c1)F 34a_100000212225_100000187166 [0,1,0,0,0,1|0,0,2]=4 5173 B12R1.226 CC(C)OCc1cccc(c1)F 7a_100000210976_100000210206 [0,1,0,0,0,1|0,0,2]=4 5174 B12R1.226 CC(C)OCc1cccc(c1)I 34a_100000212225_100011218688 [0,1,0,0,0,1|0,0,2]=4 5175 B12R1.226 CC(C)OCc1cccc(c1)I 34a_100011215336_100000210206 [0,1,0,0,0,1|0,0,2]=4 5176 B12R1.226 CC(C)OCc1cccc(c1)I 7a_100011215336_100000210206 [0,1,0,0,0,1|0,0,2]=4 5177 B12R1.226 CC(C)OCc1cccc(c1)N 34a_100000211919_100000210206 [0,1,0,0,0,1|0,0,2]=4 5178 B12R1.226 CC(C)OCc1cccc(c1)O 34a_100000212225_100011660834 [0,1,0,0,0,1|0,0,2]=4 5179 B12R1.226 CC(C)SCc1cccc(c1)Br 62a_100000210206_100000211773 [0,1,0,0,0,1|0,0,2]=4 5180 B12R1.226 CC(C)SCc1cccc(c1)Br 62a_100000211773_100000210206 [0,1,0,0,0,1|0,0,2]=4 5181 B12R1.226 CC(C)SCc1cccc(c1)Cl 62a_100000187163_100000210206 [0,1,0,0,0,1|0,0,2]=4 5182 B12R1.226 CC(C)SCc1cccc(c1)Cl 62a_100000210206_100000187163 [0,1,0,0,0,1|0,0,2]=4 5183 B12R1.226 CC(C)SCc1cccc(c1)F 62a_100000210206_100000230114 [0,1,0,0,0,1|0,0,2]=4 5184 B12R1.226 CC(C)SCc1cccc(c1)F 62a_100000230114_100000210206 [0,1,0,0,0,1|0,0,2]=4 5185 B12R1.226 CC(C)SCc1cccc(c1)I 62a_100000210206_100011218688 [0,1,0,0,0,1|0,0,2]=4 5186 B12R1.226 CC(C)SCc1cccc(c1)I 62a_100011218688_100000210206 [0,1,0,0,0,1|0,0,2]=4 5187 B12R1.226 CC(C)SCc1cccc(c1)O 62a_100000210206_100011660834 [0,1,0,0,0,1|0,0,2]=4 5188 B12R1.226 CC(C)SCc1cccc(c1)O 62a_100011660834_100000210206 [0,1,0,0,0,1|0,0,2]=4 5189 B12R1.226 CC(O)CNc1cccc(c1)Br 34a_100000210019_100011218427 [0,1,0,0,0,1|1,0,1]=4 5190 B12R1.226 CC(O)CNc1cccc(c1)Cl 34a_100000185859_100011218427 [0,1,0,0,0,1|1,0,1]=4 5191 B12R1.226 CC(O)CNc1cccc(c1)F 34a_100000210047_100011218427 [0,1,0,0,0,1|1,0,1]=4 5192 B12R1.226 CC(O)CNc1cccc(c1)I 34a_100000211102_100011218427 [0,1,0,0,0,1|1,0,1]=4 5193 B12R1.226 CC(O)CNc1cccc(c1)O 34a_100000210217_100011218427 [0,1,0,0,0,1|1,0,1]=4 5194 B12R1.226 CC(O)COc1cccc(c1)Br 34a_100000210342_100011218427 [0,1,0,0,0,1|1,0,1]=4 5195 B12R1.226 CC(O)COc1cccc(c1)Br 7a_100000210342_100011218427 [0,1,0,0,0,1|1,0,1]=4 5196 B12R1.226 CC(O)COc1cccc(c1)Cl 34a_100000210295_100011218427 [0,1,0,0,0,1|1,0,1]=4 5197 B12R1.226 CC(O)COc1cccc(c1)Cl 7a_100000210295_100011218427 [0,1,0,0,0,1|1,0,1]=4 5198 B12R1.226 CC(O)COc1cccc(c1)F 34a_100000210426_100011218427 [0,1,0,0,0,1|1,0,1]=4 5199 B12R1.226 CC(O)COc1cccc(c1)F 7a_100000210426_100011218427 [0,1,0,0,0,1|1,0,1]=4 5200 B12R1.226 CC(O)COc1cccc(c1)I 34a_100000211634_100011218427 [0,1,0,0,0,1|1,0,1]=4 5201 B12R1.226 CC(O)COc1cccc(c1)I 7a_100000211634_100011218427 [0,1,0,0,0,1|1,0,1]=4 5202 B12R1.226 CC(O)COc1cccc(c1)N 34a_100000210217_100011218427 [0,1,0,0,0,1|1,0,1]=4 5203 B12R1.226 CC(O)CSc1cccc(c1)Br 62a_100000691529_100011218427 [0,1,0,0,0,1|1,0,1]=4 5204 B12R1.226 CC(O)CSc1cccc(c1)Br 62a_100011218427_100000691529 [0,1,0,0,0,1|1,0,1]=4 5205 B12R1.226 CC(O)CSc1cccc(c1)Cl 62a_100000699651_100011218427 [0,1,0,0,0,1|1,0,1]=4 5206 B12R1.226 CC(O)CSc1cccc(c1)Cl 62a_100011218427_100000699651 [0,1,0,0,0,1|1,0,1]=4 5207 B12R1.226 CC(O)CSc1cccc(c1)F 62a_100000685547_100011218427 [0,1,0,0,0,1|1,0,1]=4 5208 B12R1.226 CC(O)CSc1cccc(c1)F 62a_100011218427_100000685547 [0,1,0,0,0,1|1,0,1]=4 5209 B12R1.226 CC(O)CSc1cccc(c1)N 62a_100000210019_100011218427 [0,1,0,0,0,1|1,0,1]=4 5210 B12R1.226 CC(O)CSc1cccc(c1)N 62a_100011218427_100000210019 [0,1,0,0,0,1|1,0,1]=4 5211 B12R1.226 CC(O)CSc1cccc(c1)O 62a_100011218427_100000211634 [0,1,0,0,0,1|1,0,1]=4 5212 B12R1.226 CC(O)CSc1cccc(c1)[S] 62a_100011218427_114929384022 [0,1,0,0,0,1|1,0,1]=4 5213 B12R1.226 CC(O)CSc1cccc(c1)[S] 62a_114929384022_100011218427 [0,1,0,0,0,1|1,0,1]=4 5214 B12R1.226 CN(C)CCc1cccc(c1)Br 2230a_100102631434_100011740638 [0,1,0,0,0,1|1,0,1]=4 5215 B12R1.226 CN(C)CCc1cccc(c1)Br 269982a_100102631434_100011740638 [0,1,0,0,0,1|1,0,1]=4 5216 B12R1.226 CN(C)CCc1cccc(c1)Cl 2230a_100102631434_100011713710 [0,1,0,0,0,1|1,0,1]=4 5217 B12R1.226 CN(C)CCc1cccc(c1)Cl 2230a_106726388433_200000210301 [0,1,0,0,0,1|1,0,1]=4 5218 B12R1.226 CN(C)CCc1cccc(c1)Cl 269982a_100102631434_100011713710 [0,1,0,0,0,1|1,0,1]=4 5219 B12R1.226 CN(C)CCc1cccc(c1)Cl 269982a_106726388433_200000210301 [0,1,0,0,0,1|1,0,1]=4 5220 B12R1.226 CN(C)CCc1cccc(c1)Cl 34a_106726388433_200000210301 [0,1,0,0,0,1|1,0,1]=4 5221 B12R1.226 CN(C)CCc1cccc(c1)F 2230a_100102631434_100011217235 [0,1,0,0,0,1|1,0,1]=4 5222 B12R1.226 CN(C)CCc1cccc(c1)F 2230a_106726388868_200000210301 [0,1,0,0,0,1|1,0,1]=4 5223 B12R1.226 CN(C)CCc1cccc(c1)F 269982a_100102631434_100011217235 [0,1,0,0,0,1|1,0,1]=4 5224 B12R1.226 CN(C)CCc1cccc(c1)F 269982a_106726388868_200000210301 [0,1,0,0,0,1|1,0,1]=4 5225 B12R1.226 CN(C)CCc1cccc(c1)F 34a_106726388868_200000210301 [0,1,0,0,0,1|1,0,1]=4 5226 B12R1.226 CN([13CH3])CCc1cccc(c1)Cl 2230a_106726388433_200025704644 [0,1,0,0,0,1|1,0,1]=4 5227 B12R1.226 CN([13CH3])CCc1cccc(c1)Cl 269982a_106726388433_200025704644 [0,1,0,0,0,1|1,0,1]=4 5228 B12R1.226 CN([13CH3])CCc1cccc(c1)Cl 34a_106726388433_200025704644 [0,1,0,0,0,1|1,0,1]=4 5229 B12R1.226 CN([13CH3])CCc1cccc(c1)F 2230a_106726388868_200025704644 [0,1,0,0,0,1|1,0,1]=4 5230 B12R1.226 CN([13CH3])CCc1cccc(c1)F 269982a_106726388868_200025704644 [0,1,0,0,0,1|1,0,1]=4 5231 B12R1.226 CN([13CH3])CCc1cccc(c1)F 34a_106726388868_200025704644 [0,1,0,0,0,1|1,0,1]=4 5232 B12R1.226 C[C@@H](O)CNc1cccc(c1)Br 34a_100000210019_100009817552 [0,1,0,0,0,1|1,0,1]=4 5233 B12R1.226 C[C@@H](O)CNc1cccc(c1)Cl 34a_100000185859_100009817552 [0,1,0,0,0,1|1,0,1]=4 5234 B12R1.226 C[C@@H](O)CNc1cccc(c1)F 34a_100000210047_100009817552 [0,1,0,0,0,1|1,0,1]=4 5235 B12R1.226 C[C@@H](O)CNc1cccc(c1)I 34a_100000211102_100009817552 [0,1,0,0,0,1|1,0,1]=4 5236 B12R1.226 C[C@@H](O)CNc1cccc(c1)O 34a_100000210217_100009817552 [0,1,0,0,0,1|1,0,1]=4 5237 B12R1.226 C[C@@H](O)COc1cccc(c1)Br 34a_100000210342_100009817552 [0,1,0,0,0,1|1,0,1]=4 5238 B12R1.226 C[C@@H](O)COc1cccc(c1)Br 7a_100000210342_100009817552 [0,1,0,0,0,1|1,0,1]=4 5239 B12R1.226 C[C@@H](O)COc1cccc(c1)Cl 34a_100000210295_100009817552 [0,1,0,0,0,1|1,0,1]=4 5240 B12R1.226 C[C@@H](O)COc1cccc(c1)Cl 7a_100000210295_100009817552 [0,1,0,0,0,1|1,0,1]=4 5241 B12R1.226 C[C@@H](O)COc1cccc(c1)F 34a_100000210426_100009817552 [0,1,0,0,0,1|1,0,1]=4 5242 B12R1.226 C[C@@H](O)COc1cccc(c1)F 7a_100000210426_100009817552 [0,1,0,0,0,1|1,0,1]=4 5243 B12R1.226 C[C@@H](O)COc1cccc(c1)I 34a_100000211634_100009817552 [0,1,0,0,0,1|1,0,1]=4 5244 B12R1.226 C[C@@H](O)COc1cccc(c1)I 7a_100000211634_100009817552 [0,1,0,0,0,1|1,0,1]=4 5245 B12R1.226 C[C@@H](O)COc1cccc(c1)N 34a_100000210217_100009817552 [0,1,0,0,0,1|1,0,1]=4 5246 B12R1.226 C[C@@H](O)CSc1cccc(c1)Br 62a_100000691529_100009817552 [0,1,0,0,0,1|1,0,1]=4 5247 B12R1.226 C[C@@H](O)CSc1cccc(c1)Br 62a_100009817552_100000691529 [0,1,0,0,0,1|1,0,1]=4 5248 B12R1.226 C[C@@H](O)CSc1cccc(c1)Cl 62a_100000699651_100009817552 [0,1,0,0,0,1|1,0,1]=4 5249 B12R1.226 C[C@@H](O)CSc1cccc(c1)Cl 62a_100009817552_100000699651 [0,1,0,0,0,1|1,0,1]=4 5250 B12R1.226 C[C@@H](O)CSc1cccc(c1)F 62a_100000685547_100009817552 [0,1,0,0,0,1|1,0,1]=4 5251 B12R1.226 C[C@@H](O)CSc1cccc(c1)F 62a_100009817552_100000685547 [0,1,0,0,0,1|1,0,1]=4 5252 B12R1.226 C[C@@H](O)CSc1cccc(c1)N 62a_100000210019_100009817552 [0,1,0,0,0,1|1,0,1]=4 5253 B12R1.226 C[C@@H](O)CSc1cccc(c1)N 62a_100009817552_100000210019 [0,1,0,0,0,1|1,0,1]=4 5254 B12R1.226 C[C@@H](O)CSc1cccc(c1)O 62a_100009817552_100000211634 [0,1,0,0,0,1|1,0,1]=4 5255 B12R1.226 C[C@@H](O)CSc1cccc(c1)[S] 62a_100009817552_114929384022 [0,1,0,0,0,1|1,0,1]=4 5256 B12R1.226 C[C@@H](O)CSc1cccc(c1)[S] 62a_114929384022_100009817552 [0,1,0,0,0,1|1,0,1]=4 5257 B12R1.226 Cc1cccc(c1)C#CC(=O)[13CH3] 1458a_100011892726_200025704644 [0,1,0,0,0,1|1,0,1]=4 5258 B12R1.226 Cc1cccc(c1)C=CC(=O)[13CH3] 1458a_100000690095_200025704644 [0,1,0,0,0,1|1,0,1]=4 5259 B12R1.226 Cc1cccc(c1)CCC(=O)[13CH3] 1458a_100000234952_200025704644 [0,1,0,0,0,1|1,0,0]=3 5260 B12R1.226 Cc1cccc(c1)CCN(C)C 2230a_100102631434_100011713685 [0,1,0,0,0,1|1,0,1]=4 5261 B12R1.226 Cc1cccc(c1)CCN(C)C 2230a_114849113767_200000210301 [0,1,0,0,0,1|1,0,1]=4 5262 B12R1.226 Cc1cccc(c1)CCN(C)C 269982a_100102631434_100011713685 [0,1,0,0,0,1|1,0,1]=4 5263 B12R1.226 Cc1cccc(c1)CCN(C)C 269982a_114849113767_200000210301 [0,1,0,0,0,1|1,0,1]=4 5264 B12R1.226 Cc1cccc(c1)CCN(C)C 34a_114849113767_200000210301 [0,1,0,0,0,1|1,0,1]=4 5265 B12R1.226 Cc1cccc(c1)CCN(C)[13CH3] 2230a_114849113767_200025704644 [0,1,0,0,0,1|1,0,1]=4 5266 B12R1.226 Cc1cccc(c1)CCN(C)[13CH3] 269982a_114849113767_200025704644 [0,1,0,0,0,1|1,0,1]=4 5267 B12R1.226 Cc1cccc(c1)CCN(C)[13CH3] 34a_114849113767_200025704644 [0,1,0,0,0,1|1,0,1]=4 5268 B12R1.226 Cc1cccc(c1)CNC(C)C 207a_100138425928_100000211157 [0,1,0,0,0,1|0,0,2]=4 5269 B12R1.226 Cc1cccc(c1)CNC(C)C 2230a_100000185548_100000210206 [0,1,0,0,0,1|0,0,2]=4 5270 B12R1.226 Cc1cccc(c1)CNC(C)C 2230a_100138425928_100000211840 [0,1,0,0,0,1|0,0,2]=4 5271 B12R1.226 Cc1cccc(c1)CNC(C)C 34a_100000185548_100000210206 [0,1,0,0,0,1|0,0,2]=4 5272 B12R1.226 Cc1cccc(c1)CNC(C)C 34a_100138425928_100000211840 [0,1,0,0,0,1|0,0,2]=4 5273 B12R1.226 Cc1cccc(c1)COC(C)C 34a_100000212225_100000211840 [0,1,0,0,0,1|0,0,2]=4 5274 B12R1.226 Cc1cccc(c1)COC(C)C 34a_100011217746_100000210206 [0,1,0,0,0,1|0,0,2]=4 5275 B12R1.226 Cc1cccc(c1)COC(C)C 7a_100011217746_100000210206 [0,1,0,0,0,1|0,0,2]=4 5276 B12R1.226 Cc1cccc(c1)CSC(C)C 62a_100000210206_100000211840 [0,1,0,0,0,1|0,0,2]=4 5277 B12R1.226 Cc1cccc(c1)CSC(C)C 62a_100000211840_100000210206 [0,1,0,0,0,1|0,0,2]=4 5278 B12R1.226 Cc1cccc(c1)NCC(=O)N 2230a_100000188690_100000747473 [0,1,0,0,0,1|2,0,0]=4 5279 B12R1.226 Cc1cccc(c1)NCC(=O)N 34a_100000188690_100000187820 [0,1,0,0,0,1|2,0,0]=4 5280 B12R1.226 Cc1cccc(c1)NCC(=O)[O-] 34a_100000188690_100020667443 [0,1,0,0,0,1|2,0,0]=4 5281 B12R1.226 Cc1cccc(c1)NCC(C)C 2230a_100000188690_100000210760 [0,1,0,0,0,1|0,0,2]=4 5282 B12R1.226 Cc1cccc(c1)NCC(C)C 34a_100000188690_100000210624 [0,1,0,0,0,1|0,0,2]=4 5283 B12R1.226 Cc1cccc(c1)NCC(C)O 2230a_100000188690_100011218427 [0,1,0,0,0,1|1,0,1]=4 5284 B12R1.226 Cc1cccc(c1)NCC(C)O 34a_100000188690_100011218427 [0,1,0,0,0,1|1,0,1]=4 5285 B12R1.226 Cc1cccc(c1)NC[C@@H](C)O 2230a_100000188690_100009817552 [0,1,0,0,0,1|1,0,1]=4 5286 B12R1.226 Cc1cccc(c1)NC[C@@H](C)O 34a_100000188690_100009817552 [0,1,0,0,0,1|1,0,1]=4 5287 B12R1.226 Cc1cccc(c1)OCC(=O)N 34a_100000210337_100000187820 [0,1,0,0,0,1|2,0,0]=4 5288 B12R1.226 Cc1cccc(c1)OCC(=O)N 7a_100000210337_100000187820 [0,1,0,0,0,1|2,0,0]=4 5289 B12R1.226 Cc1cccc(c1)OCC(=O)[13CH3] 1458a_100000183606_200025704644 [0,1,0,0,0,1|1,0,0]=3 5290 B12R1.226 Cc1cccc(c1)OCC(=O)[O-] 34a_100000210337_100020667443 [0,1,0,0,0,1|2,0,0]=4 5291 B12R1.226 Cc1cccc(c1)OCC(C)C 34a_100000210337_100000210624 [0,1,0,0,0,1|0,0,2]=4 5292 B12R1.226 Cc1cccc(c1)OCC(C)C 7a_100000210337_100000210760 [0,1,0,0,0,1|0,0,2]=4 5293 B12R1.226 Cc1cccc(c1)OCC(C)O 34a_100000210337_100011218427 [0,1,0,0,0,1|1,0,1]=4 5294 B12R1.226 Cc1cccc(c1)OCC(C)O 7a_100000210337_100011218427 [0,1,0,0,0,1|1,0,1]=4 5295 B12R1.226 Cc1cccc(c1)OC[C@@H](C)O 34a_100000210337_100009817552 [0,1,0,0,0,1|1,0,1]=4 5296 B12R1.226 Cc1cccc(c1)OC[C@@H](C)O 7a_100000210337_100009817552 [0,1,0,0,0,1|1,0,1]=4 5297 B12R1.226 Cc1cccc(c1)SCC(=O)N 62a_100000747473_100011215228 [0,1,0,0,0,1|2,0,0]=4 5298 B12R1.226 Cc1cccc(c1)SCC(=O)N 62a_100011215228_100000747473 [0,1,0,0,0,1|2,0,0]=4 5299 B12R1.226 Cc1cccc(c1)SCC(=O)[O-] 62a_100011215228_100020667443 [0,1,0,0,0,1|2,0,0]=4 5300 B12R1.226 Cc1cccc(c1)SCC(=O)[O-] 62a_100020667443_100011215228 [0,1,0,0,0,1|2,0,0]=4 5301 B12R1.226 Cc1cccc(c1)SCC(C)C 62a_100000210624_100011215228 [0,1,0,0,0,1|0,0,2]=4 5302 B12R1.226 Cc1cccc(c1)SCC(C)C 62a_100011215228_100000210760 [0,1,0,0,0,1|0,0,2]=4 5303 B12R1.226 Cc1cccc(c1)SCC(C)O 62a_100011215228_100011218427 [0,1,0,0,0,1|1,0,1]=4 5304 B12R1.226 Cc1cccc(c1)SCC(C)O 62a_100011218427_100011215228 [0,1,0,0,0,1|1,0,1]=4 5305 B12R1.226 Cc1cccc(c1)SC[C@@H](C)O 62a_100009817552_100011215228 [0,1,0,0,0,1|1,0,1]=4 5306 B12R1.226 Cc1cccc(c1)SC[C@@H](C)O 62a_100011215228_100009817552 [0,1,0,0,0,1|1,0,1]=4 5307 B12R1.226 NC(=O)CCc1cccc(c1)O 271570a_203496583355_100000162029 [0,1,0,0,0,1|2,0,0]=4 5308 B12R1.226 NC(=O)CNc1cccc(c1)Br 34a_100000210019_100000187820 [0,1,0,0,0,1|2,0,0]=4 5309 B12R1.226 NC(=O)CNc1cccc(c1)Cl 34a_100000185859_100000187820 [0,1,0,0,0,1|2,0,0]=4 5310 B12R1.226 NC(=O)CNc1cccc(c1)F 34a_100000210047_100000187820 [0,1,0,0,0,1|2,0,0]=4 5311 B12R1.226 NC(=O)CNc1cccc(c1)I 34a_100000211102_100000187820 [0,1,0,0,0,1|2,0,0]=4 5312 B12R1.226 NC(=O)CNc1cccc(c1)O 34a_100000210217_100000187820 [0,1,0,0,0,1|2,0,0]=4 5313 B12R1.226 NC(=O)COc1cccc(c1)Br 34a_100000210342_100000187820 [0,1,0,0,0,1|2,0,0]=4 5314 B12R1.226 NC(=O)COc1cccc(c1)Br 7a_100000210342_100000187820 [0,1,0,0,0,1|2,0,0]=4 5315 B12R1.226 NC(=O)COc1cccc(c1)Cl 34a_100000210295_100000187820 [0,1,0,0,0,1|2,0,0]=4 5316 B12R1.226 NC(=O)COc1cccc(c1)Cl 7a_100000210295_100000187820 [0,1,0,0,0,1|2,0,0]=4 5317 B12R1.226 NC(=O)COc1cccc(c1)F 34a_100000210426_100000187820 [0,1,0,0,0,1|2,0,0]=4 5318 B12R1.226 NC(=O)COc1cccc(c1)F 7a_100000210426_100000187820 [0,1,0,0,0,1|2,0,0]=4 5319 B12R1.226 NC(=O)COc1cccc(c1)I 34a_100000211634_100000187820 [0,1,0,0,0,1|2,0,0]=4 5320 B12R1.226 NC(=O)COc1cccc(c1)I 7a_100000211634_100000187820 [0,1,0,0,0,1|2,0,0]=4 5321 B12R1.226 NC(=O)COc1cccc(c1)N 34a_100000210217_100000187820 [0,1,0,0,0,1|2,0,0]=4 5322 B12R1.226 NC(=O)COc1cccc(c1)O 271570a_203496583355_200000150604 [0,1,0,0,0,1|2,0,0]=4 5323 B12R1.226 NC(=O)CSc1cccc(c1)Br 62a_100000691529_100000747473 [0,1,0,0,0,1|2,0,0]=4 5324 B12R1.226 NC(=O)CSc1cccc(c1)Br 62a_100000747473_100000691529 [0,1,0,0,0,1|2,0,0]=4 5325 B12R1.226 NC(=O)CSc1cccc(c1)Cl 62a_100000699651_100000747473 [0,1,0,0,0,1|2,0,0]=4 5326 B12R1.226 NC(=O)CSc1cccc(c1)Cl 62a_100000747473_100000699651 [0,1,0,0,0,1|2,0,0]=4 5327 B12R1.226 NC(=O)CSc1cccc(c1)F 62a_100000685547_100000747473 [0,1,0,0,0,1|2,0,0]=4 5328 B12R1.226 NC(=O)CSc1cccc(c1)F 62a_100000747473_100000685547 [0,1,0,0,0,1|2,0,0]=4 5329 B12R1.226 NC(=O)CSc1cccc(c1)N 62a_100000210019_100000747473 [0,1,0,0,0,1|2,0,0]=4 5330 B12R1.226 NC(=O)CSc1cccc(c1)N 62a_100000747473_100000210019 [0,1,0,0,0,1|2,0,0]=4 5331 B12R1.226 NC(=O)CSc1cccc(c1)O 62a_100000747473_100000211634 [0,1,0,0,0,1|2,0,0]=4 5332 B12R1.226 NC(=O)CSc1cccc(c1)[S] 62a_100000747473_114929384022 [0,1,0,0,0,1|2,0,0]=4 5333 B12R1.226 NC(=O)CSc1cccc(c1)[S] 62a_114929384022_100000747473 [0,1,0,0,0,1|2,0,0]=4 5334 B12R1.226 Nc1cccc(c1)OCC(=O)[O-] 34a_100000210217_100020667443 [0,1,0,0,0,1|2,0,0]=4 5335 B12R1.226 Nc1cccc(c1)SCC(=O)[O-] 62a_100000210019_100020667443 [0,1,0,0,0,1|2,0,0]=4 5336 B12R1.226 Nc1cccc(c1)SCC(=O)[O-] 62a_100020667443_100000210019 [0,1,0,0,0,1|2,0,0]=4 5337 B12R1.226 O=C([O-])CNc1cccc(c1)Br 34a_100000210019_100020667443 [0,1,0,0,0,1|2,0,0]=4 5338 B12R1.226 O=C([O-])CNc1cccc(c1)Cl 34a_100000185859_100020667443 [0,1,0,0,0,1|2,0,0]=4 5339 B12R1.226 O=C([O-])CNc1cccc(c1)F 34a_100000210047_100020667443 [0,1,0,0,0,1|2,0,0]=4 5340 B12R1.226 O=C([O-])CNc1cccc(c1)I 34a_100000211102_100020667443 [0,1,0,0,0,1|2,0,0]=4 5341 B12R1.226 O=C([O-])CNc1cccc(c1)O 34a_100000210217_100020667443 [0,1,0,0,0,1|2,0,0]=4 5342 B12R1.226 O=C([O-])COc1cccc(c1)Br 34a_100000210342_100020667443 [0,1,0,0,0,1|2,0,0]=4 5343 B12R1.226 O=C([O-])COc1cccc(c1)Cl 34a_100000210295_100020667443 [0,1,0,0,0,1|2,0,0]=4 5344 B12R1.226 O=C([O-])COc1cccc(c1)F 34a_100000210426_100020667443 [0,1,0,0,0,1|2,0,0]=4 5345 B12R1.226 O=C([O-])COc1cccc(c1)I 34a_100000211634_100020667443 [0,1,0,0,0,1|2,0,0]=4 5346 B12R1.226 O=C([O-])CSc1cccc(c1)Br 62a_100000691529_100020667443 [0,1,0,0,0,1|2,0,0]=4 5347 B12R1.226 O=C([O-])CSc1cccc(c1)Br 62a_100020667443_100000691529 [0,1,0,0,0,1|2,0,0]=4 5348 B12R1.226 O=C([O-])CSc1cccc(c1)Cl 62a_100000699651_100020667443 [0,1,0,0,0,1|2,0,0]=4 5349 B12R1.226 O=C([O-])CSc1cccc(c1)Cl 62a_100020667443_100000699651 [0,1,0,0,0,1|2,0,0]=4 5350 B12R1.226 O=C([O-])CSc1cccc(c1)F 62a_100000685547_100020667443 [0,1,0,0,0,1|2,0,0]=4 5351 B12R1.226 O=C([O-])CSc1cccc(c1)F 62a_100020667443_100000685547 [0,1,0,0,0,1|2,0,0]=4 5352 B12R1.226 O=C([O-])CSc1cccc(c1)O 62a_100020667443_100000211634 [0,1,0,0,0,1|2,0,0]=4 5353 B12R1.226 O=C([O-])CSc1cccc(c1)[S] 62a_100020667443_114929384022 [0,1,0,0,0,1|2,0,0]=4 5354 B12R1.226 O=C([O-])CSc1cccc(c1)[S] 62a_114929384022_100020667443 [0,1,0,0,0,1|2,0,0]=4 5355 B12R1.226 [13CH3]C(=O)C#Cc1cccc(c1)Br 1458a_100012100324_200025704644 [0,1,0,0,0,1|1,0,1]=4 5356 B12R1.226 [13CH3]C(=O)C#Cc1cccc(c1)Cl 1458a_100011892777_200025704644 [0,1,0,0,0,1|1,0,1]=4 5357 B12R1.226 [13CH3]C(=O)C#Cc1cccc(c1)F 1458a_100011892744_200025704644 [0,1,0,0,0,1|1,0,1]=4 5358 B12R1.226 [13CH3]C(=O)C#Cc1cccc(c1)O 1458a_200009909484_200025704644 [0,1,0,0,0,1|1,0,1]=4 5359 B12R1.226 [13CH3]C(=O)C=Cc1cccc(c1)Br 1458a_100016258244_200025704644 [0,1,0,0,0,1|1,0,1]=4 5360 B12R1.226 [13CH3]C(=O)C=Cc1cccc(c1)Cl 1458a_100000184502_200025704644 [0,1,0,0,0,1|1,0,1]=4 5361 B12R1.226 [13CH3]C(=O)C=Cc1cccc(c1)F 1458a_100000718793_200025704644 [0,1,0,0,0,1|1,0,1]=4 5362 B12R1.226 [13CH3]C(=O)C=Cc1cccc(c1)I 1458a_100020647043_200025704644 [0,1,0,0,0,1|1,0,1]=4 5363 B12R1.226 [13CH3]C(=O)CCc1cccc(c1)Br 1458a_100000184314_200025704644 [0,1,0,0,0,1|1,0,0]=3 5364 B12R1.226 [13CH3]C(=O)CCc1cccc(c1)Cl 1458a_100000235675_200025704644 [0,1,0,0,0,1|1,0,0]=3 5365 B12R1.226 [13CH3]C(=O)CCc1cccc(c1)F 1458a_100000235673_200025704644 [0,1,0,0,0,1|1,0,0]=3 5366 B12R1.226 [13CH3]C(=O)CCc1cccc(c1)I 1458a_100010007846_200025704644 [0,1,0,0,0,1|1,0,0]=3 5367 B12R1.226 [13CH3]C(=O)CCc1cccc(c1)O 1458a_100011216126_200025704644 [0,1,0,0,0,1|1,0,0]=3 5368 B12R1.226 [13CH3]C(=O)COc1cccc(c1)Br 1458a_100000182359_200025704644 [0,1,0,0,0,1|1,0,0]=3 5369 B12R1.226 [13CH3]C(=O)COc1cccc(c1)Cl 1458a_100000184978_200025704644 [0,1,0,0,0,1|1,0,0]=3 5370 B12R1.226 [13CH3]C(=O)COc1cccc(c1)F 1458a_100000182781_200025704644 [0,1,0,0,0,1|1,0,0]=3 5371 B12R1.226 [13CH3]C(=O)CSc1cccc(c1)Br 1458a_100000760868_200025704644 [0,1,0,0,0,1|1,0,0]=3 5372 B12R1.891 CC(C)(C)CNc1ccccc1 34a_100000106764_100011219605 [0,1,0,0,0,1|0,0,2]=4 5373 B12R1.891 CC(C)(C)COc1ccccc1 34a_100000210340_100011219605 [0,1,0,0,0,1|0,0,2]=4 5374 B12R1.891 CC(C)(C)CSc1ccccc1 62a_100000719477_100011219605 [0,1,0,0,0,1|0,0,2]=4 5375 B12R1.891 CC(C)(C)CSc1ccccc1 62a_100011219605_100000041952 [0,1,0,0,0,1|0,0,2]=4 5376 B12R1.891 CC(C)(C)NCc1ccccc1 207a_100000715429_100015611070 [0,1,0,0,0,1|0,0,2]=4 5377 B12R1.891 CC(C)(C)NCc1ccccc1 2230a_100000715429_100015291786 [0,1,0,0,0,1|0,0,2]=4 5378 B12R1.891 CC(C)(C)NCc1ccccc1 34a_100015324214_100000210625 [0,1,0,0,0,1|0,0,2]=4 5379 B12R1.891 CC(C)(C)OCc1ccccc1 34a_100000210790_100000210625 [0,1,0,0,0,1|0,0,2]=4 5380 B12R1.891 CC(C)(C)OCc1ccccc1 34a_100015890283_100015291786 [0,1,0,0,0,1|0,0,2]=4 5381 B12R1.891 CC(C)(C)OCc1ccccc1 7a_100015890283_100000211182 [0,1,0,0,0,1|0,0,2]=4 5382 B12R1.891 CC(C)(C)SCc1ccccc1 62a_100000211182_100000211941 [0,1,0,0,0,1|0,0,2]=4 5383 B12R1.891 CC(C)(C)SCc1ccccc1 62a_100000211941_100015291786 [0,1,0,0,0,1|0,0,2]=4 5384 B12R1.891 CC(C)(F)CNc1ccccc1 34a_100000106764_100011997219 [0,1,0,0,0,1|0,0,2]=4 5385 B12R1.891 CC(C)(F)COc1ccccc1 34a_100000210340_100011997219 [0,1,0,0,0,1|0,0,2]=4 5386 B12R1.891 CC(C)(F)CSc1ccccc1 62a_100000719477_100011997219 [0,1,0,0,0,1|0,0,2]=4 5387 B12R1.891 CC(C)(F)CSc1ccccc1 62a_100011997219_100000041952 [0,1,0,0,0,1|0,0,2]=4 5388 B12R1.891 CC(C)(O)CNc1ccccc1 34a_100000106764_100000764493 [0,1,0,0,0,1|0,0,2]=4 5389 B12R1.891 CC(C)(O)COc1ccccc1 34a_100000210340_100000764493 [0,1,0,0,0,1|0,0,2]=4 5390 B12R1.891 CC(C)(O)COc1ccccc1 7a_100000210340_100000764493 [0,1,0,0,0,1|0,0,2]=4 5391 B12R1.891 CC(C)(O)CSc1ccccc1 62a_100000719477_100000764493 [0,1,0,0,0,1|0,0,2]=4 5392 B12R1.891 CC(C)(O)CSc1ccccc1 62a_100000764493_100000041952 [0,1,0,0,0,1|0,0,2]=4 5393 B12R1.891 CS(=O)(=O)NCc1ccccc1 40a_100015324214_100000738038 [0,1,0,0,0,1|2,0,0]=4 5394 B12R1.891 C[N+](C)(C)CSc1ccccc1 62a_100000719477_200000036245 [0,1,0,0,0,1|1,0,1]=4 5395 B12R1.891 C[N+](C)(C)CSc1ccccc1 62a_200000036245_100000041952 [0,1,0,0,0,1|1,0,1]=4 5396 B12R1.891 C[Si](C)(C)COc1ccccc1 7a_100000210340_100000233785 [0,1,0,0,0,1|0,1,1]=4 5397 B12R1.891 C[Si](C)(C)CSc1ccccc1 62a_100000037933_100000041952 [0,1,0,0,0,1|0,1,1]=4 5398 B12R1.891 C[Si](C)(C)CSc1ccccc1 62a_100000719477_100000037933 [0,1,0,0,0,1|0,1,1]=4 5399 B12R1.4 C#Cc1ccc(cc1)CC(=O)C 1458a_100000070787_100000140223 [0,2,0,0,0,0|1,0,0]=3 5400 B12R1.4 C#Cc1ccc(cc1)CC(=O)C 1458a_200009884166_200000210301 [0,2,0,0,0,0|1,0,0]=3 5401 B12R1.4 C#Cc1ccc(cc1)CC(=O)[13CH3] 1458a_200009884166_200025704644 [0,2,0,0,0,0|1,0,0]=3 5402 B12R1.4 C#Cc1ccc(cc1)CN(C)C 2230a_100102631434_100000140223 [0,2,0,0,0,0|1,0,1]=4 5403 B12R1.4 C#Cc1ccc(cc1)CN(C)C 269982a_100102631434_100000140223 [0,2,0,0,0,0|1,0,1]=4 5404 B12R1.4 C#Cc1ccc(cc1)CN(C)C 270004a_100102631434_100011361452 [0,2,0,0,0,0|1,0,1]=4 5405 B12R1.4 C#Cc1ccc(cc1)NC(=O)C 11a_100011215031_100015343762 [0,2,0,0,0,0|2,0,0]=4 5406 B12R1.4 C#Cc1ccc(cc1)NC(=O)C 1626a_100011215031_100015343762 [0,2,0,0,0,0|2,0,0]=4 5407 B12R1.4 C#Cc1ccc(cc1)NC(=O)C 22a_100011215031_100000070787 [0,2,0,0,0,0|2,0,0]=4 5408 B12R1.4 C#Cc1ccc(cc1)NC(=O)C 527a_100011215031_100103153847 [0,2,0,0,0,0|2,0,0]=4 5409 B12R1.4 C=Cc1ccc(cc1)CC(=O)C 1458a_100000070787_100000034074 [0,2,0,0,0,0|1,0,0]=3 5410 B12R1.4 C=Cc1ccc(cc1)CC(=O)C 271570a_100011290941_100000691760 [0,2,0,0,0,0|1,0,0]=3 5411 B12R1.4 C=Cc1ccc(cc1)CC(=O)N 271570a_100011290941_100000162331 [0,2,0,0,0,0|2,0,0]=4 5412 B12R1.4 C=Cc1ccc(cc1)CC(C)C 271570a_100011290941_100011221366 [0,2,0,0,0,0|0,0,2]=4 5413 B12R1.4 C=Cc1ccc(cc1)CN(C)C 2230a_100102631434_100000034074 [0,2,0,0,0,0|1,0,1]=4 5414 B12R1.4 C=Cc1ccc(cc1)CN(C)C 269982a_100102631434_100000034074 [0,2,0,0,0,0|1,0,1]=4 5415 B12R1.4 C=Cc1ccc(cc1)CN(C)C 270004a_100102631434_100011361436 [0,2,0,0,0,0|1,0,1]=4 5416 B12R1.4 C=Cc1ccc(cc1)CN(C)C 271570a_100011290941_100000174694 [0,2,0,0,0,0|1,0,1]=4 5417 B12R1.4 C=Cc1ccc(cc1)NC(=O)C 11a_100011218248_100015343762 [0,2,0,0,0,0|2,0,0]=4 5418 B12R1.4 C=Cc1ccc(cc1)NC(=O)C 1626a_100011218248_100015343762 [0,2,0,0,0,0|2,0,0]=4 5419 B12R1.4 C=Cc1ccc(cc1)NC(=O)C 22a_100011218248_100000070787 [0,2,0,0,0,0|2,0,0]=4 5420 B12R1.4 C=Cc1ccc(cc1)NC(=O)C 271570a_100011290941_100000155215 [0,2,0,0,0,0|2,0,0]=4 5421 B12R1.4 C=Cc1ccc(cc1)NC(=O)C 527a_100011218248_100103153847 [0,2,0,0,0,0|2,0,0]=4 5422 B12R1.4 C=Cc1ccc(cc1)OC(=O)C 271570a_100011290941_100000002173 [0,2,0,0,0,0|2,0,0]=4 5423 B12R1.4 C=Cc1ccc(cc1)OC(=S)C 271570a_100011290941_200009816735 [0,2,0,0,0,0|2,0,0]=4 5424 B12R1.4 C=Cc1ccc(cc1)SC(=O)C 271570a_100011290941_200009995050 [0,2,0,0,0,0|2,0,0]=4 5425 B12R1.4 CC(=Cc1ccc(cc1)C#N)C 271570a_100102525489_100000179745 [0,2,0,0,0,0|0,0,2]=4 5426 B12R1.4 CC(=Cc1ccc(cc1)C=O)C 271570a_100102525489_100000186029 [0,2,0,0,0,0|0,0,2]=4 5427 B12R1.4 CC(=Cc1ccc(cc1)CF)C 271570a_100102525489_100010268989 [0,2,0,0,0,0|0,0,2]=4 5428 B12R1.4 CC(=Cc1ccc(cc1)CN)C 271570a_100102525489_100016989417 [0,2,0,0,0,0|0,0,2]=4 5429 B12R1.4 CC(=Cc1ccc(cc1)CO)C 271570a_100102525489_100000690907 [0,2,0,0,0,0|0,0,2]=4 5430 B12R1.4 CC(=Cc1ccc(cc1)NN)C 271570a_100102525489_100016988836 [0,2,0,0,0,0|0,0,2]=4 5431 B12R1.4 CC(=O)Cc1ccc(cc1)C#N 1458a_100000070787_100000184898 [0,2,0,0,0,0|1,0,0]=3 5432 B12R1.4 CC(=O)Cc1ccc(cc1)C#N 1458a_100000748677_200000210301 [0,2,0,0,0,0|1,0,0]=3 5433 B12R1.4 CC(=O)Cc1ccc(cc1)C=O 1458a_100000070787_100000075337 [0,2,0,0,0,0|1,0,0]=3 5434 B12R1.4 CC(=O)Cc1ccc(cc1)CO 1458a_100000070787_100000067286 [0,2,0,0,0,0|1,0,0]=3 5435 B12R1.4 CC(=O)Cc1ccc(cc1)CO 1458a_100011356463_200000210301 [0,2,0,0,0,0|1,0,0]=3 5436 B12R1.4 CC(=O)Cc1ccc(cc1)O[13CH3] 34a_100011218180_200025704644 [0,2,0,0,0,0|1,0,0]=3 5437 B12R1.4 CC(=O)Cc1ccc(cc1)O[13CH3] 7a_100011218180_200025704644 [0,2,0,0,0,0|1,0,0]=3 5438 B12R1.4 CC(=O)Cc1ccc(cc1)S[13CH3] 62a_100000691760_200025704644 [0,2,0,0,0,0|1,0,0]=3 5439 B12R1.4 CC(=O)Cc1ccc(cc1)S[13CH3] 62a_200025704644_100000691760 [0,2,0,0,0,0|1,0,0]=3 5440 B12R1.4 CC(=O)Cc1ccc(cn1)C#N 1458a_100000070787_100000693164 [0,2,0,0,0,0|2,0,0]=4 5441 B12R1.4 CC(=O)Cc1ccc(nc1)C#N 1458a_100000070787_100009816919 [0,2,0,0,0,0|2,0,0]=4 5442 B12R1.4 CC(=O)Nc1ccc(cc1)C#N 11a_100000185469_100015343762 [0,2,0,0,0,0|2,0,0]=4 5443 B12R1.4 CC(=O)Nc1ccc(cc1)C#N 1626a_100000185469_100015343762 [0,2,0,0,0,0|2,0,0]=4 5444 B12R1.4 CC(=O)Nc1ccc(cc1)CO 22a_100011215238_100000070787 [0,2,0,0,0,0|2,0,0]=4 5445 B12R1.4 CC(=O)Nc1ccc(cc1)N[13CH3] 34a_100000184111_200025704644 [0,2,0,0,0,0|2,0,0]=4 5446 B12R1.4 CC(=O)Nc1ccc(cc1)O[13CH3] 34a_100000184395_200025704644 [0,2,0,0,0,0|2,0,0]=4 5447 B12R1.4 CC(=O)Nc1ccc(cc1)O[13CH3] 7a_100000184395_200025704644 [0,2,0,0,0,0|2,0,0]=4 5448 B12R1.4 CC(=O)Nc1ccc(cc1)S[13CH3] 62a_200025704644_100000155215 [0,2,0,0,0,0|2,0,0]=4 5449 B12R1.4 CC(=O)Oc1ccc(cc1)S[13CH3] 62a_200025704644_100000002173 [0,2,0,0,0,0|2,0,0]=4 5450 B12R1.4 CC(=O)Sc1ccc(cc1)S[13CH3] 62a_200009995050_200025704644 [0,2,0,0,0,0|2,0,0]=4 5451 B12R1.4 CC(=S)Oc1ccc(cc1)S[13CH3] 62a_200025704644_200009816735 [0,2,0,0,0,0|2,0,0]=4 5452 B12R1.4 CC(C)Cc1ccc(cc1)N[13CH3] 2230a_100000687309_200025704644 [0,2,0,0,0,0|0,0,2]=4 5453 B12R1.4 CC(C)Cc1ccc(cc1)N[13CH3] 34a_100000687309_200025704644 [0,2,0,0,0,0|0,0,2]=4 5454 B12R1.4 CC(C)Cc1ccc(cc1)S[13CH3] 62a_100011221366_200025704644 [0,2,0,0,0,0|0,0,2]=4 5455 B12R1.4 CC(C)Cc1ccc(cc1)S[13CH3] 62a_200025704644_100011221366 [0,2,0,0,0,0|0,0,2]=4 5456 B12R1.4 CC(N)Cc1ccc(cc1)O[13CH3] 34a_100102634573_200025704644 [0,2,0,0,0,0|1,0,1]=4 5457 B12R1.4 CCc1ccc(cc1)C=C(C)C 271570a_100102525489_100011215824 [0,2,0,0,0,0|0,0,2]=4 5458 B12R1.4 CCc1ccc(cc1)CC(=O)C 1458a_100000070787_100000747183 [0,2,0,0,0,0|1,0,0]=3 5459 B12R1.4 CCc1ccc(cc1)CC(=O)C 1458a_200000759805_200000210301 [0,2,0,0,0,0|1,0,0]=3 5460 B12R1.4 CCc1ccc(cc1)CC(=O)[13CH3] 1458a_200000759805_200025704644 [0,2,0,0,0,0|1,0,0]=3 5461 B12R1.4 CCc1ccc(cc1)CN(C)C 2230a_100000683253_200000210301 [0,2,0,0,0,0|1,0,1]=4 5462 B12R1.4 CCc1ccc(cc1)CN(C)C 2230a_100102631434_100000747183 [0,2,0,0,0,0|1,0,1]=4 5463 B12R1.4 CCc1ccc(cc1)CN(C)C 269982a_100000683253_200000210301 [0,2,0,0,0,0|1,0,1]=4 5464 B12R1.4 CCc1ccc(cc1)CN(C)C 269982a_100102631434_100000747183 [0,2,0,0,0,0|1,0,1]=4 5465 B12R1.4 CCc1ccc(cc1)CN(C)C 270004a_100102631434_100000211036 [0,2,0,0,0,0|1,0,1]=4 5466 B12R1.4 CCc1ccc(cc1)CN(C)[13CH3] 2230a_100000683253_200025704644 [0,2,0,0,0,0|1,0,1]=4 5467 B12R1.4 CCc1ccc(cc1)CN(C)[13CH3] 269982a_100000683253_200025704644 [0,2,0,0,0,0|1,0,1]=4 5468 B12R1.4 CCc1ccc(cc1)NC(=O)C 11a_100000211069_100015343762 [0,2,0,0,0,0|2,0,0]=4 5469 B12R1.4 CCc1ccc(cc1)NC(=O)C 1626a_100000211069_100015343762 [0,2,0,0,0,0|2,0,0]=4 5470 B12R1.4 CCc1ccc(cc1)NC(=O)C 22a_100000211069_100000070787 [0,2,0,0,0,0|2,0,0]=4 5471 B12R1.4 CCc1ccc(cc1)NC(=O)C 527a_100000211069_100103153847 [0,2,0,0,0,0|2,0,0]=4 5472 B12R1.4 CN(C)Cc1ccc(cc1)C#N 2230a_100000217971_200000210301 [0,2,0,0,0,0|1,0,1]=4 5473 B12R1.4 CN(C)Cc1ccc(cc1)C#N 2230a_100102631434_100000184898 [0,2,0,0,0,0|1,0,1]=4 5474 B12R1.4 CN(C)Cc1ccc(cc1)C#N 269982a_100000217971_200000210301 [0,2,0,0,0,0|1,0,1]=4 5475 B12R1.4 CN(C)Cc1ccc(cc1)C#N 269982a_100102631434_100000184898 [0,2,0,0,0,0|1,0,1]=4 5476 B12R1.4 CN(C)Cc1ccc(cc1)C#N 270004a_100102631434_100000211122 [0,2,0,0,0,0|1,0,1]=4 5477 B12R1.4 CN(C)Cc1ccc(cc1)C#N 34a_100000217971_200000210301 [0,2,0,0,0,0|1,0,1]=4 5478 B12R1.4 CN(C)Cc1ccc(cc1)C=O 2230a_100102631434_100009816848 [0,2,0,0,0,0|1,0,1]=4 5479 B12R1.4 CN(C)Cc1ccc(cc1)C=O 269982a_100102631434_100009816848 [0,2,0,0,0,0|1,0,1]=4 5480 B12R1.4 CN(C)Cc1ccc(cc1)CO 2230a_100102631434_100000067286 [0,2,0,0,0,0|1,0,1]=4 5481 B12R1.4 CN(C)Cc1ccc(cc1)CO 269982a_100102631434_100000067286 [0,2,0,0,0,0|1,0,1]=4 5482 B12R1.4 CN(C)Cc1ccc(cc1)CO 270004a_100102631434_100009832023 [0,2,0,0,0,0|1,0,1]=4 5483 B12R1.4 CN(C)Cc1ccc(cc1)S[13CH3] 62a_100000174694_200025704644 [0,2,0,0,0,0|1,0,1]=4 5484 B12R1.4 CN(C)Cc1ccc(cc1)S[13CH3] 62a_200025704644_100000174694 [0,2,0,0,0,0|1,0,1]=4 5485 B12R1.4 CN([13CH3])Cc1ccc(cc1)C#N 2230a_100000217971_200025704644 [0,2,0,0,0,0|1,0,1]=4 5486 B12R1.4 CN([13CH3])Cc1ccc(cc1)C#N 269982a_100000217971_200025704644 [0,2,0,0,0,0|1,0,1]=4 5487 B12R1.4 CN([13CH3])Cc1ccc(cc1)C#N 34a_100000217971_200025704644 [0,2,0,0,0,0|1,0,1]=4 5488 B12R1.4 CNc1ccc(cc1)C=C(C)C 271570a_100102525489_100000219623 [0,2,0,0,0,0|0,0,2]=4 5489 B12R1.4 CNc1ccc(cc1)CC(=O)N 2230a_100000738315_200000210301 [0,2,0,0,0,0|2,0,0]=4 5490 B12R1.4 CNc1ccc(cc1)CC(=O)N 34a_100000738315_200000210301 [0,2,0,0,0,0|2,0,0]=4 5491 B12R1.4 CNc1ccc(cc1)CC(C)C 2230a_100000687309_200000210301 [0,2,0,0,0,0|0,0,2]=4 5492 B12R1.4 CNc1ccc(cc1)CC(C)C 34a_100000687309_200000210301 [0,2,0,0,0,0|0,0,2]=4 5493 B12R1.4 CNc1ccc(cc1)NC(=O)C 34a_100000184111_200000210301 [0,2,0,0,0,0|2,0,0]=4 5494 B12R1.4 COc1ccc(cc1)C=C(C)C 271570a_100102525489_100000171711 [0,2,0,0,0,0|0,0,2]=4 5495 B12R1.4 COc1ccc(cc1)CC(=O)C 1458a_100000210706_200000210301 [0,2,0,0,0,0|1,0,0]=3 5496 B12R1.4 COc1ccc(cc1)CC(=O)C 34a_100011218180_200000210301 [0,2,0,0,0,0|1,0,0]=3 5497 B12R1.4 COc1ccc(cc1)CC(=O)C 7a_100011218180_200000210301 [0,2,0,0,0,0|1,0,0]=3 5498 B12R1.4 COc1ccc(cc1)CC(=O)N 34a_100000020825_200000210301 [0,2,0,0,0,0|2,0,0]=4 5499 B12R1.4 COc1ccc(cc1)CC(=O)[13CH3] 1458a_100000210706_200025704644 [0,2,0,0,0,0|1,0,0]=3 5500 B12R1.4 COc1ccc(cc1)CC(C)N 34a_100102634573_200000210301 [0,2,0,0,0,0|1,0,1]=4 5501 B12R1.4 COc1ccc(cc1)CN(C)C 2230a_100000184145_200000210301 [0,2,0,0,0,0|1,0,1]=4 5502 B12R1.4 COc1ccc(cc1)CN(C)C 2230a_100102631434_100000742318 [0,2,0,0,0,0|1,0,1]=4 5503 B12R1.4 COc1ccc(cc1)CN(C)C 269982a_100000184145_200000210301 [0,2,0,0,0,0|1,0,1]=4 5504 B12R1.4 COc1ccc(cc1)CN(C)C 269982a_100102631434_100000742318 [0,2,0,0,0,0|1,0,1]=4 5505 B12R1.4 COc1ccc(cc1)CN(C)C 270004a_100102631434_100000169835 [0,2,0,0,0,0|1,0,1]=4 5506 B12R1.4 COc1ccc(cc1)CN(C)[13CH3] 2230a_100000184145_200025704644 [0,2,0,0,0,0|1,0,1]=4 5507 B12R1.4 COc1ccc(cc1)CN(C)[13CH3] 269982a_100000184145_200025704644 [0,2,0,0,0,0|1,0,1]=4 5508 B12R1.4 COc1ccc(cc1)NC(=O)C 11a_100000184247_100015343762 [0,2,0,0,0,0|2,0,0]=4 5509 B12R1.4 COc1ccc(cc1)NC(=O)C 1626a_100000184247_100015343762 [0,2,0,0,0,0|2,0,0]=4 5510 B12R1.4 COc1ccc(cc1)NC(=O)C 22a_100000184247_100000070787 [0,2,0,0,0,0|2,0,0]=4 5511 B12R1.4 COc1ccc(cc1)NC(=O)C 34a_100000184395_200000210301 [0,2,0,0,0,0|2,0,0]=4 5512 B12R1.4 COc1ccc(cc1)NC(=O)C 527a_100000184247_100103153847 [0,2,0,0,0,0|2,0,0]=4 5513 B12R1.4 COc1ccc(cc1)NC(=O)C 7a_100000184395_200000210301 [0,2,0,0,0,0|2,0,0]=4 5514 B12R1.4 COc1ccc(cn1)CC(=O)C 1458a_100000070787_100020631284 [0,2,0,0,0,0|2,0,0]=4 5515 B12R1.4 COc1ccc(cn1)CC(=O)C 1458a_100012001117_200000210301 [0,2,0,0,0,0|2,0,0]=4 5516 B12R1.4 COc1ccc(cn1)CC(=O)[13CH3] 1458a_100012001117_200025704644 [0,2,0,0,0,0|2,0,0]=4 5517 B12R1.4 COc1ccc(nc1)CC(=O)C 1458a_100000070787_200000757186 [0,2,0,0,0,0|2,0,0]=4 5518 B12R1.4 COc1ccc(nc1)CC(=O)C 1458a_100000722272_200000210301 [0,2,0,0,0,0|2,0,0]=4 5519 B12R1.4 COc1ccc(nc1)CC(=O)[13CH3] 1458a_100000722272_200025704644 [0,2,0,0,0,0|2,0,0]=4 5520 B12R1.4 CSc1ccc(cc1)C=C(C)C 271570a_100102525489_100011263217 [0,2,0,0,0,0|0,0,2]=4 5521 B12R1.4 CSc1ccc(cc1)CC(=O)C 1458a_100000070787_100000181263 [0,2,0,0,0,0|1,0,0]=3 5522 B12R1.4 CSc1ccc(cc1)CC(=O)C 1458a_100000756958_200000210301 [0,2,0,0,0,0|1,0,0]=3 5523 B12R1.4 CSc1ccc(cc1)CC(=O)C 62a_100000691760_200000210301 [0,2,0,0,0,0|1,0,0]=3 5524 B12R1.4 CSc1ccc(cc1)CC(=O)C 62a_200000210301_100000691760 [0,2,0,0,0,0|1,0,0]=3 5525 B12R1.4 CSc1ccc(cc1)CC(=O)N 62a_100000162331_200000210301 [0,2,0,0,0,0|2,0,0]=4 5526 B12R1.4 CSc1ccc(cc1)CC(=O)N 62a_200000210301_100000162331 [0,2,0,0,0,0|2,0,0]=4 5527 B12R1.4 CSc1ccc(cc1)CC(=O)[13CH3] 1458a_100000756958_200025704644 [0,2,0,0,0,0|1,0,0]=3 5528 B12R1.4 CSc1ccc(cc1)CC(C)C 62a_100011221366_200000210301 [0,2,0,0,0,0|0,0,2]=4 5529 B12R1.4 CSc1ccc(cc1)CC(C)C 62a_200000210301_100011221366 [0,2,0,0,0,0|0,0,2]=4 5530 B12R1.4 CSc1ccc(cc1)CN(C)C 2230a_100102631434_100000181263 [0,2,0,0,0,0|1,0,1]=4 5531 B12R1.4 CSc1ccc(cc1)CN(C)C 2230a_102495365258_200000210301 [0,2,0,0,0,0|1,0,1]=4 5532 B12R1.4 CSc1ccc(cc1)CN(C)C 269982a_100102631434_100011934452 [0,2,0,0,0,0|1,0,1]=4 5533 B12R1.4 CSc1ccc(cc1)CN(C)C 269982a_102495365258_200000210301 [0,2,0,0,0,0|1,0,1]=4 5534 B12R1.4 CSc1ccc(cc1)CN(C)C 270004a_100102631434_100000211154 [0,2,0,0,0,0|1,0,1]=4 5535 B12R1.4 CSc1ccc(cc1)CN(C)C 62a_100000174694_200000210301 [0,2,0,0,0,0|1,0,1]=4 5536 B12R1.4 CSc1ccc(cc1)CN(C)C 62a_200000210301_100000174694 [0,2,0,0,0,0|1,0,1]=4 5537 B12R1.4 CSc1ccc(cc1)CN(C)[13CH3] 2230a_102495365258_200025704644 [0,2,0,0,0,0|1,0,1]=4 5538 B12R1.4 CSc1ccc(cc1)CN(C)[13CH3] 269982a_102495365258_200025704644 [0,2,0,0,0,0|1,0,1]=4 5539 B12R1.4 CSc1ccc(cc1)NC(=O)C 11a_100000212337_100015343762 [0,2,0,0,0,0|2,0,0]=4 5540 B12R1.4 CSc1ccc(cc1)NC(=O)C 22a_100000212337_100000070787 [0,2,0,0,0,0|2,0,0]=4 5541 B12R1.4 CSc1ccc(cc1)NC(=O)C 527a_100000212337_100103153847 [0,2,0,0,0,0|2,0,0]=4 5542 B12R1.4 CSc1ccc(cc1)NC(=O)C 62a_200000210301_100000155215 [0,2,0,0,0,0|2,0,0]=4 5543 B12R1.4 CSc1ccc(cc1)OC(=O)C 62a_200000210301_100000002173 [0,2,0,0,0,0|2,0,0]=4 5544 B12R1.4 CSc1ccc(cc1)OC(=S)C 62a_200000210301_200009816735 [0,2,0,0,0,0|2,0,0]=4 5545 B12R1.4 CSc1ccc(cc1)SC(=O)C 62a_200009995050_200000210301 [0,2,0,0,0,0|2,0,0]=4 5546 B12R1.4 [13CH3]C(=O)Cc1ccc(cc1)C#N 1458a_100000748677_200025704644 [0,2,0,0,0,0|1,0,0]=3 5547 B12R1.4 [13CH3]C(=O)Cc1ccc(cc1)CO 1458a_100011356463_200025704644 [0,2,0,0,0,0|1,0,0]=3 5548 B12R1.4 [13CH3]Nc1ccc(cc1)CC(=O)N 2230a_100000738315_200025704644 [0,2,0,0,0,0|2,0,0]=4 5549 B12R1.4 [13CH3]Nc1ccc(cc1)CC(=O)N 34a_100000738315_200025704644 [0,2,0,0,0,0|2,0,0]=4 5550 B12R1.4 [13CH3]Oc1ccc(cc1)CC(=O)N 34a_100000020825_200025704644 [0,2,0,0,0,0|2,0,0]=4 5551 B12R1.4 [13CH3]Sc1ccc(cc1)CC(=O)N 62a_100000162331_200025704644 [0,2,0,0,0,0|2,0,0]=4 5552 B12R1.4 [13CH3]Sc1ccc(cc1)CC(=O)N 62a_200025704644_100000162331 [0,2,0,0,0,0|2,0,0]=4 5553 B12R1.19 CC(=Cc1ccc(c(c1)Br)Br)C 271570a_100102525489_100012356285 [0,2,0,0,0,0|0,0,2]=4 5554 B12R1.19 CC(=Cc1ccc(c(c1)Br)C)C 271570a_100102525489_100011847877 [0,2,0,0,0,0|0,0,2]=4 5555 B12R1.19 CC(=Cc1ccc(c(c1)Br)Cl)C 271570a_100102525489_100012353702 [0,2,0,0,0,0|0,0,2]=4 5556 B12R1.19 CC(=Cc1ccc(c(c1)Br)F)C 271570a_100102525489_100012047266 [0,2,0,0,0,0|0,0,2]=4 5557 B12R1.19 CC(=Cc1ccc(c(c1)Br)N)C 271570a_100102525489_100000750455 [0,2,0,0,0,0|0,0,2]=4 5558 B12R1.19 CC(=Cc1ccc(c(c1)Br)O)C 271570a_100102525489_100012361655 [0,2,0,0,0,0|0,0,2]=4 5559 B12R1.19 CC(=Cc1ccc(c(c1)C)Br)C 271570a_100102525489_100009813585 [0,2,0,0,0,0|0,0,2]=4 5560 B12R1.19 CC(=Cc1ccc(c(c1)C)C)C 271570a_100102525489_100011215607 [0,2,0,0,0,0|0,0,2]=4 5561 B12R1.19 CC(=Cc1ccc(c(c1)C)Cl)C 271570a_100102525489_100000049509 [0,2,0,0,0,0|0,0,2]=4 5562 B12R1.19 CC(=Cc1ccc(c(c1)C)F)C 271570a_100102525489_100011218330 [0,2,0,0,0,0|0,0,2]=4 5563 B12R1.19 CC(=Cc1ccc(c(c1)C)N)C 271570a_100102525489_100000211769 [0,2,0,0,0,0|0,0,2]=4 5564 B12R1.19 CC(=Cc1ccc(c(c1)C)O)C 271570a_100102525489_100000186361 [0,2,0,0,0,0|0,0,2]=4 5565 B12R1.19 CC(=Cc1ccc(c(c1)Cl)Br)C 271570a_100102525489_100012047281 [0,2,0,0,0,0|0,0,2]=4 5566 B12R1.19 CC(=Cc1ccc(c(c1)Cl)C)C 271570a_100102525489_100011216363 [0,2,0,0,0,0|0,0,2]=4 5567 B12R1.19 CC(=Cc1ccc(c(c1)Cl)Cl)C 271570a_100102525489_100011214914 [0,2,0,0,0,0|0,0,2]=4 5568 B12R1.19 CC(=Cc1ccc(c(c1)Cl)F)C 271570a_100102525489_100011215976 [0,2,0,0,0,0|0,0,2]=4 5569 B12R1.19 CC(=Cc1ccc(c(c1)Cl)N)C 271570a_100102525489_100011218065 [0,2,0,0,0,0|0,0,2]=4 5570 B12R1.19 CC(=Cc1ccc(c(c1)Cl)O)C 271570a_100102525489_100012360047 [0,2,0,0,0,0|0,0,2]=4 5571 B12R1.19 CC(=Cc1ccc(c(c1)F)Br)C 271570a_100102525489_100000685389 [0,2,0,0,0,0|0,0,2]=4 5572 B12R1.19 CC(=Cc1ccc(c(c1)F)C)C 271570a_100102525489_100000720648 [0,2,0,0,0,0|0,0,2]=4 5573 B12R1.19 CC(=Cc1ccc(c(c1)F)Cl)C 271570a_100102525489_100011216805 [0,2,0,0,0,0|0,0,2]=4 5574 B12R1.19 CC(=Cc1ccc(c(c1)F)F)C 271570a_100102525489_100000750028 [0,2,0,0,0,0|0,0,2]=4 5575 B12R1.19 CC(=Cc1ccc(c(c1)F)N)C 271570a_100102525489_100011215594 [0,2,0,0,0,0|0,0,2]=4 5576 B12R1.19 CC(=Cc1ccc(c(c1)F)O)C 271570a_100102525489_100000185481 [0,2,0,0,0,0|0,0,2]=4 5577 B12R1.19 CC(=Cc1ccc(c(c1)N)Br)C 271570a_100102525489_100000750456 [0,2,0,0,0,0|0,0,2]=4 5578 B12R1.19 CC(=Cc1ccc(c(c1)N)C)C 271570a_100102525489_100000761890 [0,2,0,0,0,0|0,0,2]=4 5579 B12R1.19 CC(=Cc1ccc(c(c1)N)Cl)C 271570a_100102525489_200000761891 [0,2,0,0,0,0|0,0,2]=4 5580 B12R1.19 CC(=Cc1ccc(c(c1)N)F)C 271570a_100102525489_100000740924 [0,2,0,0,0,0|0,0,2]=4 5581 B12R1.19 CC(=Cc1ccc(c(c1)N)N)C 271570a_100102525489_100000741789 [0,2,0,0,0,0|0,0,2]=4 5582 B12R1.19 CC(=Cc1ccc(c(c1)N)O)C 271570a_100102525489_100000752626 [0,2,0,0,0,0|0,0,2]=4 5583 B12R1.19 CC(=Cc1ccc(c(c1)O)Br)C 271570a_100102525489_100012356990 [0,2,0,0,0,0|0,0,2]=4 5584 B12R1.19 CC(=Cc1ccc(c(c1)O)C)C 271570a_100102525489_100000766334 [0,2,0,0,0,0|0,0,2]=4 5585 B12R1.19 CC(=Cc1ccc(c(c1)O)Cl)C 271570a_100102525489_100011356854 [0,2,0,0,0,0|0,0,2]=4 5586 B12R1.19 CC(=Cc1ccc(c(c1)O)F)C 271570a_100102525489_100000686035 [0,2,0,0,0,0|0,0,2]=4 5587 B12R1.19 CC(=Cc1ccc(c(c1)O)N)C 271570a_100102525489_100000739049 [0,2,0,0,0,0|0,0,2]=4 5588 B12R1.19 CC(=Cc1ccc(c(c1)O)O)C 271570a_100102525489_100009813601 [0,2,0,0,0,0|0,0,2]=4 5589 B12R1.19 CC(=O)Cc1cc(=O)c(co1)O 1458a_100000070787_100000010605 [0,2,0,0,0,0|2,0,0]=4 5590 B12R1.19 CC(=O)Cc1ccc(c(c1)Br)Br 1458a_100000070787_100012353900 [0,2,0,0,0,0|1,0,0]=3 5591 B12R1.19 CC(=O)Cc1ccc(c(c1)Br)C 1458a_100000070787_100012232412 [0,2,0,0,0,0|1,0,0]=3 5592 B12R1.19 CC(=O)Cc1ccc(c(c1)Br)C 1458a_100000709925_200000210301 [0,2,0,0,0,0|1,0,0]=3 5593 B12R1.19 CC(=O)Cc1ccc(c(c1)Br)Cl 1458a_100000070787_100012353894 [0,2,0,0,0,0|1,0,0]=3 5594 B12R1.19 CC(=O)Cc1ccc(c(c1)Br)Cl 1458a_100012349508_200000210301 [0,2,0,0,0,0|1,0,0]=3 5595 B12R1.19 CC(=O)Cc1ccc(c(c1)Br)F 1458a_100000070787_100011206884 [0,2,0,0,0,0|1,0,0]=3 5596 B12R1.19 CC(=O)Cc1ccc(c(c1)Br)F 1458a_100000742997_200000210301 [0,2,0,0,0,0|1,0,0]=3 5597 B12R1.19 CC(=O)Cc1ccc(c(c1)Br)O 1458a_100009990404_200000210301 [0,2,0,0,0,0|1,0,0]=3 5598 B12R1.19 CC(=O)Cc1ccc(c(c1)C)Br 1458a_100000070787_100000727479 [0,2,0,0,0,0|1,0,0]=3 5599 B12R1.19 CC(=O)Cc1ccc(c(c1)C)Br 1458a_100012340274_200000210301 [0,2,0,0,0,0|1,0,0]=3 5600 B12R1.19 CC(=O)Cc1ccc(c(c1)C)C 1458a_100000070787_100000742320 [0,2,0,0,0,0|1,0,0]=3 5601 B12R1.19 CC(=O)Cc1ccc(c(c1)C)C 1458a_100000184070_200000210301 [0,2,0,0,0,0|1,0,0]=3 5602 B12R1.19 CC(=O)Cc1ccc(c(c1)C)Cl 1458a_100000070787_100012184735 [0,2,0,0,0,0|1,0,0]=3 5603 B12R1.19 CC(=O)Cc1ccc(c(c1)C)F 1458a_100000070787_100011216667 [0,2,0,0,0,0|1,0,0]=3 5604 B12R1.19 CC(=O)Cc1ccc(c(c1)C)F 1458a_100011667458_200000210301 [0,2,0,0,0,0|1,0,0]=3 5605 B12R1.19 CC(=O)Cc1ccc(c(c1)C)O 1458a_100000083968_200000210301 [0,2,0,0,0,0|1,0,0]=3 5606 B12R1.19 CC(=O)Cc1ccc(c(c1)Cl)Br 1458a_100000070787_100012353895 [0,2,0,0,0,0|1,0,0]=3 5607 B12R1.19 CC(=O)Cc1ccc(c(c1)Cl)Br 1458a_100000766880_200000210301 [0,2,0,0,0,0|1,0,0]=3 5608 B12R1.19 CC(=O)Cc1ccc(c(c1)Cl)C 1458a_100000070787_100011823929 [0,2,0,0,0,0|1,0,0]=3 5609 B12R1.19 CC(=O)Cc1ccc(c(c1)Cl)Cl 1458a_100000070787_100000184707 [0,2,0,0,0,0|1,0,0]=3 5610 B12R1.19 CC(=O)Cc1ccc(c(c1)Cl)Cl 1458a_100000210702_200000210301 [0,2,0,0,0,0|1,0,0]=3 5611 B12R1.19 CC(=O)Cc1ccc(c(c1)Cl)F 1458a_100000070787_100000717365 [0,2,0,0,0,0|1,0,0]=3 5612 B12R1.19 CC(=O)Cc1ccc(c(c1)Cl)F 1458a_100011217296_200000210301 [0,2,0,0,0,0|1,0,0]=3 5613 B12R1.19 CC(=O)Cc1ccc(c(c1)Cl)I 1458a_100000070787_100012349665 [0,2,0,0,0,0|1,0,0]=3 5614 B12R1.19 CC(=O)Cc1ccc(c(c1)Cl)O 1458a_100000035197_200000210301 [0,2,0,0,0,0|1,0,0]=3 5615 B12R1.19 CC(=O)Cc1ccc(c(c1)F)Br 1458a_100000070787_100000767054 [0,2,0,0,0,0|1,0,0]=3 5616 B12R1.19 CC(=O)Cc1ccc(c(c1)F)Br 1458a_100000691132_200000210301 [0,2,0,0,0,0|1,0,0]=3 5617 B12R1.19 CC(=O)Cc1ccc(c(c1)F)C 1458a_100000070787_100011217369 [0,2,0,0,0,0|1,0,0]=3 5618 B12R1.19 CC(=O)Cc1ccc(c(c1)F)C 1458a_100011217375_200000210301 [0,2,0,0,0,0|1,0,0]=3 5619 B12R1.19 CC(=O)Cc1ccc(c(c1)F)Cl 1458a_100000070787_100000716492 [0,2,0,0,0,0|1,0,0]=3 5620 B12R1.19 CC(=O)Cc1ccc(c(c1)F)Cl 1458a_100000722404_200000210301 [0,2,0,0,0,0|1,0,0]=3 5621 B12R1.19 CC(=O)Cc1ccc(c(c1)F)F 1458a_100000070787_100000757363 [0,2,0,0,0,0|1,0,0]=3 5622 B12R1.19 CC(=O)Cc1ccc(c(c1)F)F 1458a_100000684721_200000210301 [0,2,0,0,0,0|1,0,0]=3 5623 B12R1.19 CC(=O)Cc1ccc(c(c1)F)I 1458a_100000070787_100010149604 [0,2,0,0,0,0|1,0,0]=3 5624 B12R1.19 CC(=O)Cc1ccc(c(c1)F)I 1458a_100010149632_200000210301 [0,2,0,0,0,0|1,0,0]=3 5625 B12R1.19 CC(=O)Cc1ccc(c(c1)F)O 1458a_100000039761_200000210301 [0,2,0,0,0,0|1,0,0]=3 5626 B12R1.19 CC(=O)Cc1ccc(c(c1)I)Br 1458a_100000070787_100010146616 [0,2,0,0,0,0|1,0,0]=3 5627 B12R1.19 CC(=O)Cc1ccc(c(c1)I)C 1458a_100000070787_100010206137 [0,2,0,0,0,0|1,0,0]=3 5628 B12R1.19 CC(=O)Cc1ccc(c(c1)I)F 1458a_100000070787_100010188208 [0,2,0,0,0,0|1,0,0]=3 5629 B12R1.19 CC(=O)Cc1ccc(c(c1)O)C 1458a_100000082272_200000210301 [0,2,0,0,0,0|1,0,0]=3 5630 B12R1.19 CC(=O)Cc1ccc(c(c1)O)O 1458a_100000031429_200000210301 [0,2,0,0,0,0|1,0,0]=3 5631 B12R1.19 CC(=O)Cc1ccc(c(c1)O)O 271570a_203496583355_100010141077 [0,2,0,0,0,0|1,0,0]=3 5632 B12R1.19 CC(=O)Cc1cnc(c(c1)Br)F 1458a_100000070787_200010066439 [0,2,0,0,0,0|2,0,0]=4 5633 B12R1.19 CC(=O)Cc1cnc(c(c1)Cl)Cl 1458a_100000070787_100009843750 [0,2,0,0,0,0|2,0,0]=4 5634 B12R1.19 CC(=O)Cc1cnc(c(c1)I)Cl 1458a_100000070787_100011072623 [0,2,0,0,0,0|2,0,0]=4 5635 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)Br 11a_100011306057_100015343762 [0,2,0,0,0,0|2,0,0]=4 5636 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)Br 1626a_100011306057_100015343762 [0,2,0,0,0,0|2,0,0]=4 5637 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)Br 22a_100011306057_100000070787 [0,2,0,0,0,0|2,0,0]=4 5638 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)Br 527a_100011306057_100103153847 [0,2,0,0,0,0|2,0,0]=4 5639 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)C 11a_100000736455_100015343762 [0,2,0,0,0,0|2,0,0]=4 5640 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)C 1626a_100000736455_100015343762 [0,2,0,0,0,0|2,0,0]=4 5641 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)C 22a_100000736455_100000070787 [0,2,0,0,0,0|2,0,0]=4 5642 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)C 527a_100000736455_100103153847 [0,2,0,0,0,0|2,0,0]=4 5643 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)Cl 11a_100000686031_100015343762 [0,2,0,0,0,0|2,0,0]=4 5644 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)Cl 1626a_100000686031_100015343762 [0,2,0,0,0,0|2,0,0]=4 5645 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)Cl 22a_100000686031_100000070787 [0,2,0,0,0,0|2,0,0]=4 5646 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)Cl 527a_100000686031_100103153847 [0,2,0,0,0,0|2,0,0]=4 5647 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)F 11a_100000760356_100015343762 [0,2,0,0,0,0|2,0,0]=4 5648 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)F 1626a_100000760356_100015343762 [0,2,0,0,0,0|2,0,0]=4 5649 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)F 22a_100000760356_100000070787 [0,2,0,0,0,0|2,0,0]=4 5650 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)F 527a_100000760356_100103153847 [0,2,0,0,0,0|2,0,0]=4 5651 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)I 11a_100000750458_100015343762 [0,2,0,0,0,0|2,0,0]=4 5652 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)I 1626a_100000750458_100015343762 [0,2,0,0,0,0|2,0,0]=4 5653 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)I 22a_100000750458_100000070787 [0,2,0,0,0,0|2,0,0]=4 5654 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)I 527a_100000750458_100103153847 [0,2,0,0,0,0|2,0,0]=4 5655 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)O 22a_100011534360_100000070787 [0,2,0,0,0,0|2,0,0]=4 5656 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)O 527a_100011534360_100103153847 [0,2,0,0,0,0|2,0,0]=4 5657 B12R1.19 CC(=O)Nc1ccc(c(c1)C)Br 11a_100000210723_100015343762 [0,2,0,0,0,0|2,0,0]=4 5658 B12R1.19 CC(=O)Nc1ccc(c(c1)C)Br 1626a_100000210723_100015343762 [0,2,0,0,0,0|2,0,0]=4 5659 B12R1.19 CC(=O)Nc1ccc(c(c1)C)Br 22a_100000210723_100000070787 [0,2,0,0,0,0|2,0,0]=4 5660 B12R1.19 CC(=O)Nc1ccc(c(c1)C)Br 527a_100000210723_100103153847 [0,2,0,0,0,0|2,0,0]=4 5661 B12R1.19 CC(=O)Nc1ccc(c(c1)C)C 11a_100000724040_100015343762 [0,2,0,0,0,0|2,0,0]=4 5662 B12R1.19 CC(=O)Nc1ccc(c(c1)C)C 1626a_100000724040_100015343762 [0,2,0,0,0,0|2,0,0]=4 5663 B12R1.19 CC(=O)Nc1ccc(c(c1)C)C 22a_100000724040_100000070787 [0,2,0,0,0,0|2,0,0]=4 5664 B12R1.19 CC(=O)Nc1ccc(c(c1)C)C 527a_100000724040_100103153847 [0,2,0,0,0,0|2,0,0]=4 5665 B12R1.19 CC(=O)Nc1ccc(c(c1)C)Cl 11a_100000187808_100015343762 [0,2,0,0,0,0|2,0,0]=4 5666 B12R1.19 CC(=O)Nc1ccc(c(c1)C)Cl 1626a_100000187808_100015343762 [0,2,0,0,0,0|2,0,0]=4 5667 B12R1.19 CC(=O)Nc1ccc(c(c1)C)Cl 22a_100000187808_100000070787 [0,2,0,0,0,0|2,0,0]=4 5668 B12R1.19 CC(=O)Nc1ccc(c(c1)C)Cl 527a_100000187808_100103153847 [0,2,0,0,0,0|2,0,0]=4 5669 B12R1.19 CC(=O)Nc1ccc(c(c1)C)F 11a_100000750164_100015343762 [0,2,0,0,0,0|2,0,0]=4 5670 B12R1.19 CC(=O)Nc1ccc(c(c1)C)F 1626a_100000750164_100015343762 [0,2,0,0,0,0|2,0,0]=4 5671 B12R1.19 CC(=O)Nc1ccc(c(c1)C)F 22a_100000750164_100000070787 [0,2,0,0,0,0|2,0,0]=4 5672 B12R1.19 CC(=O)Nc1ccc(c(c1)C)F 527a_100000750164_100103153847 [0,2,0,0,0,0|2,0,0]=4 5673 B12R1.19 CC(=O)Nc1ccc(c(c1)C)I 11a_100000198070_100015343762 [0,2,0,0,0,0|2,0,0]=4 5674 B12R1.19 CC(=O)Nc1ccc(c(c1)C)I 1626a_100000198070_100015343762 [0,2,0,0,0,0|2,0,0]=4 5675 B12R1.19 CC(=O)Nc1ccc(c(c1)C)I 22a_100000198070_100000070787 [0,2,0,0,0,0|2,0,0]=4 5676 B12R1.19 CC(=O)Nc1ccc(c(c1)C)I 527a_100000198070_100103153847 [0,2,0,0,0,0|2,0,0]=4 5677 B12R1.19 CC(=O)Nc1ccc(c(c1)C)O 11a_100011218179_100015343762 [0,2,0,0,0,0|2,0,0]=4 5678 B12R1.19 CC(=O)Nc1ccc(c(c1)C)O 22a_100011218179_100000070787 [0,2,0,0,0,0|2,0,0]=4 5679 B12R1.19 CC(=O)Nc1ccc(c(c1)C)O 271570a_203496583355_100000155607 [0,2,0,0,0,0|2,0,0]=4 5680 B12R1.19 CC(=O)Nc1ccc(c(c1)C)O 527a_100011218179_100103153847 [0,2,0,0,0,0|2,0,0]=4 5681 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)Br 11a_100000687081_100015343762 [0,2,0,0,0,0|2,0,0]=4 5682 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)Br 1626a_100000687081_100015343762 [0,2,0,0,0,0|2,0,0]=4 5683 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)Br 22a_100000687081_100000070787 [0,2,0,0,0,0|2,0,0]=4 5684 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)Br 527a_100000687081_100103153847 [0,2,0,0,0,0|2,0,0]=4 5685 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)C 11a_100000188892_100015343762 [0,2,0,0,0,0|2,0,0]=4 5686 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)C 1626a_100000188892_100015343762 [0,2,0,0,0,0|2,0,0]=4 5687 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)C 22a_100000188892_100000070787 [0,2,0,0,0,0|2,0,0]=4 5688 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)C 527a_100000188892_100103153847 [0,2,0,0,0,0|2,0,0]=4 5689 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)Cl 11a_100000184108_100015343762 [0,2,0,0,0,0|2,0,0]=4 5690 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)Cl 1626a_100000184108_100015343762 [0,2,0,0,0,0|2,0,0]=4 5691 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)Cl 22a_100000184108_100000070787 [0,2,0,0,0,0|2,0,0]=4 5692 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)Cl 527a_100000184108_100103153847 [0,2,0,0,0,0|2,0,0]=4 5693 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)F 11a_100000211060_100015343762 [0,2,0,0,0,0|2,0,0]=4 5694 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)F 1626a_100000211060_100015343762 [0,2,0,0,0,0|2,0,0]=4 5695 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)F 22a_100000211060_100000070787 [0,2,0,0,0,0|2,0,0]=4 5696 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)F 527a_100000211060_100103153847 [0,2,0,0,0,0|2,0,0]=4 5697 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)I 11a_100000761885_100015343762 [0,2,0,0,0,0|2,0,0]=4 5698 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)I 1626a_100000761885_100015343762 [0,2,0,0,0,0|2,0,0]=4 5699 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)I 22a_100000761885_100000070787 [0,2,0,0,0,0|2,0,0]=4 5700 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)O 22a_100000744943_100000070787 [0,2,0,0,0,0|2,0,0]=4 5701 B12R1.19 CC(=O)Nc1ccc(c(c1)F)Br 11a_100000759894_100015343762 [0,2,0,0,0,0|2,0,0]=4 5702 B12R1.19 CC(=O)Nc1ccc(c(c1)F)Br 1626a_100000759894_100015343762 [0,2,0,0,0,0|2,0,0]=4 5703 B12R1.19 CC(=O)Nc1ccc(c(c1)F)Br 22a_100000759894_100000070787 [0,2,0,0,0,0|2,0,0]=4 5704 B12R1.19 CC(=O)Nc1ccc(c(c1)F)Br 527a_100000759894_100103153847 [0,2,0,0,0,0|2,0,0]=4 5705 B12R1.19 CC(=O)Nc1ccc(c(c1)F)C 11a_100000210958_100015343762 [0,2,0,0,0,0|2,0,0]=4 5706 B12R1.19 CC(=O)Nc1ccc(c(c1)F)C 1626a_100000210958_100015343762 [0,2,0,0,0,0|2,0,0]=4 5707 B12R1.19 CC(=O)Nc1ccc(c(c1)F)C 22a_100000210958_100000070787 [0,2,0,0,0,0|2,0,0]=4 5708 B12R1.19 CC(=O)Nc1ccc(c(c1)F)C 527a_100000210958_100103153847 [0,2,0,0,0,0|2,0,0]=4 5709 B12R1.19 CC(=O)Nc1ccc(c(c1)F)Cl 11a_100000739366_100015343762 [0,2,0,0,0,0|2,0,0]=4 5710 B12R1.19 CC(=O)Nc1ccc(c(c1)F)Cl 1626a_100000739366_100015343762 [0,2,0,0,0,0|2,0,0]=4 5711 B12R1.19 CC(=O)Nc1ccc(c(c1)F)Cl 22a_100000739366_100000070787 [0,2,0,0,0,0|2,0,0]=4 5712 B12R1.19 CC(=O)Nc1ccc(c(c1)F)F 11a_100000210724_100015343762 [0,2,0,0,0,0|2,0,0]=4 5713 B12R1.19 CC(=O)Nc1ccc(c(c1)F)F 1626a_100000210724_100015343762 [0,2,0,0,0,0|2,0,0]=4 5714 B12R1.19 CC(=O)Nc1ccc(c(c1)F)F 22a_100000210724_100000070787 [0,2,0,0,0,0|2,0,0]=4 5715 B12R1.19 CC(=O)Nc1ccc(c(c1)F)I 11a_100011356925_100015343762 [0,2,0,0,0,0|2,0,0]=4 5716 B12R1.19 CC(=O)Nc1ccc(c(c1)F)I 1626a_100011356925_100015343762 [0,2,0,0,0,0|2,0,0]=4 5717 B12R1.19 CC(=O)Nc1ccc(c(c1)F)I 22a_100011356925_100000070787 [0,2,0,0,0,0|2,0,0]=4 5718 B12R1.19 CC(=O)Nc1ccc(c(c1)F)O 22a_100011220035_100000070787 [0,2,0,0,0,0|2,0,0]=4 5719 B12R1.19 CC(=O)Nc1ccc(c(c1)F)O 271570a_203496583355_100011219590 [0,2,0,0,0,0|2,0,0]=4 5720 B12R1.19 CC(=O)Nc1ccc(c(c1)F)O 527a_100011220035_100103153847 [0,2,0,0,0,0|2,0,0]=4 5721 B12R1.19 CC(=O)Nc1ccc(c(c1)I)Br 11a_100000750459_100015343762 [0,2,0,0,0,0|2,0,0]=4 5722 B12R1.19 CC(=O)Nc1ccc(c(c1)I)Br 1626a_100000750459_100015343762 [0,2,0,0,0,0|2,0,0]=4 5723 B12R1.19 CC(=O)Nc1ccc(c(c1)I)Br 22a_100000750459_100000070787 [0,2,0,0,0,0|2,0,0]=4 5724 B12R1.19 CC(=O)Nc1ccc(c(c1)I)Br 527a_100000750459_100103153847 [0,2,0,0,0,0|2,0,0]=4 5725 B12R1.19 CC(=O)Nc1ccc(c(c1)I)C 11a_100000184131_100015343762 [0,2,0,0,0,0|2,0,0]=4 5726 B12R1.19 CC(=O)Nc1ccc(c(c1)I)C 1626a_100000184131_100015343762 [0,2,0,0,0,0|2,0,0]=4 5727 B12R1.19 CC(=O)Nc1ccc(c(c1)I)C 22a_100000184131_100000070787 [0,2,0,0,0,0|2,0,0]=4 5728 B12R1.19 CC(=O)Nc1ccc(c(c1)I)C 527a_100000184131_100103153847 [0,2,0,0,0,0|2,0,0]=4 5729 B12R1.19 CC(=O)Nc1ccc(c(c1)I)Cl 11a_100012360549_100015343762 [0,2,0,0,0,0|2,0,0]=4 5730 B12R1.19 CC(=O)Nc1ccc(c(c1)I)Cl 1626a_100012360549_100015343762 [0,2,0,0,0,0|2,0,0]=4 5731 B12R1.19 CC(=O)Nc1ccc(c(c1)I)Cl 22a_100012360549_100000070787 [0,2,0,0,0,0|2,0,0]=4 5732 B12R1.19 CC(=O)Nc1ccc(c(c1)I)Cl 527a_100012360549_100103153847 [0,2,0,0,0,0|2,0,0]=4 5733 B12R1.19 CC(=O)Nc1ccc(c(c1)I)F 11a_114828291077_100015343762 [0,2,0,0,0,0|2,0,0]=4 5734 B12R1.19 CC(=O)Nc1ccc(c(c1)I)F 1626a_114828291077_100015343762 [0,2,0,0,0,0|2,0,0]=4 5735 B12R1.19 CC(=O)Nc1ccc(c(c1)I)F 22a_114828291077_100000070787 [0,2,0,0,0,0|2,0,0]=4 5736 B12R1.19 CC(=O)Nc1ccc(c(c1)I)F 527a_114828291077_100103153847 [0,2,0,0,0,0|2,0,0]=4 5737 B12R1.19 CC(=O)Nc1ccc(c(c1)O)C 11a_100000759471_100015343762 [0,2,0,0,0,0|2,0,0]=4 5738 B12R1.19 CC(=O)Nc1ccc(c(c1)O)C 22a_100000759471_100000070787 [0,2,0,0,0,0|2,0,0]=4 5739 B12R1.19 CC(=O)Nc1ccc(c(c1)O)C 271570a_203496583355_100011221169 [0,2,0,0,0,0|2,0,0]=4 5740 B12R1.19 CC(=O)Nc1ccc(c(c1)O)C 527a_100000759471_100103153847 [0,2,0,0,0,0|2,0,0]=4 5741 B12R1.19 CC(=O)Nc1ccc(c(c1)O)Cl 22a_100011934209_100000070787 [0,2,0,0,0,0|2,0,0]=4 5742 B12R1.19 CC(=O)Nc1ccc(c(c1)O)F 22a_100012017398_100000070787 [0,2,0,0,0,0|2,0,0]=4 5743 B12R1.19 CC(=O)Nc1ccc(c(c1)O)F 271570a_203496583355_100012348134 [0,2,0,0,0,0|2,0,0]=4 5744 B12R1.19 CC(=O)Nc1ccc(c(c1)O)F 527a_100012017398_100103153847 [0,2,0,0,0,0|2,0,0]=4 5745 B12R1.19 CC(=O)Nc1ccc(c(c1)O)O 22a_100102946323_100000070787 [0,2,0,0,0,0|2,0,0]=4 5746 B12R1.19 CC(=O)Nc1ccc(c(c1)O)O 527a_100102946323_100103153847 [0,2,0,0,0,0|2,0,0]=4 5747 B12R1.19 CC(=O)Oc1ccc(c(c1)O)C 271570a_203496583355_200025702335 [0,2,0,0,0,0|2,0,0]=4 5748 B12R1.19 CN(C)Cc1ccc(c(c1)Br)Br 2230a_100102631434_100012353900 [0,2,0,0,0,0|1,0,1]=4 5749 B12R1.19 CN(C)Cc1ccc(c(c1)Br)Br 269982a_100102631434_100012353900 [0,2,0,0,0,0|1,0,1]=4 5750 B12R1.19 CN(C)Cc1ccc(c(c1)Br)Br 270004a_100102631434_100011215943 [0,2,0,0,0,0|1,0,1]=4 5751 B12R1.19 CN(C)Cc1ccc(c(c1)Br)Cl 2230a_100102631434_100012353894 [0,2,0,0,0,0|1,0,1]=4 5752 B12R1.19 CN(C)Cc1ccc(c(c1)Br)Cl 269982a_100102631434_100012353894 [0,2,0,0,0,0|1,0,1]=4 5753 B12R1.19 CN(C)Cc1ccc(c(c1)Br)Cl 270004a_100102631434_100000693810 [0,2,0,0,0,0|1,0,1]=4 5754 B12R1.19 CN(C)Cc1ccc(c(c1)Br)F 2230a_100102631434_100011206884 [0,2,0,0,0,0|1,0,1]=4 5755 B12R1.19 CN(C)Cc1ccc(c(c1)Br)F 269982a_100102631434_100000743011 [0,2,0,0,0,0|1,0,1]=4 5756 B12R1.19 CN(C)Cc1ccc(c(c1)Br)F 270004a_100102631434_100000211747 [0,2,0,0,0,0|1,0,1]=4 5757 B12R1.19 CN(C)Cc1ccc(c(c1)Cl)Br 2230a_100102631434_100012353895 [0,2,0,0,0,0|1,0,1]=4 5758 B12R1.19 CN(C)Cc1ccc(c(c1)Cl)Br 269982a_100102631434_100012353895 [0,2,0,0,0,0|1,0,1]=4 5759 B12R1.19 CN(C)Cc1ccc(c(c1)Cl)Br 270004a_100102631434_100000690054 [0,2,0,0,0,0|1,0,1]=4 5760 B12R1.19 CN(C)Cc1ccc(c(c1)Cl)Cl 2230a_100000184578_200000210301 [0,2,0,0,0,0|1,0,1]=4 5761 B12R1.19 CN(C)Cc1ccc(c(c1)Cl)Cl 2230a_100102631434_100000184707 [0,2,0,0,0,0|1,0,1]=4 5762 B12R1.19 CN(C)Cc1ccc(c(c1)Cl)Cl 269982a_100000184578_200000210301 [0,2,0,0,0,0|1,0,1]=4 5763 B12R1.19 CN(C)Cc1ccc(c(c1)Cl)Cl 269982a_100102631434_100000188800 [0,2,0,0,0,0|1,0,1]=4 5764 B12R1.19 CN(C)Cc1ccc(c(c1)Cl)Cl 270004a_100102631434_100000188533 [0,2,0,0,0,0|1,0,1]=4 5765 B12R1.19 CN(C)Cc1ccc(c(c1)Cl)Cl 34a_100000184578_200000210301 [0,2,0,0,0,0|1,0,1]=4 5766 B12R1.19 CN(C)Cc1ccc(c(c1)Cl)F 2230a_100102631434_100000717365 [0,2,0,0,0,0|1,0,1]=4 5767 B12R1.19 CN(C)Cc1ccc(c(c1)Cl)F 269982a_100102631434_100011934319 [0,2,0,0,0,0|1,0,1]=4 5768 B12R1.19 CN(C)Cc1ccc(c(c1)Cl)F 270004a_100102631434_100000742290 [0,2,0,0,0,0|1,0,1]=4 5769 B12R1.19 CN(C)Cc1ccc(c(c1)Cl)I 2230a_100102631434_100012349665 [0,2,0,0,0,0|1,0,1]=4 5770 B12R1.19 CN(C)Cc1ccc(c(c1)Cl)I 269982a_100102631434_100012349665 [0,2,0,0,0,0|1,0,1]=4 5771 B12R1.19 CN(C)Cc1ccc(c(c1)F)Br 2230a_100102631434_100000767054 [0,2,0,0,0,0|1,0,1]=4 5772 B12R1.19 CN(C)Cc1ccc(c(c1)F)Br 269982a_100102631434_100000767054 [0,2,0,0,0,0|1,0,1]=4 5773 B12R1.19 CN(C)Cc1ccc(c(c1)F)Br 270004a_100102631434_100000686674 [0,2,0,0,0,0|1,0,1]=4 5774 B12R1.19 CN(C)Cc1ccc(c(c1)F)Cl 2230a_100102631434_100000716492 [0,2,0,0,0,0|1,0,1]=4 5775 B12R1.19 CN(C)Cc1ccc(c(c1)F)Cl 269982a_100102631434_100000716492 [0,2,0,0,0,0|1,0,1]=4 5776 B12R1.19 CN(C)Cc1ccc(c(c1)F)Cl 270004a_100102631434_100000745630 [0,2,0,0,0,0|1,0,1]=4 5777 B12R1.19 CN(C)Cc1ccc(c(c1)F)F 2230a_100102631434_100000757363 [0,2,0,0,0,0|1,0,1]=4 5778 B12R1.19 CN(C)Cc1ccc(c(c1)F)F 269982a_100102631434_100000757363 [0,2,0,0,0,0|1,0,1]=4 5779 B12R1.19 CN(C)Cc1ccc(c(c1)F)F 270004a_100102631434_100000211062 [0,2,0,0,0,0|1,0,1]=4 5780 B12R1.19 CN(C)Cc1ccc(c(c1)F)I 2230a_100102631434_100010149604 [0,2,0,0,0,0|1,0,1]=4 5781 B12R1.19 CN(C)Cc1ccc(c(c1)F)I 269982a_100102631434_100010149604 [0,2,0,0,0,0|1,0,1]=4 5782 B12R1.19 CN(C)Cc1ccc(c(c1)F)I 270004a_100102631434_100000050832 [0,2,0,0,0,0|1,0,1]=4 5783 B12R1.19 CN(C)Cc1ccc(c(c1)I)Br 2230a_100102631434_100010146616 [0,2,0,0,0,0|1,0,1]=4 5784 B12R1.19 CN(C)Cc1ccc(c(c1)I)Br 269982a_100102631434_100010146616 [0,2,0,0,0,0|1,0,1]=4 5785 B12R1.19 CN(C)Cc1ccc(c(c1)I)Br 270004a_100102631434_100010146563 [0,2,0,0,0,0|1,0,1]=4 5786 B12R1.19 CN(C)Cc1ccc(c(c1)I)Cl 270004a_100102631434_100010209939 [0,2,0,0,0,0|1,0,1]=4 5787 B12R1.19 CN(C)Cc1ccc(c(c1)I)F 2230a_100102631434_100010188208 [0,2,0,0,0,0|1,0,1]=4 5788 B12R1.19 CN(C)Cc1ccc(c(c1)I)F 269982a_100102631434_100010188208 [0,2,0,0,0,0|1,0,1]=4 5789 B12R1.19 CN(C)Cc1ccc(c(c1)I)F 270004a_100102631434_100010188209 [0,2,0,0,0,0|1,0,1]=4 5790 B12R1.19 CN([13CH3])Cc1ccc(c(c1)Cl)Cl 2230a_100000184578_200025704644 [0,2,0,0,0,0|1,0,1]=4 5791 B12R1.19 CN([13CH3])Cc1ccc(c(c1)Cl)Cl 269982a_100000184578_200025704644 [0,2,0,0,0,0|1,0,1]=4 5792 B12R1.19 CN([13CH3])Cc1ccc(c(c1)Cl)Cl 34a_100000184578_200025704644 [0,2,0,0,0,0|1,0,1]=4 5793 B12R1.19 Cc1cc(ccc1Br)CC(=O)[13CH3] 1458a_100012340274_200025704644 [0,2,0,0,0,0|1,0,0]=3 5794 B12R1.19 Cc1cc(ccc1Br)CN(C)C 2230a_100102631434_100000727479 [0,2,0,0,0,0|1,0,1]=4 5795 B12R1.19 Cc1cc(ccc1Br)CN(C)C 269982a_100102631434_100000727479 [0,2,0,0,0,0|1,0,1]=4 5796 B12R1.19 Cc1cc(ccc1Br)CN(C)C 270004a_100102631434_100000765772 [0,2,0,0,0,0|1,0,1]=4 5797 B12R1.19 Cc1cc(ccc1Cl)CN(C)C 2230a_100102631434_100012184735 [0,2,0,0,0,0|1,0,1]=4 5798 B12R1.19 Cc1cc(ccc1Cl)CN(C)C 269982a_100102631434_100012184735 [0,2,0,0,0,0|1,0,1]=4 5799 B12R1.19 Cc1cc(ccc1Cl)CN(C)C 270004a_100102631434_100000698814 [0,2,0,0,0,0|1,0,1]=4 5800 B12R1.19 Cc1cc(ccc1F)CC(=O)[13CH3] 1458a_100011667458_200025704644 [0,2,0,0,0,0|1,0,0]=3 5801 B12R1.19 Cc1cc(ccc1F)CN(C)C 2230a_100102631434_100011216667 [0,2,0,0,0,0|1,0,1]=4 5802 B12R1.19 Cc1cc(ccc1F)CN(C)C 269982a_100102631434_100011216667 [0,2,0,0,0,0|1,0,1]=4 5803 B12R1.19 Cc1cc(ccc1F)CN(C)C 270004a_100102631434_100000748208 [0,2,0,0,0,0|1,0,1]=4 5804 B12R1.19 Cc1cc(ccc1O)CC(=O)[13CH3] 1458a_100000083968_200025704644 [0,2,0,0,0,0|1,0,0]=3 5805 B12R1.19 Cc1ccc(cc1Br)CC(=O)[13CH3] 1458a_100000709925_200025704644 [0,2,0,0,0,0|1,0,0]=3 5806 B12R1.19 Cc1ccc(cc1Br)CN(C)C 2230a_100102631434_100012232412 [0,2,0,0,0,0|1,0,1]=4 5807 B12R1.19 Cc1ccc(cc1Br)CN(C)C 269982a_100102631434_100012232412 [0,2,0,0,0,0|1,0,1]=4 5808 B12R1.19 Cc1ccc(cc1Br)CN(C)C 270004a_100102631434_100000695567 [0,2,0,0,0,0|1,0,1]=4 5809 B12R1.19 Cc1ccc(cc1C)CC(=O)[13CH3] 1458a_100000184070_200025704644 [0,2,0,0,0,0|1,0,0]=3 5810 B12R1.19 Cc1ccc(cc1C)CN(C)C 2230a_100015204808_200000210301 [0,2,0,0,0,0|1,0,1]=4 5811 B12R1.19 Cc1ccc(cc1C)CN(C)C 2230a_100102631434_100000742320 [0,2,0,0,0,0|1,0,1]=4 5812 B12R1.19 Cc1ccc(cc1C)CN(C)C 269982a_100015204808_200000210301 [0,2,0,0,0,0|1,0,1]=4 5813 B12R1.19 Cc1ccc(cc1C)CN(C)C 269982a_100102631434_100000742320 [0,2,0,0,0,0|1,0,1]=4 5814 B12R1.19 Cc1ccc(cc1C)CN(C)C 270004a_100102631434_100000229942 [0,2,0,0,0,0|1,0,1]=4 5815 B12R1.19 Cc1ccc(cc1C)CN(C)C 34a_100015204808_200000210301 [0,2,0,0,0,0|1,0,1]=4 5816 B12R1.19 Cc1ccc(cc1C)CN(C)[13CH3] 2230a_100015204808_200025704644 [0,2,0,0,0,0|1,0,1]=4 5817 B12R1.19 Cc1ccc(cc1C)CN(C)[13CH3] 269982a_100015204808_200025704644 [0,2,0,0,0,0|1,0,1]=4 5818 B12R1.19 Cc1ccc(cc1C)CN(C)[13CH3] 34a_100015204808_200025704644 [0,2,0,0,0,0|1,0,1]=4 5819 B12R1.19 Cc1ccc(cc1Cl)CN(C)C 2230a_100102631434_100011823929 [0,2,0,0,0,0|1,0,1]=4 5820 B12R1.19 Cc1ccc(cc1Cl)CN(C)C 269982a_100102631434_100011823929 [0,2,0,0,0,0|1,0,1]=4 5821 B12R1.19 Cc1ccc(cc1Cl)CN(C)C 270004a_100102631434_100000760539 [0,2,0,0,0,0|1,0,1]=4 5822 B12R1.19 Cc1ccc(cc1F)CC(=O)[13CH3] 1458a_100011217375_200025704644 [0,2,0,0,0,0|1,0,0]=3 5823 B12R1.19 Cc1ccc(cc1F)CN(C)C 2230a_100102631434_100011217369 [0,2,0,0,0,0|1,0,1]=4 5824 B12R1.19 Cc1ccc(cc1F)CN(C)C 269982a_100102631434_100011217369 [0,2,0,0,0,0|1,0,1]=4 5825 B12R1.19 Cc1ccc(cc1F)CN(C)C 270004a_100102631434_100000753222 [0,2,0,0,0,0|1,0,1]=4 5826 B12R1.19 Cc1ccc(cc1I)CN(C)C 2230a_100102631434_100010206137 [0,2,0,0,0,0|1,0,1]=4 5827 B12R1.19 Cc1ccc(cc1I)CN(C)C 269982a_100102631434_100010206137 [0,2,0,0,0,0|1,0,1]=4 5828 B12R1.19 Cc1ccc(cc1I)CN(C)C 270004a_100102631434_100010197721 [0,2,0,0,0,0|1,0,1]=4 5829 B12R1.19 Cc1ccc(cc1O)CC(=O)[13CH3] 1458a_100000082272_200025704644 [0,2,0,0,0,0|1,0,0]=3 5830 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)Br)Cl 1458a_100012349508_200025704644 [0,2,0,0,0,0|1,0,0]=3 5831 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)Br)F 1458a_100000742997_200025704644 [0,2,0,0,0,0|1,0,0]=3 5832 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)Br)O 1458a_100009990404_200025704644 [0,2,0,0,0,0|1,0,0]=3 5833 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)Cl)Br 1458a_100000766880_200025704644 [0,2,0,0,0,0|1,0,0]=3 5834 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)Cl)Cl 1458a_100000210702_200025704644 [0,2,0,0,0,0|1,0,0]=3 5835 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)Cl)F 1458a_100011217296_200025704644 [0,2,0,0,0,0|1,0,0]=3 5836 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)Cl)O 1458a_100000035197_200025704644 [0,2,0,0,0,0|1,0,0]=3 5837 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)F)Br 1458a_100000691132_200025704644 [0,2,0,0,0,0|1,0,0]=3 5838 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)F)Cl 1458a_100000722404_200025704644 [0,2,0,0,0,0|1,0,0]=3 5839 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)F)F 1458a_100000684721_200025704644 [0,2,0,0,0,0|1,0,0]=3 5840 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)F)I 1458a_100010149632_200025704644 [0,2,0,0,0,0|1,0,0]=3 5841 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)F)O 1458a_100000039761_200025704644 [0,2,0,0,0,0|1,0,0]=3 5842 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)O)O 1458a_100000031429_200025704644 [0,2,0,0,0,0|1,0,0]=3 5843 B12R1.20 CC(=C(C)c1ccc(cc1)Br)C 271570a_200000049429_100000752885 [0,2,0,0,0,0|0,0,2]=4 5844 B12R1.20 CC(=C(C)c1ccc(cc1)C)C 271570a_200000049429_100000186775 [0,2,0,0,0,0|0,0,2]=4 5845 B12R1.20 CC(=C(C)c1ccc(cc1)Cl)C 271570a_200000049429_100000755918 [0,2,0,0,0,0|0,0,2]=4 5846 B12R1.20 CC(=C(C)c1ccc(cc1)F)C 271570a_200000049429_100000211213 [0,2,0,0,0,0|0,0,2]=4 5847 B12R1.20 CC(=C(C)c1ccc(cc1)N)C 271570a_200000049429_100000185761 [0,2,0,0,0,0|0,0,2]=4 5848 B12R1.20 CC(=C(C)c1ccc(cc1)O)C 271570a_200000049429_100000185759 [0,2,0,0,0,0|0,0,2]=4 5849 B12R1.20 CC(=O)C(C)c1ccc(cc1)Br 1458a_100000070787_100000755118 [0,2,0,0,0,0|1,0,0]=3 5850 B12R1.20 CC(=O)C(C)c1ccc(cc1)C 1458a_100000070787_100011261388 [0,2,0,0,0,0|1,0,0]=3 5851 B12R1.20 CC(=O)C(C)c1ccc(cc1)C 1458a_100000751627_200000210301 [0,2,0,0,0,0|1,0,0]=3 5852 B12R1.20 CC(=O)C(C)c1ccc(cc1)Cl 1458a_100000070787_100000684792 [0,2,0,0,0,0|1,0,0]=3 5853 B12R1.20 CC(=O)C(C)c1ccc(cc1)Cl 1458a_100011216001_200000210301 [0,2,0,0,0,0|1,0,0]=3 5854 B12R1.20 CC(=O)C(C)c1ccc(cc1)F 1458a_100000070787_100000743420 [0,2,0,0,0,0|1,0,0]=3 5855 B12R1.20 CC(=O)C(C)c1ccc(cc1)F 1458a_100011435297_200000210301 [0,2,0,0,0,0|1,0,0]=3 5856 B12R1.20 CC(=O)C(C)c1ccc(cc1)O 1458a_100000031422_200000210301 [0,2,0,0,0,0|1,0,0]=3 5857 B12R1.20 CC(=O)C(F)c1ccc(cc1)Cl 1458a_100012277543_200000210301 [0,2,0,0,0,0|1,0,0]=3 5858 B12R1.20 CC(=O)C(O)c1ccc(cc1)Br 1458a_100000756554_200000210301 [0,2,0,0,0,0|1,0,0]=3 5859 B12R1.20 CC(=O)C(O)c1ccc(cc1)F 1458a_100000209909_200000210301 [0,2,0,0,0,0|1,0,0]=3 5860 B12R1.20 CC(=O)C(O)c1ccc(cc1)O 1458a_100011215213_200000210301 [0,2,0,0,0,0|1,0,0]=3 5861 B12R1.20 CC(=O)N(C)c1ccc(cc1)Br 11a_100000219623_100015343762 [0,2,0,0,0,0|2,0,0]=4 5862 B12R1.20 CC(=O)N(C)c1ccc(cc1)Br 1626a_100000219623_100015343762 [0,2,0,0,0,0|2,0,0]=4 5863 B12R1.20 CC(=O)N(C)c1ccc(cc1)Br 22a_100000219623_100000070787 [0,2,0,0,0,0|2,0,0]=4 5864 B12R1.20 CC(=O)N(C)c1ccc(cc1)C 11a_100000219977_100015343762 [0,2,0,0,0,0|2,0,0]=4 5865 B12R1.20 CC(=O)N(C)c1ccc(cc1)C 1626a_100000219977_100015343762 [0,2,0,0,0,0|2,0,0]=4 5866 B12R1.20 CC(=O)N(C)c1ccc(cc1)C 22a_100000219977_100000070787 [0,2,0,0,0,0|2,0,0]=4 5867 B12R1.20 CC(=O)N(C)c1ccc(cc1)Cl 11a_100020629279_100015343762 [0,2,0,0,0,0|2,0,0]=4 5868 B12R1.20 CC(=O)N(C)c1ccc(cc1)Cl 1626a_100020629279_100015343762 [0,2,0,0,0,0|2,0,0]=4 5869 B12R1.20 CC(=O)N(C)c1ccc(cc1)Cl 22a_100020629279_100000070787 [0,2,0,0,0,0|2,0,0]=4 5870 B12R1.20 CC(=O)N(C)c1ccc(cc1)F 11a_100000219829_100015343762 [0,2,0,0,0,0|2,0,0]=4 5871 B12R1.20 CC(=O)N(C)c1ccc(cc1)F 1626a_100000219829_100015343762 [0,2,0,0,0,0|2,0,0]=4 5872 B12R1.20 CC(=O)N(C)c1ccc(cc1)F 22a_100000219829_100000070787 [0,2,0,0,0,0|2,0,0]=4 5873 B12R1.20 CC(=O)N(C)c1ccc(cc1)I 11a_100000743151_100015343762 [0,2,0,0,0,0|2,0,0]=4 5874 B12R1.20 CC(=O)N(C)c1ccc(cc1)I 1626a_100000743151_100015343762 [0,2,0,0,0,0|2,0,0]=4 5875 B12R1.20 CC(=O)N(C)c1ccc(cc1)I 22a_100000743151_100000070787 [0,2,0,0,0,0|2,0,0]=4 5876 B12R1.20 CC(=O)N(C)c1ccc(cc1)O 22a_100000182112_100000070787 [0,2,0,0,0,0|2,0,0]=4 5877 B12R1.20 CC(=O)N(C)c1ccc(cc1)O 271570a_203496583355_200009816415 [0,2,0,0,0,0|2,0,0]=4 5878 B12R1.20 CC(=O)N(C)c1ccc(cc1)O 527a_100000182112_100103153847 [0,2,0,0,0,0|2,0,0]=4 5879 B12R1.20 CC(=O)[C@H](O)c1ccc(cc1)C 1458a_100009815954_200000210301 [0,2,0,0,0,0|1,0,0]=3 5880 B12R1.20 CC(=O)[C@H](O)c1ccc(cc1)Cl 1458a_100009817493_200000210301 [0,2,0,0,0,0|1,0,0]=3 5881 B12R1.20 CC(C(=O)[13CH3])c1ccc(cc1)Cl 1458a_100011216001_200025704644 [0,2,0,0,0,0|1,0,0]=3 5882 B12R1.20 CC(C(=O)[13CH3])c1ccc(cc1)F 1458a_100011435297_200025704644 [0,2,0,0,0,0|1,0,0]=3 5883 B12R1.20 CC(C(=O)[13CH3])c1ccc(cc1)O 1458a_100000031422_200025704644 [0,2,0,0,0,0|1,0,0]=3 5884 B12R1.20 CC(C)[C@H](N)c1ccc(cc1)O 271570a_203496583355_100102422763 [0,2,0,0,0,0|0,0,2]=4 5885 B12R1.20 CC(c1ccc(cc1)Br)N(C)C 2230a_100000231103_200000210301 [0,2,0,0,0,0|1,0,1]=4 5886 B12R1.20 CC(c1ccc(cc1)Br)N(C)C 2230a_100102631434_100000755118 [0,2,0,0,0,0|1,0,1]=4 5887 B12R1.20 CC(c1ccc(cc1)Br)N(C)C 269982a_100000231103_200000210301 [0,2,0,0,0,0|1,0,1]=4 5888 B12R1.20 CC(c1ccc(cc1)Br)N(C)C 269982a_100102631434_100000755118 [0,2,0,0,0,0|1,0,1]=4 5889 B12R1.20 CC(c1ccc(cc1)Br)N(C)[13CH3] 2230a_100000231103_200025704644 [0,2,0,0,0,0|1,0,1]=4 5890 B12R1.20 CC(c1ccc(cc1)Br)N(C)[13CH3] 269982a_100000231103_200025704644 [0,2,0,0,0,0|1,0,1]=4 5891 B12R1.20 CC(c1ccc(cc1)Cl)N(C)C 2230a_100000231102_200000210301 [0,2,0,0,0,0|1,0,1]=4 5892 B12R1.20 CC(c1ccc(cc1)Cl)N(C)C 2230a_100102631434_100000684792 [0,2,0,0,0,0|1,0,1]=4 5893 B12R1.20 CC(c1ccc(cc1)Cl)N(C)C 269982a_100000231102_200000210301 [0,2,0,0,0,0|1,0,1]=4 5894 B12R1.20 CC(c1ccc(cc1)Cl)N(C)C 269982a_100102631434_100000684792 [0,2,0,0,0,0|1,0,1]=4 5895 B12R1.20 CC(c1ccc(cc1)Cl)N(C)[13CH3] 2230a_100000231102_200025704644 [0,2,0,0,0,0|1,0,1]=4 5896 B12R1.20 CC(c1ccc(cc1)Cl)N(C)[13CH3] 269982a_100000231102_200025704644 [0,2,0,0,0,0|1,0,1]=4 5897 B12R1.20 CC(c1ccc(cc1)F)N(C)C 2230a_100000222788_200000210301 [0,2,0,0,0,0|1,0,1]=4 5898 B12R1.20 CC(c1ccc(cc1)F)N(C)C 2230a_100102631434_100000743420 [0,2,0,0,0,0|1,0,1]=4 5899 B12R1.20 CC(c1ccc(cc1)F)N(C)C 269982a_100000222788_200000210301 [0,2,0,0,0,0|1,0,1]=4 5900 B12R1.20 CC(c1ccc(cc1)F)N(C)C 269982a_100102631434_100000743420 [0,2,0,0,0,0|1,0,1]=4 5901 B12R1.20 CC(c1ccc(cc1)F)N(C)C 34a_100000222788_200000210301 [0,2,0,0,0,0|1,0,1]=4 5902 B12R1.20 CC(c1ccc(cc1)F)N(C)[13CH3] 2230a_100000222788_200025704644 [0,2,0,0,0,0|1,0,1]=4 5903 B12R1.20 CC(c1ccc(cc1)F)N(C)[13CH3] 269982a_100000222788_200025704644 [0,2,0,0,0,0|1,0,1]=4 5904 B12R1.20 CC(c1ccc(cc1)F)N(C)[13CH3] 34a_100000222788_200025704644 [0,2,0,0,0,0|1,0,1]=4 5905 B12R1.20 Cc1ccc(cc1)C(C)C(=O)[13CH3] 1458a_100000751627_200025704644 [0,2,0,0,0,0|1,0,0]=3 5906 B12R1.20 Cc1ccc(cc1)C(C)N(C)C 2230a_100102631434_100011261388 [0,2,0,0,0,0|1,0,1]=4 5907 B12R1.20 Cc1ccc(cc1)C(C)N(C)C 269982a_100102631434_100011261388 [0,2,0,0,0,0|1,0,1]=4 5908 B12R1.20 Cc1ccc(cc1)[C@@H](O)C(=O)[13CH3] 1458a_100009815954_200025704644 [0,2,0,0,0,0|1,0,0]=3 5909 B12R1.20 [13CH3]C(=O)C(F)c1ccc(cc1)Cl 1458a_100012277543_200025704644 [0,2,0,0,0,0|1,0,0]=3 5910 B12R1.20 [13CH3]C(=O)C(O)c1ccc(cc1)Br 1458a_100000756554_200025704644 [0,2,0,0,0,0|1,0,0]=3 5911 B12R1.20 [13CH3]C(=O)C(O)c1ccc(cc1)F 1458a_100000209909_200025704644 [0,2,0,0,0,0|1,0,0]=3 5912 B12R1.20 [13CH3]C(=O)C(O)c1ccc(cc1)O 1458a_100011215213_200025704644 [0,2,0,0,0,0|1,0,0]=3 5913 B12R1.20 [13CH3]C(=O)[C@H](O)c1ccc(cc1)Cl 1458a_100009817493_200025704644 [0,2,0,0,0,0|1,0,0]=3 5914 B12R1.49 C#CC(=O)Cc1ccc(cc1)Br 1458a_100000211873_100000189115 [0,2,0,0,0,0|1,0,1]=4 5915 B12R1.49 C#CC(=O)Cc1ccc(cc1)C 1458a_100000211873_100000210814 [0,2,0,0,0,0|1,0,1]=4 5916 B12R1.49 C#CC(=O)Cc1ccc(cc1)Cl 1458a_100000211873_100000694040 [0,2,0,0,0,0|1,0,1]=4 5917 B12R1.49 C#CC(=O)Cc1ccc(cc1)F 1458a_100000211873_100000198546 [0,2,0,0,0,0|1,0,1]=4 5918 B12R1.49 C#CC(=O)Cc1ccc(cc1)I 1458a_100000211873_100000189116 [0,2,0,0,0,0|1,0,1]=4 5919 B12R1.49 C=CC(=O)Cc1ccc(cc1)Br 1458a_100000185746_100000189115 [0,2,0,0,0,0|1,0,0]=3 5920 B12R1.49 C=CC(=O)Cc1ccc(cc1)C 1458a_100000185746_100000210814 [0,2,0,0,0,0|1,0,0]=3 5921 B12R1.49 C=CC(=O)Cc1ccc(cc1)Cl 1458a_100000185746_100000694040 [0,2,0,0,0,0|1,0,0]=3 5922 B12R1.49 C=CC(=O)Cc1ccc(cc1)F 1458a_100000185746_100000198546 [0,2,0,0,0,0|1,0,0]=3 5923 B12R1.49 C=CC(=O)Cc1ccc(cc1)I 1458a_100000185746_100000189116 [0,2,0,0,0,0|1,0,0]=3 5924 B12R1.49 C=CC(=O)Cc1ccc(cn1)Br 1458a_100000185746_100000702658 [0,2,0,0,0,0|2,0,0]=4 5925 B12R1.49 C=CC(=O)Cc1ccc(cn1)C 1458a_100000185746_100000691093 [0,2,0,0,0,0|2,0,0]=4 5926 B12R1.49 C=CC(=O)Cc1ccc(cn1)Cl 1458a_100000185746_100012066911 [0,2,0,0,0,0|2,0,0]=4 5927 B12R1.49 C=CC(=O)Cc1ccc(cn1)F 1458a_100000185746_100000703193 [0,2,0,0,0,0|2,0,0]=4 5928 B12R1.49 C=CC(=O)Cc1ccc(nc1)Br 1458a_100000185746_100009831999 [0,2,0,0,0,0|2,0,0]=4 5929 B12R1.49 C=CC(=O)Cc1ccc(nc1)C 1458a_100000185746_100016987292 [0,2,0,0,0,0|2,0,0]=4 5930 B12R1.49 C=CC(=O)Cc1ccc(nc1)Cl 1458a_100000185746_100000735431 [0,2,0,0,0,0|2,0,0]=4 5931 B12R1.49 C=CC(=O)Cc1ccc(nc1)F 1458a_100000185746_100009820150 [0,2,0,0,0,0|2,0,0]=4 5932 B12R1.49 C=CC(=O)Nc1ccc(cc1)Br 1626a_100000210018_100000185746 [0,2,0,0,0,0|2,0,0]=4 5933 B12R1.49 C=CC(=O)Nc1ccc(cc1)Br 22a_100000210018_100000185746 [0,2,0,0,0,0|2,0,0]=4 5934 B12R1.49 C=CC(=O)Nc1ccc(cc1)C 1626a_100000124888_100000185746 [0,2,0,0,0,0|2,0,0]=4 5935 B12R1.49 C=CC(=O)Nc1ccc(cc1)C 22a_100000124888_100000185746 [0,2,0,0,0,0|2,0,0]=4 5936 B12R1.49 C=CC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000185746 [0,2,0,0,0,0|2,0,0]=4 5937 B12R1.49 C=CC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000185746 [0,2,0,0,0,0|2,0,0]=4 5938 B12R1.49 C=CC(=O)Nc1ccc(cc1)F 1626a_100000185862_100000185746 [0,2,0,0,0,0|2,0,0]=4 5939 B12R1.49 C=CC(=O)Nc1ccc(cc1)F 22a_100000185862_100000185746 [0,2,0,0,0,0|2,0,0]=4 5940 B12R1.49 C=CC(=O)Nc1ccc(cc1)I 1626a_100000185761_100000185746 [0,2,0,0,0,0|2,0,0]=4 5941 B12R1.49 C=CC(=O)Nc1ccc(cc1)I 22a_100000185761_100000185746 [0,2,0,0,0,0|2,0,0]=4 5942 B12R1.49 C=CC(=O)Nc1ccc(cc1)O 22a_100000185829_100000185746 [0,2,0,0,0,0|2,0,0]=4 5943 B12R1.49 C=CC(C)Sc1ccc(cc1)Br 62a_100011215867_100000752885 [0,2,0,0,0,0|1,0,1]=4 5944 B12R1.49 C=CC(C)Sc1ccc(cc1)C 62a_100011215867_100000186775 [0,2,0,0,0,0|1,0,1]=4 5945 B12R1.49 C=CC(C)Sc1ccc(cc1)Cl 62a_100011215867_100000755918 [0,2,0,0,0,0|1,0,1]=4 5946 B12R1.49 C=CC(C)Sc1ccc(cc1)F 62a_100011215867_100000211213 [0,2,0,0,0,0|1,0,1]=4 5947 B12R1.49 C=CC(C)Sc1ccc(cc1)N 62a_100011215867_100000185761 [0,2,0,0,0,0|1,0,1]=4 5948 B12R1.49 C=CC(C)Sc1ccc(cc1)O 62a_100011215867_100000185759 [0,2,0,0,0,0|1,0,1]=4 5949 B12R1.49 CC(=Cc1ccc(cc1)Br)C#N 6a_100000186029_200000212204 [0,2,0,0,0,0|0,0,2]=4 5950 B12R1.49 CC(=Cc1ccc(cc1)F)C#N 6a_100000210084_200000212204 [0,2,0,0,0,0|0,0,2]=4 5951 B12R1.49 CC(=Cc1ccc(cc1)I)C#N 6a_100000188517_200000212204 [0,2,0,0,0,0|0,0,2]=4 5952 B12R1.49 CC(Cc1ccc(cc1)F)O[13CH3] 34a_100011351027_200025704644 [0,2,0,0,0,0|0,0,2]=4 5953 B12R1.49 CC(Cc1ccc(cc1)F)O[13CH3] 7a_100011351027_200025704644 [0,2,0,0,0,0|0,0,2]=4 5954 B12R1.49 CC(Cc1ccc(cc1)O)N[13CH3] 2230a_100102634573_200025704644 [0,2,0,0,0,0|0,0,2]=4 5955 B12R1.49 CC(Cc1ccc(cc1)O)N[13CH3] 34a_100102634573_200025704644 [0,2,0,0,0,0|0,0,2]=4 5956 B12R1.49 CCC(=O)Cc1ccc(cc1)Br 1458a_100000198978_100000210202 [0,2,0,0,0,0|1,0,0]=3 5957 B12R1.49 CCC(=O)Cc1ccc(cc1)Br 1458a_100000210414_100000189115 [0,2,0,0,0,0|1,0,0]=3 5958 B12R1.49 CCC(=O)Cc1ccc(cc1)C 1458a_100000210414_100000210814 [0,2,0,0,0,0|1,0,0]=3 5959 B12R1.49 CCC(=O)Cc1ccc(cc1)C 1458a_100000212244_100000210202 [0,2,0,0,0,0|1,0,0]=3 5960 B12R1.49 CCC(=O)Cc1ccc(cc1)Cl 1458a_100000210414_100000694040 [0,2,0,0,0,0|1,0,0]=3 5961 B12R1.49 CCC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100000210202 [0,2,0,0,0,0|1,0,0]=3 5962 B12R1.49 CCC(=O)Cc1ccc(cc1)F 1458a_100000210414_100000198546 [0,2,0,0,0,0|1,0,0]=3 5963 B12R1.49 CCC(=O)Cc1ccc(cc1)F 1458a_100000210951_100000210202 [0,2,0,0,0,0|1,0,0]=3 5964 B12R1.49 CCC(=O)Cc1ccc(cc1)I 1458a_100000210414_100000189116 [0,2,0,0,0,0|1,0,0]=3 5965 B12R1.49 CCC(=O)Cc1ccc(cc1)I 1458a_100000688869_100000210202 [0,2,0,0,0,0|1,0,0]=3 5966 B12R1.49 CCC(=O)Cc1ccc(cc1)O 1458a_100000198540_100000210202 [0,2,0,0,0,0|1,0,0]=3 5967 B12R1.49 CCC(=O)Cc1ccc(cn1)Br 1458a_100000210414_100000702658 [0,2,0,0,0,0|2,0,0]=4 5968 B12R1.49 CCC(=O)Cc1ccc(cn1)Br 1458a_100020629044_100000210202 [0,2,0,0,0,0|2,0,0]=4 5969 B12R1.49 CCC(=O)Cc1ccc(cn1)C 1458a_100000210414_100000691093 [0,2,0,0,0,0|2,0,0]=4 5970 B12R1.49 CCC(=O)Cc1ccc(cn1)C 1458a_100025705728_100000210202 [0,2,0,0,0,0|2,0,0]=4 5971 B12R1.49 CCC(=O)Cc1ccc(cn1)Cl 1458a_100000210414_100012066911 [0,2,0,0,0,0|2,0,0]=4 5972 B12R1.49 CCC(=O)Cc1ccc(cn1)Cl 1458a_100000728320_100000210202 [0,2,0,0,0,0|2,0,0]=4 5973 B12R1.49 CCC(=O)Cc1ccc(cn1)F 1458a_100000210414_100000703193 [0,2,0,0,0,0|2,0,0]=4 5974 B12R1.49 CCC(=O)Cc1ccc(nc1)Br 1458a_100000210414_100009831999 [0,2,0,0,0,0|2,0,0]=4 5975 B12R1.49 CCC(=O)Cc1ccc(nc1)Br 1458a_100010067268_100000210202 [0,2,0,0,0,0|2,0,0]=4 5976 B12R1.49 CCC(=O)Cc1ccc(nc1)C 1458a_100000210414_100016987292 [0,2,0,0,0,0|2,0,0]=4 5977 B12R1.49 CCC(=O)Cc1ccc(nc1)C 1458a_100000740413_100000210202 [0,2,0,0,0,0|2,0,0]=4 5978 B12R1.49 CCC(=O)Cc1ccc(nc1)Cl 1458a_100000061944_100000210202 [0,2,0,0,0,0|2,0,0]=4 5979 B12R1.49 CCC(=O)Cc1ccc(nc1)Cl 1458a_100000210414_100000735431 [0,2,0,0,0,0|2,0,0]=4 5980 B12R1.49 CCC(=O)Cc1ccc(nc1)F 1458a_100000210414_100009820150 [0,2,0,0,0,0|2,0,0]=4 5981 B12R1.49 CCC(=O)Cn1ccc(=O)cc1 1458a_200000238563_100000210202 [0,2,0,0,0,0|2,0,0]=4 5982 B12R1.49 CCC(=O)Nc1ccc(cc1)Br 11a_100000210018_100000210414 [0,2,0,0,0,0|2,0,0]=4 5983 B12R1.49 CCC(=O)Nc1ccc(cc1)Br 1626a_100000210018_100000210414 [0,2,0,0,0,0|2,0,0]=4 5984 B12R1.49 CCC(=O)Nc1ccc(cc1)Br 22a_100000210018_100000210414 [0,2,0,0,0,0|2,0,0]=4 5985 B12R1.49 CCC(=O)Nc1ccc(cc1)Br 527a_100000210018_100000210414 [0,2,0,0,0,0|2,0,0]=4 5986 B12R1.49 CCC(=O)Nc1ccc(cc1)C 11a_100000124888_100000210414 [0,2,0,0,0,0|2,0,0]=4 5987 B12R1.49 CCC(=O)Nc1ccc(cc1)C 1626a_100000124888_100000210414 [0,2,0,0,0,0|2,0,0]=4 5988 B12R1.49 CCC(=O)Nc1ccc(cc1)C 22a_100000124888_100000210414 [0,2,0,0,0,0|2,0,0]=4 5989 B12R1.49 CCC(=O)Nc1ccc(cc1)C 527a_100000124888_100000210414 [0,2,0,0,0,0|2,0,0]=4 5990 B12R1.49 CCC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000210414 [0,2,0,0,0,0|2,0,0]=4 5991 B12R1.49 CCC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000210414 [0,2,0,0,0,0|2,0,0]=4 5992 B12R1.49 CCC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000210414 [0,2,0,0,0,0|2,0,0]=4 5993 B12R1.49 CCC(=O)Nc1ccc(cc1)Cl 527a_100000210052_100000210414 [0,2,0,0,0,0|2,0,0]=4 5994 B12R1.49 CCC(=O)Nc1ccc(cc1)F 11a_100000185862_100000210414 [0,2,0,0,0,0|2,0,0]=4 5995 B12R1.49 CCC(=O)Nc1ccc(cc1)F 1626a_100000185862_100000210414 [0,2,0,0,0,0|2,0,0]=4 5996 B12R1.49 CCC(=O)Nc1ccc(cc1)F 22a_100000185862_100000210414 [0,2,0,0,0,0|2,0,0]=4 5997 B12R1.49 CCC(=O)Nc1ccc(cc1)F 527a_100000185862_100000210414 [0,2,0,0,0,0|2,0,0]=4 5998 B12R1.49 CCC(=O)Nc1ccc(cc1)I 11a_100000185761_100000210414 [0,2,0,0,0,0|2,0,0]=4 5999 B12R1.49 CCC(=O)Nc1ccc(cc1)I 1626a_100000185761_100000210414 [0,2,0,0,0,0|2,0,0]=4 6000 B12R1.49 CCC(=O)Nc1ccc(cc1)I 22a_100000185761_100000210414 [0,2,0,0,0,0|2,0,0]=4 6001 B12R1.49 CCC(=O)Nc1ccc(cc1)I 527a_100000185761_100000210414 [0,2,0,0,0,0|2,0,0]=4 6002 B12R1.49 CCC(=O)Nc1ccc(cc1)O 22a_100000185829_100000210414 [0,2,0,0,0,0|2,0,0]=4 6003 B12R1.49 CCC(=O)Oc1ccc(cc1)O 271570a_203496583355_200009811598 [0,2,0,0,0,0|2,0,0]=4 6004 B12R1.49 CCN(C)Cc1ccc(cc1)Br 2230a_100000180866_100000210202 [0,2,0,0,0,0|1,0,1]=4 6005 B12R1.49 CCN(C)Cc1ccc(cc1)Br 2230a_100000187385_200000210301 [0,2,0,0,0,0|1,0,1]=4 6006 B12R1.49 CCN(C)Cc1ccc(cc1)Br 2230a_100000225621_100011217064 [0,2,0,0,0,0|1,0,1]=4 6007 B12R1.49 CCN(C)Cc1ccc(cc1)Br 269982a_100000180866_100000204670 [0,2,0,0,0,0|1,0,1]=4 6008 B12R1.49 CCN(C)Cc1ccc(cc1)Br 269982a_100000187385_200000210301 [0,2,0,0,0,0|1,0,1]=4 6009 B12R1.49 CCN(C)Cc1ccc(cc1)Br 269982a_100000225621_100011217064 [0,2,0,0,0,0|1,0,1]=4 6010 B12R1.49 CCN(C)Cc1ccc(cc1)Br 26a_100000225621_100000185759 [0,2,0,0,0,0|1,0,1]=4 6011 B12R1.49 CCN(C)Cc1ccc(cc1)C 2230a_100000180869_200000210301 [0,2,0,0,0,0|1,0,1]=4 6012 B12R1.49 CCN(C)Cc1ccc(cc1)C 2230a_100000225621_100000210814 [0,2,0,0,0,0|1,0,1]=4 6013 B12R1.49 CCN(C)Cc1ccc(cc1)C 2230a_100000744650_100000210202 [0,2,0,0,0,0|1,0,1]=4 6014 B12R1.49 CCN(C)Cc1ccc(cc1)C 269982a_100000180869_200000210301 [0,2,0,0,0,0|1,0,1]=4 6015 B12R1.49 CCN(C)Cc1ccc(cc1)C 269982a_100000225621_100000210814 [0,2,0,0,0,0|1,0,1]=4 6016 B12R1.49 CCN(C)Cc1ccc(cc1)C 269982a_100000744650_100000204670 [0,2,0,0,0,0|1,0,1]=4 6017 B12R1.49 CCN(C)Cc1ccc(cc1)C 26a_100000225621_200020625495 [0,2,0,0,0,0|1,0,1]=4 6018 B12R1.49 CCN(C)Cc1ccc(cc1)C 34a_100000744650_100000210202 [0,2,0,0,0,0|1,0,1]=4 6019 B12R1.49 CCN(C)Cc1ccc(cc1)Cl 2230a_100000180830_200000210301 [0,2,0,0,0,0|1,0,1]=4 6020 B12R1.49 CCN(C)Cc1ccc(cc1)Cl 2230a_100000184517_100000210202 [0,2,0,0,0,0|1,0,1]=4 6021 B12R1.49 CCN(C)Cc1ccc(cc1)Cl 2230a_100000225621_100000694040 [0,2,0,0,0,0|1,0,1]=4 6022 B12R1.49 CCN(C)Cc1ccc(cc1)Cl 269982a_100000180830_200000210301 [0,2,0,0,0,0|1,0,1]=4 6023 B12R1.49 CCN(C)Cc1ccc(cc1)Cl 269982a_100000184517_100000204670 [0,2,0,0,0,0|1,0,1]=4 6024 B12R1.49 CCN(C)Cc1ccc(cc1)Cl 269982a_100000225621_100000187161 [0,2,0,0,0,0|1,0,1]=4 6025 B12R1.49 CCN(C)Cc1ccc(cc1)Cl 34a_100000184517_100000210202 [0,2,0,0,0,0|1,0,1]=4 6026 B12R1.49 CCN(C)Cc1ccc(cc1)F 2230a_100000184576_100000210202 [0,2,0,0,0,0|1,0,1]=4 6027 B12R1.49 CCN(C)Cc1ccc(cc1)F 2230a_100000225621_100000198546 [0,2,0,0,0,0|1,0,1]=4 6028 B12R1.49 CCN(C)Cc1ccc(cc1)F 2230a_100015183324_200000210301 [0,2,0,0,0,0|1,0,1]=4 6029 B12R1.49 CCN(C)Cc1ccc(cc1)F 269982a_100000184576_100000204670 [0,2,0,0,0,0|1,0,1]=4 6030 B12R1.49 CCN(C)Cc1ccc(cc1)F 269982a_100000225621_100000198546 [0,2,0,0,0,0|1,0,1]=4 6031 B12R1.49 CCN(C)Cc1ccc(cc1)F 269982a_100015183324_200000210301 [0,2,0,0,0,0|1,0,1]=4 6032 B12R1.49 CCN(C)Cc1ccc(cc1)F 34a_100000184576_100000210202 [0,2,0,0,0,0|1,0,1]=4 6033 B12R1.49 CCN(C)Cc1ccc(cc1)F 34a_100015183324_200000210301 [0,2,0,0,0,0|1,0,1]=4 6034 B12R1.49 CCN(C)Cc1ccc(cc1)I 2230a_100000225621_100000189116 [0,2,0,0,0,0|1,0,1]=4 6035 B12R1.49 CCN(C)Cc1ccc(cc1)I 269982a_100000225621_100000189116 [0,2,0,0,0,0|1,0,1]=4 6036 B12R1.49 CCN(C)Cc1ccc(cc1)O 2230a_100000207500_100000210202 [0,2,0,0,0,0|1,0,1]=4 6037 B12R1.49 CCN(C)Cc1ccc(cc1)O 269982a_100000207500_100000204670 [0,2,0,0,0,0|1,0,1]=4 6038 B12R1.49 CCN(C)Cc1ccc(cc1)O 269982a_100000748449_200000210301 [0,2,0,0,0,0|1,0,1]=4 6039 B12R1.49 CCN([13CH3])Cc1ccc(cc1)Br 2230a_100000187385_200025704644 [0,2,0,0,0,0|1,0,1]=4 6040 B12R1.49 CCN([13CH3])Cc1ccc(cc1)Br 269982a_100000187385_200025704644 [0,2,0,0,0,0|1,0,1]=4 6041 B12R1.49 CCN([13CH3])Cc1ccc(cc1)C 2230a_100000180869_200025704644 [0,2,0,0,0,0|1,0,1]=4 6042 B12R1.49 CCN([13CH3])Cc1ccc(cc1)C 269982a_100000180869_200025704644 [0,2,0,0,0,0|1,0,1]=4 6043 B12R1.49 CCN([13CH3])Cc1ccc(cc1)Cl 2230a_100000180830_200025704644 [0,2,0,0,0,0|1,0,1]=4 6044 B12R1.49 CCN([13CH3])Cc1ccc(cc1)Cl 269982a_100000180830_200025704644 [0,2,0,0,0,0|1,0,1]=4 6045 B12R1.49 CCN([13CH3])Cc1ccc(cc1)F 2230a_100015183324_200025704644 [0,2,0,0,0,0|1,0,1]=4 6046 B12R1.49 CCN([13CH3])Cc1ccc(cc1)F 269982a_100015183324_200025704644 [0,2,0,0,0,0|1,0,1]=4 6047 B12R1.49 CCN([13CH3])Cc1ccc(cc1)F 34a_100015183324_200025704644 [0,2,0,0,0,0|1,0,1]=4 6048 B12R1.49 CCN([13CH3])Cc1ccc(cc1)O 269982a_100000748449_200025704644 [0,2,0,0,0,0|1,0,1]=4 6049 B12R1.49 CN(CF)Cc1ccc(cc1)Br 269982a_100000180866_100015361967 [0,2,0,0,0,0|1,0,1]=4 6050 B12R1.49 CN(CF)Cc1ccc(cc1)Cl 269982a_100000184517_100015361967 [0,2,0,0,0,0|1,0,1]=4 6051 B12R1.49 CN(CF)Cc1ccc(cc1)Cl 34a_100000184517_100015361967 [0,2,0,0,0,0|1,0,1]=4 6052 B12R1.49 CN(CF)Cc1ccc(cc1)F 269982a_100000184576_100015361967 [0,2,0,0,0,0|1,0,1]=4 6053 B12R1.49 CN(CF)Cc1ccc(cc1)F 34a_100000184576_100015361967 [0,2,0,0,0,0|1,0,1]=4 6054 B12R1.49 CN(CF)Cc1ccc(cc1)O 269982a_100000207500_100015361967 [0,2,0,0,0,0|1,0,1]=4 6055 B12R1.49 CNC(=O)Cc1ccc(cc1)Br 11a_106832991635_100000198978 [0,2,0,0,0,0|1,0,0]=3 6056 B12R1.49 CNC(=O)Cc1ccc(cc1)Br 240690a_100102657272_100000198978 [0,2,0,0,0,0|1,0,0]=3 6057 B12R1.49 CNC(=O)Cc1ccc(cc1)Br 527a_100102657272_100000198978 [0,2,0,0,0,0|1,0,0]=3 6058 B12R1.49 CNC(=O)Cc1ccc(cc1)C 11a_106832991635_100000212244 [0,2,0,0,0,0|1,0,0]=3 6059 B12R1.49 CNC(=O)Cc1ccc(cc1)C 240690a_100102657272_100000212244 [0,2,0,0,0,0|1,0,0]=3 6060 B12R1.49 CNC(=O)Cc1ccc(cc1)C 527a_100102657272_100000212244 [0,2,0,0,0,0|1,0,0]=3 6061 B12R1.49 CNC(=O)Cc1ccc(cc1)Cl 11a_106832991635_100000211027 [0,2,0,0,0,0|1,0,0]=3 6062 B12R1.49 CNC(=O)Cc1ccc(cc1)Cl 240690a_100102657272_100000211027 [0,2,0,0,0,0|1,0,0]=3 6063 B12R1.49 CNC(=O)Cc1ccc(cc1)Cl 527a_100102657272_100000211027 [0,2,0,0,0,0|1,0,0]=3 6064 B12R1.49 CNC(=O)Cc1ccc(cc1)F 11a_106832991635_100000210951 [0,2,0,0,0,0|1,0,0]=3 6065 B12R1.49 CNC(=O)Cc1ccc(cc1)F 1626a_100102657272_100000210951 [0,2,0,0,0,0|1,0,0]=3 6066 B12R1.49 CNC(=O)Cc1ccc(cc1)F 240690a_100102657272_100000210951 [0,2,0,0,0,0|1,0,0]=3 6067 B12R1.49 CNC(=O)Cc1ccc(cc1)F 527a_100102657272_100000210951 [0,2,0,0,0,0|1,0,0]=3 6068 B12R1.49 CNC(=O)Cc1ccc(cc1)I 11a_106832991635_100000688869 [0,2,0,0,0,0|1,0,0]=3 6069 B12R1.49 CNC(=O)Cc1ccc(cc1)I 1626a_100102657272_100000688869 [0,2,0,0,0,0|1,0,0]=3 6070 B12R1.49 CNC(=O)Cc1ccc(cc1)I 240690a_100102657272_100000688869 [0,2,0,0,0,0|1,0,0]=3 6071 B12R1.49 CNC(=O)Cc1ccc(cc1)I 527a_100102657272_100000688869 [0,2,0,0,0,0|1,0,0]=3 6072 B12R1.49 CNC(=O)Cc1ccc(cc1)O 1626a_100102657272_100000198540 [0,2,0,0,0,0|1,0,0]=3 6073 B12R1.49 CNC(=O)Cc1ccc(cc1)O 240690a_100102657272_100000198540 [0,2,0,0,0,0|1,0,0]=3 6074 B12R1.49 CNC(=O)Cc1ccc(cc1)O 271570a_203496583355_100000155101 [0,2,0,0,0,0|1,0,0]=3 6075 B12R1.49 CNC(=O)Cc1ccc(cc1)O 527a_100102657272_100000198540 [0,2,0,0,0,0|1,0,0]=3 6076 B12R1.49 CNC(=O)Cc1ccc(cn1)Br 11a_106832991635_100020629044 [0,2,0,0,0,0|2,0,0]=4 6077 B12R1.49 CNC(=O)Cc1ccc(cn1)Br 240690a_100102657272_100020629044 [0,2,0,0,0,0|2,0,0]=4 6078 B12R1.49 CNC(=O)Cc1ccc(cn1)C 11a_106832991635_100025705728 [0,2,0,0,0,0|2,0,0]=4 6079 B12R1.49 CNC(=O)Cc1ccc(cn1)C 1626a_100102657272_100025705728 [0,2,0,0,0,0|2,0,0]=4 6080 B12R1.49 CNC(=O)Cc1ccc(cn1)C 240690a_100102657272_100025705728 [0,2,0,0,0,0|2,0,0]=4 6081 B12R1.49 CNC(=O)Cc1ccc(cn1)Cl 11a_106832991635_100000728320 [0,2,0,0,0,0|2,0,0]=4 6082 B12R1.49 CNC(=O)Cc1ccc(cn1)Cl 1626a_100102657272_100000728320 [0,2,0,0,0,0|2,0,0]=4 6083 B12R1.49 CNC(=O)Cc1ccc(cn1)Cl 240690a_100102657272_100000728320 [0,2,0,0,0,0|2,0,0]=4 6084 B12R1.49 CNC(=O)Cc1ccc(cn1)Cl 527a_100102657272_100000728320 [0,2,0,0,0,0|2,0,0]=4 6085 B12R1.49 CNC(=O)Cc1ccc(nc1)Br 11a_106832991635_100010067268 [0,2,0,0,0,0|2,0,0]=4 6086 B12R1.49 CNC(=O)Cc1ccc(nc1)Br 240690a_100102657272_100010067268 [0,2,0,0,0,0|2,0,0]=4 6087 B12R1.49 CNC(=O)Cc1ccc(nc1)Br 527a_100102657272_100010067268 [0,2,0,0,0,0|2,0,0]=4 6088 B12R1.49 CNC(=O)Cc1ccc(nc1)C 11a_106832991635_100000740413 [0,2,0,0,0,0|2,0,0]=4 6089 B12R1.49 CNC(=O)Cc1ccc(nc1)C 1626a_100102657272_100000740413 [0,2,0,0,0,0|2,0,0]=4 6090 B12R1.49 CNC(=O)Cc1ccc(nc1)C 240690a_100102657272_100000740413 [0,2,0,0,0,0|2,0,0]=4 6091 B12R1.49 CNC(=O)Cc1ccc(nc1)C 527a_100102657272_100000740413 [0,2,0,0,0,0|2,0,0]=4 6092 B12R1.49 CNC(=O)Cc1ccc(nc1)Cl 11a_106832991635_100000061944 [0,2,0,0,0,0|2,0,0]=4 6093 B12R1.49 CNC(=O)Cc1ccc(nc1)Cl 1626a_100102657272_100000061944 [0,2,0,0,0,0|2,0,0]=4 6094 B12R1.49 CNC(=O)Cc1ccc(nc1)Cl 240690a_100102657272_100000061944 [0,2,0,0,0,0|2,0,0]=4 6095 B12R1.49 CNC(=O)Cc1ccc(nc1)Cl 527a_100102657272_100000061944 [0,2,0,0,0,0|2,0,0]=4 6096 B12R1.49 CNC(=O)Cn1ccc(=O)cc1 11a_106832991635_200000238563 [0,2,0,0,0,0|2,0,0]=4 6097 B12R1.49 CNC(=O)Cn1ccc(=O)cc1 1626a_100102657272_200000238563 [0,2,0,0,0,0|2,0,0]=4 6098 B12R1.49 CNC(=O)Cn1ccc(=O)cc1 240690a_100102657272_200000238563 [0,2,0,0,0,0|2,0,0]=4 6099 B12R1.49 CNC(=O)Cn1ccc(=O)cc1 527a_100102657272_200000238563 [0,2,0,0,0,0|2,0,0]=4 6100 B12R1.49 CNC(=O)Nc1ccc(cc1)Br 2430a_100000210018_100102657272 [0,2,0,0,0,0|2,0,0]=4 6101 B12R1.49 CNC(=O)Nc1ccc(cc1)C 2430a_100000124888_100102657272 [0,2,0,0,0,0|2,0,0]=4 6102 B12R1.49 CNC(=O)Nc1ccc(cc1)Cl 2430a_100000210052_100102657272 [0,2,0,0,0,0|2,0,0]=4 6103 B12R1.49 CNC(=O)Nc1ccc(cc1)F 2430a_100000185862_100102657272 [0,2,0,0,0,0|2,0,0]=4 6104 B12R1.49 CNC(=O)Nc1ccc(cc1)I 2430a_100000185761_100102657272 [0,2,0,0,0,0|2,0,0]=4 6105 B12R1.49 CNC(=O)Nc1ccc(cc1)O 2430a_100000185829_100102657272 [0,2,0,0,0,0|2,0,0]=4 6106 B12R1.49 CNC(C)Cc1ccc(cc1)Br 270004a_106832991635_100000691760 [0,2,0,0,0,0|0,0,2]=4 6107 B12R1.49 CNC(C)Cc1ccc(cc1)C 270004a_106832991635_100000751045 [0,2,0,0,0,0|0,0,2]=4 6108 B12R1.49 CNC(C)Cc1ccc(cc1)Cl 270004a_106832991635_100000747806 [0,2,0,0,0,0|0,0,2]=4 6109 B12R1.49 CNC(C)Cc1ccc(cc1)F 270004a_106832991635_100000745281 [0,2,0,0,0,0|0,0,2]=4 6110 B12R1.49 CNC(C)Cc1ccc(cc1)O 2230a_100102634573_200000210301 [0,2,0,0,0,0|0,0,2]=4 6111 B12R1.49 CNC(C)Cc1ccc(cc1)O 270004a_106832991635_100011218180 [0,2,0,0,0,0|0,0,2]=4 6112 B12R1.49 CNC(C)Cc1ccc(cc1)O 34a_100102634573_200000210301 [0,2,0,0,0,0|0,0,2]=4 6113 B12R1.49 COC(=O)Cc1ccc(cc1)O 271570a_203496583355_100000149743 [0,2,0,0,0,0|1,0,0]=3 6114 B12R1.49 COC(=O)Cc1ccc(cn1)O 271570a_203496583355_100012362609 [0,2,0,0,0,0|2,0,0]=4 6115 B12R1.49 COC(=O)Cc1ccc(nc1)O 271570a_203496583355_100000071674 [0,2,0,0,0,0|2,0,0]=4 6116 B12R1.49 COC(=O)Nc1ccc(cc1)O 271570a_203496583355_100000181880 [0,2,0,0,0,0|2,0,0]=4 6117 B12R1.49 COC(C)Cc1ccc(cc1)F 34a_100011351027_200000210301 [0,2,0,0,0,0|0,0,2]=4 6118 B12R1.49 COC(C)Cc1ccc(cc1)F 7a_100011351027_200000210301 [0,2,0,0,0,0|0,0,2]=4 6119 B12R1.49 Cc1ccc(cc1)CC(=O)CF 1458a_100000212244_100015361967 [0,2,0,0,0,0|1,0,0]=3 6120 B12R1.49 Cc1ccc(cc1)CC(=O)CO 1458a_100000210174_100000210814 [0,2,0,0,0,0|1,0,0]=3 6121 B12R1.49 Cc1ccc(cc1)CN(C)CF 269982a_100000744650_100015361967 [0,2,0,0,0,0|1,0,1]=4 6122 B12R1.49 Cc1ccc(cc1)CN(C)CF 34a_100000744650_100015361967 [0,2,0,0,0,0|1,0,1]=4 6123 B12R1.49 Cc1ccc(cc1)NC(=O)CO 22a_100000124888_100000210174 [0,2,0,0,0,0|2,0,0]=4 6124 B12R1.49 Cc1ccc(cc1)NC(=O)CO 527a_100000124888_100000210174 [0,2,0,0,0,0|2,0,0]=4 6125 B12R1.49 Cc1ccc(cn1)CC(=O)CF 1458a_100000740413_100015361967 [0,2,0,0,0,0|2,0,0]=4 6126 B12R1.49 Cc1ccc(cn1)CC(=O)CO 1458a_100000210174_100016987292 [0,2,0,0,0,0|2,0,0]=4 6127 B12R1.49 Cc1ccc(nc1)CC(=O)CF 1458a_100025705728_100015361967 [0,2,0,0,0,0|2,0,0]=4 6128 B12R1.49 Cc1ccc(nc1)CC(=O)CO 1458a_100000210174_100000691093 [0,2,0,0,0,0|2,0,0]=4 6129 B12R1.49 O=C(CF)Cc1ccc(cc1)Br 1458a_100000198978_100015361967 [0,2,0,0,0,0|1,0,0]=3 6130 B12R1.49 O=C(CF)Cc1ccc(cc1)Cl 1458a_100000211027_100015361967 [0,2,0,0,0,0|1,0,0]=3 6131 B12R1.49 O=C(CF)Cc1ccc(cc1)F 1458a_100000210951_100015361967 [0,2,0,0,0,0|1,0,0]=3 6132 B12R1.49 O=C(CF)Cc1ccc(cc1)I 1458a_100000688869_100015361967 [0,2,0,0,0,0|1,0,0]=3 6133 B12R1.49 O=C(CF)Cc1ccc(cc1)O 1458a_100000198540_100015361967 [0,2,0,0,0,0|1,0,0]=3 6134 B12R1.49 O=C(CF)Cc1ccc(cn1)Br 1458a_100020629044_100015361967 [0,2,0,0,0,0|2,0,0]=4 6135 B12R1.49 O=C(CF)Cc1ccc(cn1)Cl 1458a_100000728320_100015361967 [0,2,0,0,0,0|2,0,0]=4 6136 B12R1.49 O=C(CF)Cc1ccc(nc1)Br 1458a_100010067268_100015361967 [0,2,0,0,0,0|2,0,0]=4 6137 B12R1.49 O=C(CF)Cc1ccc(nc1)Cl 1458a_100000061944_100015361967 [0,2,0,0,0,0|2,0,0]=4 6138 B12R1.49 O=C(CF)Cn1ccc(=O)cc1 1458a_200000238563_100015361967 [0,2,0,0,0,0|2,0,0]=4 6139 B12R1.49 O=C(CO)Cc1ccc(cc1)Br 1458a_100000210174_100000189115 [0,2,0,0,0,0|1,0,0]=3 6140 B12R1.49 O=C(CO)Cc1ccc(cc1)Cl 1458a_100000210174_100000694040 [0,2,0,0,0,0|1,0,0]=3 6141 B12R1.49 O=C(CO)Cc1ccc(cc1)F 1458a_100000210174_100000198546 [0,2,0,0,0,0|1,0,0]=3 6142 B12R1.49 O=C(CO)Cc1ccc(cc1)I 1458a_100000210174_100000189116 [0,2,0,0,0,0|1,0,0]=3 6143 B12R1.49 O=C(CO)Cc1ccc(cn1)Br 1458a_100000210174_100000702658 [0,2,0,0,0,0|2,0,0]=4 6144 B12R1.49 O=C(CO)Cc1ccc(cn1)Cl 1458a_100000210174_100012066911 [0,2,0,0,0,0|2,0,0]=4 6145 B12R1.49 O=C(CO)Cc1ccc(cn1)F 1458a_100000210174_100000703193 [0,2,0,0,0,0|2,0,0]=4 6146 B12R1.49 O=C(CO)Cc1ccc(nc1)Br 1458a_100000210174_100009831999 [0,2,0,0,0,0|2,0,0]=4 6147 B12R1.49 O=C(CO)Cc1ccc(nc1)Cl 1458a_100000210174_100000735431 [0,2,0,0,0,0|2,0,0]=4 6148 B12R1.49 O=C(CO)Cc1ccc(nc1)F 1458a_100000210174_100009820150 [0,2,0,0,0,0|2,0,0]=4 6149 B12R1.49 O=C(CO)Nc1ccc(cc1)Br 22a_100000210018_100000210174 [0,2,0,0,0,0|2,0,0]=4 6150 B12R1.49 O=C(CO)Nc1ccc(cc1)Br 527a_100000210018_100000210174 [0,2,0,0,0,0|2,0,0]=4 6151 B12R1.49 O=C(CO)Nc1ccc(cc1)Cl 22a_100000210052_100000210174 [0,2,0,0,0,0|2,0,0]=4 6152 B12R1.49 O=C(CO)Nc1ccc(cc1)Cl 527a_100000210052_100000210174 [0,2,0,0,0,0|2,0,0]=4 6153 B12R1.49 O=C(CO)Nc1ccc(cc1)F 22a_100000185862_100000210174 [0,2,0,0,0,0|2,0,0]=4 6154 B12R1.49 O=C(CO)Nc1ccc(cc1)F 527a_100000185862_100000210174 [0,2,0,0,0,0|2,0,0]=4 6155 B12R1.49 O=C(CO)Nc1ccc(cc1)I 22a_100000185761_100000210174 [0,2,0,0,0,0|2,0,0]=4 6156 B12R1.49 O=C(CO)Nc1ccc(cc1)I 527a_100000185761_100000210174 [0,2,0,0,0,0|2,0,0]=4 6157 B12R1.49 O=C(CO)Nc1ccc(cc1)O 22a_100000185829_100000210174 [0,2,0,0,0,0|2,0,0]=4 6158 B12R1.106 CC(F)(F)Cc1ccc(cc1)O 271570a_203496583355_100010238340 [0,2,0,0,0,0|1,0,1]=4 6159 B12R1.106 CS(=O)(=O)Cc1ccc(cc1)O 271570a_203496583355_100009814647 [0,2,0,0,0,0|2,0,0]=4 6160 B12R1.106 C[Si](C)(C)Cc1ccc(cc1)O 271570a_203496583355_100009813299 [0,2,0,0,0,0|0,1,1]=4 6161 B12R1.233 CC(=Cc1ccc(cc1Br)Br)C 271570a_100102525489_100011484698 [0,2,0,0,0,0|0,0,2]=4 6162 B12R1.233 CC(=Cc1ccc(cc1Br)C)C 271570a_100102525489_100009813563 [0,2,0,0,0,0|0,0,2]=4 6163 B12R1.233 CC(=Cc1ccc(cc1Br)Cl)C 271570a_100102525489_100011219703 [0,2,0,0,0,0|0,0,2]=4 6164 B12R1.233 CC(=Cc1ccc(cc1Br)F)C 271570a_100102525489_100011217111 [0,2,0,0,0,0|0,0,2]=4 6165 B12R1.233 CC(=Cc1ccc(cc1Br)N)C 271570a_100102525489_100000750458 [0,2,0,0,0,0|0,0,2]=4 6166 B12R1.233 CC(=Cc1ccc(cc1Br)O)C 271570a_100102525489_100000701344 [0,2,0,0,0,0|0,0,2]=4 6167 B12R1.233 CC(=Cc1ccc(cc1C)Br)C 271570a_100102525489_100000701812 [0,2,0,0,0,0|0,0,2]=4 6168 B12R1.233 CC(=Cc1ccc(cc1C)C)C 271570a_100102525489_100011217332 [0,2,0,0,0,0|0,0,2]=4 6169 B12R1.233 CC(=Cc1ccc(cc1C)Cl)C 271570a_100102525489_100011219607 [0,2,0,0,0,0|0,0,2]=4 6170 B12R1.233 CC(=Cc1ccc(cc1C)F)C 271570a_100102525489_100011205405 [0,2,0,0,0,0|0,0,2]=4 6171 B12R1.233 CC(=Cc1ccc(cc1C)N)C 271570a_100102525489_100000210723 [0,2,0,0,0,0|0,0,2]=4 6172 B12R1.233 CC(=Cc1ccc(cc1C)O)C 271570a_100102525489_100000729255 [0,2,0,0,0,0|0,0,2]=4 6173 B12R1.233 CC(=Cc1ccc(cc1Cl)Br)C 271570a_100102525489_100011216062 [0,2,0,0,0,0|0,0,2]=4 6174 B12R1.233 CC(=Cc1ccc(cc1Cl)C)C 271570a_100102525489_100011263221 [0,2,0,0,0,0|0,0,2]=4 6175 B12R1.233 CC(=Cc1ccc(cc1Cl)Cl)C 271570a_100102525489_100000699841 [0,2,0,0,0,0|0,0,2]=4 6176 B12R1.233 CC(=Cc1ccc(cc1Cl)F)C 271570a_100102525489_100000733362 [0,2,0,0,0,0|0,0,2]=4 6177 B12R1.233 CC(=Cc1ccc(cc1Cl)N)C 271570a_100102525489_100000761885 [0,2,0,0,0,0|0,0,2]=4 6178 B12R1.233 CC(=Cc1ccc(cc1Cl)O)C 271570a_100102525489_100000047559 [0,2,0,0,0,0|0,0,2]=4 6179 B12R1.233 CC(=Cc1ccc(cc1F)Br)C 271570a_100102525489_100009814013 [0,2,0,0,0,0|0,0,2]=4 6180 B12R1.233 CC(=Cc1ccc(cc1F)C)C 271570a_100102525489_100011216119 [0,2,0,0,0,0|0,0,2]=4 6181 B12R1.233 CC(=Cc1ccc(cc1F)Cl)C 271570a_100102525489_100011216042 [0,2,0,0,0,0|0,0,2]=4 6182 B12R1.233 CC(=Cc1ccc(cc1F)F)C 271570a_100102525489_100000750030 [0,2,0,0,0,0|0,0,2]=4 6183 B12R1.233 CC(=Cc1ccc(cc1F)N)C 271570a_100102525489_100011356925 [0,2,0,0,0,0|0,0,2]=4 6184 B12R1.233 CC(=Cc1ccc(cc1F)O)C 271570a_100102525489_100000755031 [0,2,0,0,0,0|0,0,2]=4 6185 B12R1.233 CC(=Cc1ccc(cc1N)Br)C 271570a_100102525489_100000743836 [0,2,0,0,0,0|0,0,2]=4 6186 B12R1.233 CC(=Cc1ccc(cc1N)C)C 271570a_100102525489_100011216686 [0,2,0,0,0,0|0,0,2]=4 6187 B12R1.233 CC(=Cc1ccc(cc1N)Cl)C 271570a_100102525489_100000761886 [0,2,0,0,0,0|0,0,2]=4 6188 B12R1.233 CC(=Cc1ccc(cc1N)F)C 271570a_100102525489_100011218093 [0,2,0,0,0,0|0,0,2]=4 6189 B12R1.233 CC(=Cc1ccc(cc1N)N)C 271570a_100102525489_200012175722 [0,2,0,0,0,0|0,0,2]=4 6190 B12R1.233 CC(=Cc1ccc(cc1N)O)C 271570a_100102525489_100011999798 [0,2,0,0,0,0|0,0,2]=4 6191 B12R1.233 CC(=Cc1ccc(cc1O)Br)C 271570a_100102525489_100012344904 [0,2,0,0,0,0|0,0,2]=4 6192 B12R1.233 CC(=Cc1ccc(cc1O)C)C 271570a_100102525489_100012002257 [0,2,0,0,0,0|0,0,2]=4 6193 B12R1.233 CC(=Cc1ccc(cc1O)Cl)C 271570a_100102525489_100000050036 [0,2,0,0,0,0|0,0,2]=4 6194 B12R1.233 CC(=Cc1ccc(cc1O)F)C 271570a_100102525489_100000690578 [0,2,0,0,0,0|0,0,2]=4 6195 B12R1.233 CC(=Cc1ccc(cc1O)O)C 271570a_100102525489_100009813921 [0,2,0,0,0,0|0,0,2]=4 6196 B12R1.233 CC(=O)Cc1ccc(cc1Br)Br 1458a_100000070787_200012351560 [0,2,0,0,0,0|1,0,0]=3 6197 B12R1.233 CC(=O)Cc1ccc(cc1Br)Br 1458a_100010172832_200000210301 [0,2,0,0,0,0|1,0,0]=3 6198 B12R1.233 CC(=O)Cc1ccc(cc1Br)Cl 1458a_100000070787_100000755608 [0,2,0,0,0,0|1,0,0]=3 6199 B12R1.233 CC(=O)Cc1ccc(cc1Br)Cl 1458a_100000755479_200000210301 [0,2,0,0,0,0|1,0,0]=3 6200 B12R1.233 CC(=O)Cc1ccc(cc1Br)F 1458a_100000070787_100000243222 [0,2,0,0,0,0|1,0,0]=3 6201 B12R1.233 CC(=O)Cc1ccc(cc1Br)F 1458a_100000708238_200000210301 [0,2,0,0,0,0|1,0,0]=3 6202 B12R1.233 CC(=O)Cc1ccc(cc1Br)I 1458a_100000070787_100010146610 [0,2,0,0,0,0|1,0,0]=3 6203 B12R1.233 CC(=O)Cc1ccc(cc1Br)O 1458a_100010176083_200000210301 [0,2,0,0,0,0|1,0,0]=3 6204 B12R1.233 CC(=O)Cc1ccc(cc1C)Br 1458a_100000070787_100000708836 [0,2,0,0,0,0|1,0,0]=3 6205 B12R1.233 CC(=O)Cc1ccc(cc1C)Br 1458a_100000697930_200000210301 [0,2,0,0,0,0|1,0,0]=3 6206 B12R1.233 CC(=O)Cc1ccc(cc1C)C 1458a_100000070787_100011219618 [0,2,0,0,0,0|1,0,0]=3 6207 B12R1.233 CC(=O)Cc1ccc(cc1C)C 1458a_100011236500_200000210301 [0,2,0,0,0,0|1,0,0]=3 6208 B12R1.233 CC(=O)Cc1ccc(cc1C)Cl 1458a_100000070787_100012361307 [0,2,0,0,0,0|1,0,0]=3 6209 B12R1.233 CC(=O)Cc1ccc(cc1C)F 1458a_100000070787_100000700533 [0,2,0,0,0,0|1,0,0]=3 6210 B12R1.233 CC(=O)Cc1ccc(cc1C)F 1458a_100011667441_200000210301 [0,2,0,0,0,0|1,0,0]=3 6211 B12R1.233 CC(=O)Cc1ccc(cc1Cl)Br 1458a_100000070787_100011740631 [0,2,0,0,0,0|1,0,0]=3 6212 B12R1.233 CC(=O)Cc1ccc(cc1Cl)Br 1458a_100012361378_200000210301 [0,2,0,0,0,0|1,0,0]=3 6213 B12R1.233 CC(=O)Cc1ccc(cc1Cl)C 1458a_100000070787_100012349684 [0,2,0,0,0,0|1,0,0]=3 6214 B12R1.233 CC(=O)Cc1ccc(cc1Cl)Cl 1458a_100000070787_100000188473 [0,2,0,0,0,0|1,0,0]=3 6215 B12R1.233 CC(=O)Cc1ccc(cc1Cl)Cl 1458a_100000210926_200000210301 [0,2,0,0,0,0|1,0,0]=3 6216 B12R1.233 CC(=O)Cc1ccc(cc1Cl)F 1458a_100000070787_100011216360 [0,2,0,0,0,0|1,0,0]=3 6217 B12R1.233 CC(=O)Cc1ccc(cc1Cl)F 1458a_100000690284_200000210301 [0,2,0,0,0,0|1,0,0]=3 6218 B12R1.233 CC(=O)Cc1ccc(cc1F)Br 1458a_100000070787_100000211606 [0,2,0,0,0,0|1,0,0]=3 6219 B12R1.233 CC(=O)Cc1ccc(cc1F)Br 1458a_100011295475_200000210301 [0,2,0,0,0,0|1,0,0]=3 6220 B12R1.233 CC(=O)Cc1ccc(cc1F)C 1458a_100000042674_200000210301 [0,2,0,0,0,0|1,0,0]=3 6221 B12R1.233 CC(=O)Cc1ccc(cc1F)C 1458a_100000070787_100012002367 [0,2,0,0,0,0|1,0,0]=3 6222 B12R1.233 CC(=O)Cc1ccc(cc1F)Cl 1458a_100000070787_100000709361 [0,2,0,0,0,0|1,0,0]=3 6223 B12R1.233 CC(=O)Cc1ccc(cc1F)Cl 1458a_100011830378_200000210301 [0,2,0,0,0,0|1,0,0]=3 6224 B12R1.233 CC(=O)Cc1ccc(cc1F)F 1458a_100000070787_100000748237 [0,2,0,0,0,0|1,0,0]=3 6225 B12R1.233 CC(=O)Cc1ccc(cc1F)F 1458a_100000684719_200000210301 [0,2,0,0,0,0|1,0,0]=3 6226 B12R1.233 CC(=O)Cc1ccc(cc1F)I 1458a_100000070787_100010244991 [0,2,0,0,0,0|1,0,0]=3 6227 B12R1.233 CC(=O)Cc1ccc(cc1F)I 1458a_100010149628_200000210301 [0,2,0,0,0,0|1,0,0]=3 6228 B12R1.233 CC(=O)Cc1ccc(cc1F)O 1458a_100000090534_200000210301 [0,2,0,0,0,0|1,0,0]=3 6229 B12R1.233 CC(=O)Cc1ccc(cc1I)Br 1458a_100000070787_100010146615 [0,2,0,0,0,0|1,0,0]=3 6230 B12R1.233 CC(=O)Cc1ccc(cc1I)Cl 1458a_100000070787_100010254388 [0,2,0,0,0,0|1,0,0]=3 6231 B12R1.233 CC(=O)Cc1ccc(cc1I)F 1458a_100000070787_100012354799 [0,2,0,0,0,0|1,0,0]=3 6232 B12R1.233 CC(=O)Cc1ccc(cc1O)Br 1458a_100000707504_200000210301 [0,2,0,0,0,0|1,0,0]=3 6233 B12R1.233 CC(=O)Cc1ccc(nc1Br)C 1458a_100000070787_200010064658 [0,2,0,0,0,0|2,0,0]=4 6234 B12R1.233 CC(=O)Cc1ccc(nc1Cl)Cl 1458a_100000070787_100000722033 [0,2,0,0,0,0|2,0,0]=4 6235 B12R1.233 CC(=O)Cc1ccc(nc1Cl)Cl 1458a_200010067290_200000210301 [0,2,0,0,0,0|2,0,0]=4 6236 B12R1.233 CC(=O)Cc1cnc(cc1C)F 1458a_100000070787_100010382440 [0,2,0,0,0,0|2,0,0]=4 6237 B12R1.233 CC(=O)Cc1cnc(cc1Cl)Cl 1458a_100000070787_100011997056 [0,2,0,0,0,0|2,0,0]=4 6238 B12R1.233 CC(=O)Cc1ncc(cc1Br)Cl 1458a_200012351915_200000210301 [0,2,0,0,0,0|2,0,0]=4 6239 B12R1.233 CC(=O)Cc1ncc(cc1C)C 1458a_100000070787_100016990036 [0,2,0,0,0,0|2,0,0]=4 6240 B12R1.233 CC(=O)Cc1ncc(cc1F)Br 1458a_100012351917_200000210301 [0,2,0,0,0,0|2,0,0]=4 6241 B12R1.233 CC(=O)Cc1ncc(cc1F)Cl 1458a_100000070787_200009879301 [0,2,0,0,0,0|2,0,0]=4 6242 B12R1.233 CC(=O)Cn1ccc(cc1=O)C 1458a_100000721392_200000210301 [0,2,0,0,0,0|2,0,0]=4 6243 B12R1.233 CC(=O)Nc1ccc(cc1Br)Br 11a_100000211012_100015343762 [0,2,0,0,0,0|2,0,0]=4 6244 B12R1.233 CC(=O)Nc1ccc(cc1Br)Br 1626a_100000211012_100015343762 [0,2,0,0,0,0|2,0,0]=4 6245 B12R1.233 CC(=O)Nc1ccc(cc1Br)C 11a_100000210942_100015343762 [0,2,0,0,0,0|2,0,0]=4 6246 B12R1.233 CC(=O)Nc1ccc(cc1Br)C 1626a_100000210942_100015343762 [0,2,0,0,0,0|2,0,0]=4 6247 B12R1.233 CC(=O)Nc1ccc(cc1Br)Cl 11a_100000752454_100015343762 [0,2,0,0,0,0|2,0,0]=4 6248 B12R1.233 CC(=O)Nc1ccc(cc1Br)Cl 1626a_100000752454_100015343762 [0,2,0,0,0,0|2,0,0]=4 6249 B12R1.233 CC(=O)Nc1ccc(cc1Br)F 11a_100000738039_100015343762 [0,2,0,0,0,0|2,0,0]=4 6250 B12R1.233 CC(=O)Nc1ccc(cc1Br)F 1626a_100000738039_100015343762 [0,2,0,0,0,0|2,0,0]=4 6251 B12R1.233 CC(=O)Nc1ccc(cc1Br)I 11a_100000750455_100015343762 [0,2,0,0,0,0|2,0,0]=4 6252 B12R1.233 CC(=O)Nc1ccc(cc1Br)I 1626a_100000750455_100015343762 [0,2,0,0,0,0|2,0,0]=4 6253 B12R1.233 CC(=O)Nc1ccc(cc1Br)O 22a_100012001276_100000070787 [0,2,0,0,0,0|2,0,0]=4 6254 B12R1.233 CC(=O)Nc1ccc(cc1Br)O 527a_100012001276_100103153847 [0,2,0,0,0,0|2,0,0]=4 6255 B12R1.233 CC(=O)Nc1ccc(cc1C)Br 11a_100000211769_100015343762 [0,2,0,0,0,0|2,0,0]=4 6256 B12R1.233 CC(=O)Nc1ccc(cc1C)Br 1626a_100000211769_100015343762 [0,2,0,0,0,0|2,0,0]=4 6257 B12R1.233 CC(=O)Nc1ccc(cc1C)Br 22a_100000211769_100000070787 [0,2,0,0,0,0|2,0,0]=4 6258 B12R1.233 CC(=O)Nc1ccc(cc1C)C 11a_100000736561_100015343762 [0,2,0,0,0,0|2,0,0]=4 6259 B12R1.233 CC(=O)Nc1ccc(cc1C)C 1626a_100000736561_100015343762 [0,2,0,0,0,0|2,0,0]=4 6260 B12R1.233 CC(=O)Nc1ccc(cc1C)C 22a_100000736561_100000070787 [0,2,0,0,0,0|2,0,0]=4 6261 B12R1.233 CC(=O)Nc1ccc(cc1C)C 527a_100000736561_100103153847 [0,2,0,0,0,0|2,0,0]=4 6262 B12R1.233 CC(=O)Nc1ccc(cc1C)Cl 11a_100000210418_100015343762 [0,2,0,0,0,0|2,0,0]=4 6263 B12R1.233 CC(=O)Nc1ccc(cc1C)Cl 1626a_100000210418_100015343762 [0,2,0,0,0,0|2,0,0]=4 6264 B12R1.233 CC(=O)Nc1ccc(cc1C)Cl 22a_100000210418_100000070787 [0,2,0,0,0,0|2,0,0]=4 6265 B12R1.233 CC(=O)Nc1ccc(cc1C)F 11a_100000211637_100015343762 [0,2,0,0,0,0|2,0,0]=4 6266 B12R1.233 CC(=O)Nc1ccc(cc1C)F 1626a_100000211637_100015343762 [0,2,0,0,0,0|2,0,0]=4 6267 B12R1.233 CC(=O)Nc1ccc(cc1C)F 22a_100000211637_100000070787 [0,2,0,0,0,0|2,0,0]=4 6268 B12R1.233 CC(=O)Nc1ccc(cc1C)F 527a_100000211637_100103153847 [0,2,0,0,0,0|2,0,0]=4 6269 B12R1.233 CC(=O)Nc1ccc(cc1C)I 11a_100000184554_100015343762 [0,2,0,0,0,0|2,0,0]=4 6270 B12R1.233 CC(=O)Nc1ccc(cc1C)I 1626a_100000184554_100015343762 [0,2,0,0,0,0|2,0,0]=4 6271 B12R1.233 CC(=O)Nc1ccc(cc1C)I 22a_100000184554_100000070787 [0,2,0,0,0,0|2,0,0]=4 6272 B12R1.233 CC(=O)Nc1ccc(cc1C)O 22a_100000756630_100000070787 [0,2,0,0,0,0|2,0,0]=4 6273 B12R1.233 CC(=O)Nc1ccc(cc1C)O 271570a_203496583355_100000152120 [0,2,0,0,0,0|2,0,0]=4 6274 B12R1.233 CC(=O)Nc1ccc(cc1C)O 527a_100000756630_100103153847 [0,2,0,0,0,0|2,0,0]=4 6275 B12R1.233 CC(=O)Nc1ccc(cc1Cl)Br 11a_100000211467_100015343762 [0,2,0,0,0,0|2,0,0]=4 6276 B12R1.233 CC(=O)Nc1ccc(cc1Cl)Br 1626a_100000211467_100015343762 [0,2,0,0,0,0|2,0,0]=4 6277 B12R1.233 CC(=O)Nc1ccc(cc1Cl)C 11a_100000210522_100015343762 [0,2,0,0,0,0|2,0,0]=4 6278 B12R1.233 CC(=O)Nc1ccc(cc1Cl)C 1626a_100000210522_100015343762 [0,2,0,0,0,0|2,0,0]=4 6279 B12R1.233 CC(=O)Nc1ccc(cc1Cl)C 22a_100000210522_100000070787 [0,2,0,0,0,0|2,0,0]=4 6280 B12R1.233 CC(=O)Nc1ccc(cc1Cl)Cl 11a_100000185861_100015343762 [0,2,0,0,0,0|2,0,0]=4 6281 B12R1.233 CC(=O)Nc1ccc(cc1Cl)Cl 1626a_100000185861_100015343762 [0,2,0,0,0,0|2,0,0]=4 6282 B12R1.233 CC(=O)Nc1ccc(cc1Cl)Cl 22a_100000185861_100000070787 [0,2,0,0,0,0|2,0,0]=4 6283 B12R1.233 CC(=O)Nc1ccc(cc1Cl)F 11a_100000212003_100015343762 [0,2,0,0,0,0|2,0,0]=4 6284 B12R1.233 CC(=O)Nc1ccc(cc1Cl)F 1626a_100000212003_100015343762 [0,2,0,0,0,0|2,0,0]=4 6285 B12R1.233 CC(=O)Nc1ccc(cc1Cl)F 22a_100000212003_100000070787 [0,2,0,0,0,0|2,0,0]=4 6286 B12R1.233 CC(=O)Nc1ccc(cc1Cl)I 11a_100011218065_100015343762 [0,2,0,0,0,0|2,0,0]=4 6287 B12R1.233 CC(=O)Nc1ccc(cc1Cl)I 1626a_100011218065_100015343762 [0,2,0,0,0,0|2,0,0]=4 6288 B12R1.233 CC(=O)Nc1ccc(cc1Cl)I 22a_100011218065_100000070787 [0,2,0,0,0,0|2,0,0]=4 6289 B12R1.233 CC(=O)Nc1ccc(cc1Cl)O 22a_100011215599_100000070787 [0,2,0,0,0,0|2,0,0]=4 6290 B12R1.233 CC(=O)Nc1ccc(cc1Cl)O 271570a_203496583355_100011273303 [0,2,0,0,0,0|2,0,0]=4 6291 B12R1.233 CC(=O)Nc1ccc(cc1Cl)O 527a_100011215599_100103153847 [0,2,0,0,0,0|2,0,0]=4 6292 B12R1.233 CC(=O)Nc1ccc(cc1F)Br 11a_100000210722_100015343762 [0,2,0,0,0,0|2,0,0]=4 6293 B12R1.233 CC(=O)Nc1ccc(cc1F)Br 1626a_100000210722_100015343762 [0,2,0,0,0,0|2,0,0]=4 6294 B12R1.233 CC(=O)Nc1ccc(cc1F)Br 22a_100000210722_100000070787 [0,2,0,0,0,0|2,0,0]=4 6295 B12R1.233 CC(=O)Nc1ccc(cc1F)C 11a_100000211023_100015343762 [0,2,0,0,0,0|2,0,0]=4 6296 B12R1.233 CC(=O)Nc1ccc(cc1F)C 1626a_100000211023_100015343762 [0,2,0,0,0,0|2,0,0]=4 6297 B12R1.233 CC(=O)Nc1ccc(cc1F)C 22a_100000211023_100000070787 [0,2,0,0,0,0|2,0,0]=4 6298 B12R1.233 CC(=O)Nc1ccc(cc1F)C 527a_100000211023_100103153847 [0,2,0,0,0,0|2,0,0]=4 6299 B12R1.233 CC(=O)Nc1ccc(cc1F)Cl 11a_100000211020_100015343762 [0,2,0,0,0,0|2,0,0]=4 6300 B12R1.233 CC(=O)Nc1ccc(cc1F)Cl 1626a_100000211020_100015343762 [0,2,0,0,0,0|2,0,0]=4 6301 B12R1.233 CC(=O)Nc1ccc(cc1F)Cl 22a_100000211020_100000070787 [0,2,0,0,0,0|2,0,0]=4 6302 B12R1.233 CC(=O)Nc1ccc(cc1F)F 11a_100000210720_100015343762 [0,2,0,0,0,0|2,0,0]=4 6303 B12R1.233 CC(=O)Nc1ccc(cc1F)F 1626a_100000210720_100015343762 [0,2,0,0,0,0|2,0,0]=4 6304 B12R1.233 CC(=O)Nc1ccc(cc1F)F 22a_100000210720_100000070787 [0,2,0,0,0,0|2,0,0]=4 6305 B12R1.233 CC(=O)Nc1ccc(cc1F)I 11a_100011215594_100015343762 [0,2,0,0,0,0|2,0,0]=4 6306 B12R1.233 CC(=O)Nc1ccc(cc1F)I 1626a_100011215594_100015343762 [0,2,0,0,0,0|2,0,0]=4 6307 B12R1.233 CC(=O)Nc1ccc(cc1F)I 22a_100011215594_100000070787 [0,2,0,0,0,0|2,0,0]=4 6308 B12R1.233 CC(=O)Nc1ccc(cc1F)O 22a_100000759473_100000070787 [0,2,0,0,0,0|2,0,0]=4 6309 B12R1.233 CC(=O)Nc1ccc(cc1F)O 271570a_203496583355_100000155584 [0,2,0,0,0,0|2,0,0]=4 6310 B12R1.233 CC(=O)Nc1ccc(cc1F)O 527a_100000759473_100103153847 [0,2,0,0,0,0|2,0,0]=4 6311 B12R1.233 CC(=O)Nc1ccc(cc1I)Br 11a_100000187925_100015343762 [0,2,0,0,0,0|2,0,0]=4 6312 B12R1.233 CC(=O)Nc1ccc(cc1I)Br 1626a_100000187925_100015343762 [0,2,0,0,0,0|2,0,0]=4 6313 B12R1.233 CC(=O)Nc1ccc(cc1I)C 11a_100011356834_100015343762 [0,2,0,0,0,0|2,0,0]=4 6314 B12R1.233 CC(=O)Nc1ccc(cc1I)C 1626a_100011356834_100015343762 [0,2,0,0,0,0|2,0,0]=4 6315 B12R1.233 CC(=O)Nc1ccc(cc1I)Cl 11a_100000761889_100015343762 [0,2,0,0,0,0|2,0,0]=4 6316 B12R1.233 CC(=O)Nc1ccc(cc1I)Cl 1626a_100000761889_100015343762 [0,2,0,0,0,0|2,0,0]=4 6317 B12R1.233 CC(=O)Nc1ccc(cc1I)F 11a_100000760547_100015343762 [0,2,0,0,0,0|2,0,0]=4 6318 B12R1.233 CC(=O)Nc1ccc(cc1I)F 1626a_100000760547_100015343762 [0,2,0,0,0,0|2,0,0]=4 6319 B12R1.233 CC(=O)Nc1ccc(cc1I)F 22a_100000760547_100000070787 [0,2,0,0,0,0|2,0,0]=4 6320 B12R1.233 CC(=O)Nc1ccc(cc1I)I 11a_100010002754_100015343762 [0,2,0,0,0,0|2,0,0]=4 6321 B12R1.233 CC(=O)Nc1ccc(cc1I)I 1626a_100010002754_100015343762 [0,2,0,0,0,0|2,0,0]=4 6322 B12R1.233 CC(=O)Nc1ccc(cc1I)O 22a_100010084370_100000070787 [0,2,0,0,0,0|2,0,0]=4 6323 B12R1.233 CC(=O)Nc1ccc(cc1I)O 527a_100010084370_100103153847 [0,2,0,0,0,0|2,0,0]=4 6324 B12R1.233 CC(=O)Nc1ccc(cc1N)O 271570a_203496583355_100000749274 [0,2,0,0,0,0|2,0,0]=4 6325 B12R1.233 CC(=O)Nc1ccc(cc1O)Br 22a_100000739049_100000070787 [0,2,0,0,0,0|2,0,0]=4 6326 B12R1.233 CC(=O)Nc1ccc(cc1O)Br 271570a_203496583355_100009813020 [0,2,0,0,0,0|2,0,0]=4 6327 B12R1.233 CC(=O)Nc1ccc(cc1O)Br 527a_100000739049_100103153847 [0,2,0,0,0,0|2,0,0]=4 6328 B12R1.233 CC(=O)Nc1ccc(cc1O)C 22a_100000211527_100000070787 [0,2,0,0,0,0|2,0,0]=4 6329 B12R1.233 CC(=O)Nc1ccc(cc1O)C 271570a_203496583355_100000152032 [0,2,0,0,0,0|2,0,0]=4 6330 B12R1.233 CC(=O)Nc1ccc(cc1O)C 527a_100000211527_100103153847 [0,2,0,0,0,0|2,0,0]=4 6331 B12R1.233 CC(=O)Nc1ccc(cc1O)Cl 22a_100000185728_100000070787 [0,2,0,0,0,0|2,0,0]=4 6332 B12R1.233 CC(=O)Nc1ccc(cc1O)Cl 527a_100000185728_100103153847 [0,2,0,0,0,0|2,0,0]=4 6333 B12R1.233 CC(=O)Nc1ccc(cc1O)F 22a_100000753323_100000070787 [0,2,0,0,0,0|2,0,0]=4 6334 B12R1.233 CC(=O)Nc1ccc(cc1O)F 271570a_203496583355_100011215554 [0,2,0,0,0,0|2,0,0]=4 6335 B12R1.233 CC(=O)Nc1ccc(cc1O)F 527a_100000753323_100103153847 [0,2,0,0,0,0|2,0,0]=4 6336 B12R1.233 CC(=O)Nc1ccc(cc1O)I 22a_100000057187_100000070787 [0,2,0,0,0,0|2,0,0]=4 6337 B12R1.233 CC(=O)Nc1ccc(cc1O)I 527a_100000057187_100103153847 [0,2,0,0,0,0|2,0,0]=4 6338 B12R1.233 CC(=O)Nc1ccc(cc1O)O 22a_100000106777_100000070787 [0,2,0,0,0,0|2,0,0]=4 6339 B12R1.233 CC(=O)Nc1ccc(cc1O)O 527a_100000106777_100103153847 [0,2,0,0,0,0|2,0,0]=4 6340 B12R1.233 CC(=O)Oc1ccc(cc1F)O 271570a_203496583355_100009811628 [0,2,0,0,0,0|2,0,0]=4 6341 B12R1.233 CN(C)Cc1ccc(cc1Br)Br 2230a_100102631434_200012351560 [0,2,0,0,0,0|1,0,1]=4 6342 B12R1.233 CN(C)Cc1ccc(cc1Br)Br 269982a_100102631434_200012351560 [0,2,0,0,0,0|1,0,1]=4 6343 B12R1.233 CN(C)Cc1ccc(cc1Br)Br 270004a_100102631434_100012351556 [0,2,0,0,0,0|1,0,1]=4 6344 B12R1.233 CN(C)Cc1ccc(cc1Br)Cl 2230a_100102631434_100000755608 [0,2,0,0,0,0|1,0,1]=4 6345 B12R1.233 CN(C)Cc1ccc(cc1Br)Cl 269982a_100102631434_100000755608 [0,2,0,0,0,0|1,0,1]=4 6346 B12R1.233 CN(C)Cc1ccc(cc1Br)Cl 270004a_100102631434_100000687667 [0,2,0,0,0,0|1,0,1]=4 6347 B12R1.233 CN(C)Cc1ccc(cc1Br)F 2230a_100102631434_100000243222 [0,2,0,0,0,0|1,0,1]=4 6348 B12R1.233 CN(C)Cc1ccc(cc1Br)F 2230a_200011192132_200000210301 [0,2,0,0,0,0|1,0,1]=4 6349 B12R1.233 CN(C)Cc1ccc(cc1Br)F 269982a_100102631434_100000243222 [0,2,0,0,0,0|1,0,1]=4 6350 B12R1.233 CN(C)Cc1ccc(cc1Br)F 269982a_200011192132_200000210301 [0,2,0,0,0,0|1,0,1]=4 6351 B12R1.233 CN(C)Cc1ccc(cc1Br)F 270004a_100102631434_100000685661 [0,2,0,0,0,0|1,0,1]=4 6352 B12R1.233 CN(C)Cc1ccc(cc1Br)F 34a_200011192132_200000210301 [0,2,0,0,0,0|1,0,1]=4 6353 B12R1.233 CN(C)Cc1ccc(cc1Br)I 2230a_100102631434_100010146610 [0,2,0,0,0,0|1,0,1]=4 6354 B12R1.233 CN(C)Cc1ccc(cc1Br)I 269982a_100102631434_100010146610 [0,2,0,0,0,0|1,0,1]=4 6355 B12R1.233 CN(C)Cc1ccc(cc1Cl)Br 2230a_100102631434_100011740631 [0,2,0,0,0,0|1,0,1]=4 6356 B12R1.233 CN(C)Cc1ccc(cc1Cl)Br 269982a_100102631434_100011740631 [0,2,0,0,0,0|1,0,1]=4 6357 B12R1.233 CN(C)Cc1ccc(cc1Cl)Br 270004a_100102631434_100000764164 [0,2,0,0,0,0|1,0,1]=4 6358 B12R1.233 CN(C)Cc1ccc(cc1Cl)Cl 2230a_100015189987_200000210301 [0,2,0,0,0,0|1,0,1]=4 6359 B12R1.233 CN(C)Cc1ccc(cc1Cl)Cl 2230a_100102631434_100000188473 [0,2,0,0,0,0|1,0,1]=4 6360 B12R1.233 CN(C)Cc1ccc(cc1Cl)Cl 269982a_100015189987_200000210301 [0,2,0,0,0,0|1,0,1]=4 6361 B12R1.233 CN(C)Cc1ccc(cc1Cl)Cl 269982a_100102631434_100000188473 [0,2,0,0,0,0|1,0,1]=4 6362 B12R1.233 CN(C)Cc1ccc(cc1Cl)Cl 270004a_100102631434_100000188887 [0,2,0,0,0,0|1,0,1]=4 6363 B12R1.233 CN(C)Cc1ccc(cc1Cl)Cl 34a_100015189987_200000210301 [0,2,0,0,0,0|1,0,1]=4 6364 B12R1.233 CN(C)Cc1ccc(cc1Cl)F 2230a_100102631434_100011216360 [0,2,0,0,0,0|1,0,1]=4 6365 B12R1.233 CN(C)Cc1ccc(cc1Cl)F 269982a_100102631434_100011216360 [0,2,0,0,0,0|1,0,1]=4 6366 B12R1.233 CN(C)Cc1ccc(cc1Cl)F 270004a_100102631434_100000752949 [0,2,0,0,0,0|1,0,1]=4 6367 B12R1.233 CN(C)Cc1ccc(cc1F)Br 2230a_100102631434_100000211606 [0,2,0,0,0,0|1,0,1]=4 6368 B12R1.233 CN(C)Cc1ccc(cc1F)Br 269982a_100102631434_100000211606 [0,2,0,0,0,0|1,0,1]=4 6369 B12R1.233 CN(C)Cc1ccc(cc1F)Br 270004a_100102631434_100000211676 [0,2,0,0,0,0|1,0,1]=4 6370 B12R1.233 CN(C)Cc1ccc(cc1F)Cl 2230a_100102631434_100000709361 [0,2,0,0,0,0|1,0,1]=4 6371 B12R1.233 CN(C)Cc1ccc(cc1F)Cl 269982a_100102631434_100000709361 [0,2,0,0,0,0|1,0,1]=4 6372 B12R1.233 CN(C)Cc1ccc(cc1F)Cl 270004a_100102631434_100000697372 [0,2,0,0,0,0|1,0,1]=4 6373 B12R1.233 CN(C)Cc1ccc(cc1F)F 2230a_100000207661_200000210301 [0,2,0,0,0,0|1,0,1]=4 6374 B12R1.233 CN(C)Cc1ccc(cc1F)F 2230a_100102631434_100000748237 [0,2,0,0,0,0|1,0,1]=4 6375 B12R1.233 CN(C)Cc1ccc(cc1F)F 269982a_100000207661_200000210301 [0,2,0,0,0,0|1,0,1]=4 6376 B12R1.233 CN(C)Cc1ccc(cc1F)F 269982a_100102631434_100000748237 [0,2,0,0,0,0|1,0,1]=4 6377 B12R1.233 CN(C)Cc1ccc(cc1F)F 270004a_100102631434_100000211964 [0,2,0,0,0,0|1,0,1]=4 6378 B12R1.233 CN(C)Cc1ccc(cc1F)F 34a_100000207661_200000210301 [0,2,0,0,0,0|1,0,1]=4 6379 B12R1.233 CN(C)Cc1ccc(cc1F)I 2230a_100102631434_100010244991 [0,2,0,0,0,0|1,0,1]=4 6380 B12R1.233 CN(C)Cc1ccc(cc1F)I 269982a_100102631434_100010244991 [0,2,0,0,0,0|1,0,1]=4 6381 B12R1.233 CN(C)Cc1ccc(cc1F)O 271570a_203496583355_100000174744 [0,2,0,0,0,0|1,0,1]=4 6382 B12R1.233 CN(C)Cc1ccc(cc1I)Br 2230a_100102631434_100010146615 [0,2,0,0,0,0|1,0,1]=4 6383 B12R1.233 CN(C)Cc1ccc(cc1I)Br 269982a_100102631434_100010146615 [0,2,0,0,0,0|1,0,1]=4 6384 B12R1.233 CN(C)Cc1ccc(cc1I)Br 270004a_100102631434_100010146562 [0,2,0,0,0,0|1,0,1]=4 6385 B12R1.233 CN(C)Cc1ccc(cc1I)Cl 2230a_100102631434_100010254388 [0,2,0,0,0,0|1,0,1]=4 6386 B12R1.233 CN(C)Cc1ccc(cc1I)Cl 269982a_100102631434_100010254388 [0,2,0,0,0,0|1,0,1]=4 6387 B12R1.233 CN(C)Cc1ccc(cc1I)F 2230a_100102631434_100012354799 [0,2,0,0,0,0|1,0,1]=4 6388 B12R1.233 CN(C)Cc1ccc(cc1I)F 269982a_100102631434_100012354799 [0,2,0,0,0,0|1,0,1]=4 6389 B12R1.233 CN([13CH3])Cc1ccc(cc1Br)F 2230a_200011192132_200025704644 [0,2,0,0,0,0|1,0,1]=4 6390 B12R1.233 CN([13CH3])Cc1ccc(cc1Br)F 269982a_200011192132_200025704644 [0,2,0,0,0,0|1,0,1]=4 6391 B12R1.233 CN([13CH3])Cc1ccc(cc1Br)F 34a_200011192132_200025704644 [0,2,0,0,0,0|1,0,1]=4 6392 B12R1.233 CN([13CH3])Cc1ccc(cc1Cl)Cl 2230a_100015189987_200025704644 [0,2,0,0,0,0|1,0,1]=4 6393 B12R1.233 CN([13CH3])Cc1ccc(cc1Cl)Cl 269982a_100015189987_200025704644 [0,2,0,0,0,0|1,0,1]=4 6394 B12R1.233 CN([13CH3])Cc1ccc(cc1Cl)Cl 34a_100015189987_200025704644 [0,2,0,0,0,0|1,0,1]=4 6395 B12R1.233 CN([13CH3])Cc1ccc(cc1F)F 2230a_100000207661_200025704644 [0,2,0,0,0,0|1,0,1]=4 6396 B12R1.233 CN([13CH3])Cc1ccc(cc1F)F 269982a_100000207661_200025704644 [0,2,0,0,0,0|1,0,1]=4 6397 B12R1.233 CN([13CH3])Cc1ccc(cc1F)F 34a_100000207661_200025704644 [0,2,0,0,0,0|1,0,1]=4 6398 B12R1.233 Cc1cc(ccc1CC(=O)[13CH3])Br 1458a_100000697930_200025704644 [0,2,0,0,0,0|1,0,0]=3 6399 B12R1.233 Cc1cc(ccc1CC(=O)[13CH3])F 1458a_100011667441_200025704644 [0,2,0,0,0,0|1,0,0]=3 6400 B12R1.233 Cc1cc(ccc1CN(C)C)Br 2230a_100102631434_100000708836 [0,2,0,0,0,0|1,0,1]=4 6401 B12R1.233 Cc1cc(ccc1CN(C)C)Br 269982a_100102631434_100000708836 [0,2,0,0,0,0|1,0,1]=4 6402 B12R1.233 Cc1cc(ccc1CN(C)C)Br 270004a_100102631434_100000687586 [0,2,0,0,0,0|1,0,1]=4 6403 B12R1.233 Cc1cc(ccc1CN(C)C)Cl 2230a_100102631434_100012361307 [0,2,0,0,0,0|1,0,1]=4 6404 B12R1.233 Cc1cc(ccc1CN(C)C)Cl 269982a_100102631434_100012361307 [0,2,0,0,0,0|1,0,1]=4 6405 B12R1.233 Cc1cc(ccc1CN(C)C)Cl 270004a_100102631434_100000766358 [0,2,0,0,0,0|1,0,1]=4 6406 B12R1.233 Cc1cc(ccc1CN(C)C)F 2230a_100102631434_100000700533 [0,2,0,0,0,0|1,0,1]=4 6407 B12R1.233 Cc1cc(ccc1CN(C)C)F 269982a_100102631434_100000700533 [0,2,0,0,0,0|1,0,1]=4 6408 B12R1.233 Cc1cc(ccc1CN(C)C)F 270004a_100102631434_100000745986 [0,2,0,0,0,0|1,0,1]=4 6409 B12R1.233 Cc1ccc(c(c1)Br)CN(C)C 270004a_100102631434_100000692596 [0,2,0,0,0,0|1,0,1]=4 6410 B12R1.233 Cc1ccc(c(c1)C)CC(=O)[13CH3] 1458a_100011236500_200025704644 [0,2,0,0,0,0|1,0,0]=3 6411 B12R1.233 Cc1ccc(c(c1)C)CN(C)C 2230a_100025771030_200000210301 [0,2,0,0,0,0|1,0,1]=4 6412 B12R1.233 Cc1ccc(c(c1)C)CN(C)C 2230a_100102631434_100011219618 [0,2,0,0,0,0|1,0,1]=4 6413 B12R1.233 Cc1ccc(c(c1)C)CN(C)C 269982a_100025771030_200000210301 [0,2,0,0,0,0|1,0,1]=4 6414 B12R1.233 Cc1ccc(c(c1)C)CN(C)C 269982a_100102631434_100011219618 [0,2,0,0,0,0|1,0,1]=4 6415 B12R1.233 Cc1ccc(c(c1)C)CN(C)C 270004a_100102631434_100000211342 [0,2,0,0,0,0|1,0,1]=4 6416 B12R1.233 Cc1ccc(c(c1)C)CN(C)C 34a_100025771030_200000210301 [0,2,0,0,0,0|1,0,1]=4 6417 B12R1.233 Cc1ccc(c(c1)C)CN(C)[13CH3] 2230a_100025771030_200025704644 [0,2,0,0,0,0|1,0,1]=4 6418 B12R1.233 Cc1ccc(c(c1)C)CN(C)[13CH3] 269982a_100025771030_200025704644 [0,2,0,0,0,0|1,0,1]=4 6419 B12R1.233 Cc1ccc(c(c1)C)CN(C)[13CH3] 34a_100025771030_200025704644 [0,2,0,0,0,0|1,0,1]=4 6420 B12R1.233 Cc1ccc(c(c1)Cl)CN(C)C 2230a_100102631434_100012349684 [0,2,0,0,0,0|1,0,1]=4 6421 B12R1.233 Cc1ccc(c(c1)Cl)CN(C)C 269982a_100102631434_100012349684 [0,2,0,0,0,0|1,0,1]=4 6422 B12R1.233 Cc1ccc(c(c1)Cl)CN(C)C 270004a_100102631434_100011935181 [0,2,0,0,0,0|1,0,1]=4 6423 B12R1.233 Cc1ccc(c(c1)F)CC(=O)[13CH3] 1458a_100000042674_200025704644 [0,2,0,0,0,0|1,0,0]=3 6424 B12R1.233 Cc1ccc(c(c1)F)CN(C)C 2230a_100102631434_100011217900 [0,2,0,0,0,0|1,0,1]=4 6425 B12R1.233 Cc1ccc(c(c1)F)CN(C)C 269982a_100102631434_100011217900 [0,2,0,0,0,0|1,0,1]=4 6426 B12R1.233 Cc1ccc(c(c1)F)CN(C)C 270004a_100102631434_100011217368 [0,2,0,0,0,0|1,0,1]=4 6427 B12R1.233 Cc1ccc(c(c1)I)CN(C)C 270004a_100102631434_100010150104 [0,2,0,0,0,0|1,0,1]=4 6428 B12R1.233 Cc1ccn(c(=O)c1)CC(=O)[13CH3] 1458a_100000721392_200025704644 [0,2,0,0,0,0|2,0,0]=4 6429 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1Br)Br 1458a_100010172832_200025704644 [0,2,0,0,0,0|1,0,0]=3 6430 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1Br)Cl 1458a_100000755479_200025704644 [0,2,0,0,0,0|1,0,0]=3 6431 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1Br)F 1458a_100000708238_200025704644 [0,2,0,0,0,0|1,0,0]=3 6432 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1Br)O 1458a_100010176083_200025704644 [0,2,0,0,0,0|1,0,0]=3 6433 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1Cl)Br 1458a_100012361378_200025704644 [0,2,0,0,0,0|1,0,0]=3 6434 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1Cl)Cl 1458a_100000210926_200025704644 [0,2,0,0,0,0|1,0,0]=3 6435 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1Cl)F 1458a_100000690284_200025704644 [0,2,0,0,0,0|1,0,0]=3 6436 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1F)Br 1458a_100011295475_200025704644 [0,2,0,0,0,0|1,0,0]=3 6437 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1F)Cl 1458a_100011830378_200025704644 [0,2,0,0,0,0|1,0,0]=3 6438 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1F)F 1458a_100000684719_200025704644 [0,2,0,0,0,0|1,0,0]=3 6439 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1F)I 1458a_100010149628_200025704644 [0,2,0,0,0,0|1,0,0]=3 6440 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1F)O 1458a_100000090534_200025704644 [0,2,0,0,0,0|1,0,0]=3 6441 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1O)Br 1458a_100000707504_200025704644 [0,2,0,0,0,0|1,0,0]=3 6442 B12R1.233 [13CH3]C(=O)Cc1ccc(nc1Cl)Cl 1458a_200010067290_200025704644 [0,2,0,0,0,0|2,0,0]=4 6443 B12R1.233 [13CH3]C(=O)Cc1ncc(cc1Br)Cl 1458a_200012351915_200025704644 [0,2,0,0,0,0|2,0,0]=4 6444 B12R1.233 [13CH3]C(=O)Cc1ncc(cc1F)Br 1458a_100012351917_200025704644 [0,2,0,0,0,0|2,0,0]=4 6445 B12R1.34 C#CC(=O)C(C)c1ccccc1 1458a_100000211873_100000230085 [0,2,0,0,0,0|1,0,1]=4 6446 B12R1.34 C=C(C(=O)CC)c1ccccc1 1458a_100000065200_100000210202 [0,2,0,0,0,0|1,0,1]=4 6447 B12R1.34 C=C(C(=O)CF)c1ccccc1 1458a_100000065200_100015361967 [0,2,0,0,0,0|1,0,1]=4 6448 B12R1.34 C=C(C(=O)NC)c1ccccc1 1626a_100102657272_100000065200 [0,2,0,0,0,0|1,0,1]=4 6449 B12R1.34 C=CC(=O)C(C)c1ccccc1 1458a_100000185746_100000230085 [0,2,0,0,0,0|1,0,0]=3 6450 B12R1.34 C=CC(=O)N(C)c1ccccc1 1626a_100000210012_100000185746 [0,2,0,0,0,0|2,0,0]=4 6451 B12R1.34 C=CC(=O)N(C)c1ccccc1 22a_100000210012_100000185746 [0,2,0,0,0,0|2,0,0]=4 6452 B12R1.34 C=CC(C)N(C)c1ccccc1 269982a_100000210012_100011215867 [0,2,0,0,0,0|1,0,1]=4 6453 B12R1.34 CC(C(=O)CF)c1ccccn1 1458a_100000722050_100015361967 [0,2,0,0,0,0|2,0,0]=4 6454 B12R1.34 CC(C(=O)CO)c1ccccc1 1458a_100000210174_100000230085 [0,2,0,0,0,0|1,0,0]=3 6455 B12R1.34 CC(c1ccccc1)N(C)CF 269982a_100000195388_100015361967 [0,2,0,0,0,0|1,0,1]=4 6456 B12R1.34 CCC(=O)C(C)c1ccccc1 1458a_100000210414_100000230085 [0,2,0,0,0,0|1,0,0]=3 6457 B12R1.34 CCC(=O)C(C)c1ccccn1 1458a_100000722050_100000210202 [0,2,0,0,0,0|2,0,0]=4 6458 B12R1.34 CCC(=O)C(F)c1ccccc1 1458a_100000698975_100000210202 [0,2,0,0,0,0|1,0,0]=3 6459 B12R1.34 CCC(=O)N(C)c1ccccc1 11a_100000210012_100000210414 [0,2,0,0,0,0|2,0,0]=4 6460 B12R1.34 CCC(=O)N(C)c1ccccc1 1626a_100000210012_100000210414 [0,2,0,0,0,0|2,0,0]=4 6461 B12R1.34 CCC(=O)N(C)c1ccccc1 22a_100000210012_100000210414 [0,2,0,0,0,0|2,0,0]=4 6462 B12R1.34 CCC(=O)[C@@H](C)c1ccccc1 1458a_100000751047_100000210202 [0,2,0,0,0,0|1,0,0]=3 6463 B12R1.34 CCC(=O)[C@H](O)c1ccccc1 1458a_100000684486_100000210202 [0,2,0,0,0,0|1,0,0]=3 6464 B12R1.34 CCN(C)C(C)c1ccccc1 2230a_100000195388_100000210202 [0,2,0,0,0,0|1,0,1]=4 6465 B12R1.34 CCN(C)C(C)c1ccccc1 2230a_100000225621_100000230085 [0,2,0,0,0,0|1,0,1]=4 6466 B12R1.34 CCN(C)C(C)c1ccccc1 269982a_100000195388_100000204670 [0,2,0,0,0,0|1,0,1]=4 6467 B12R1.34 CCN(C)C(C)c1ccccc1 269982a_100000225621_100000230085 [0,2,0,0,0,0|1,0,1]=4 6468 B12R1.34 CN(C(=O)CO)c1ccccc1 22a_100000210012_100000210174 [0,2,0,0,0,0|2,0,0]=4 6469 B12R1.34 CNC(=O)C(C)c1ccccn1 11a_106832991635_100000722050 [0,2,0,0,0,0|2,0,0]=4 6470 B12R1.34 CNC(=O)C(C)c1ccccn1 1626a_100102657272_100000722050 [0,2,0,0,0,0|2,0,0]=4 6471 B12R1.34 CNC(=O)C(C)c1ccccn1 240690a_100102657272_100000722050 [0,2,0,0,0,0|2,0,0]=4 6472 B12R1.34 CNC(=O)C(C)c1ccccn1 527a_100102657272_100000722050 [0,2,0,0,0,0|2,0,0]=4 6473 B12R1.34 CNC(=O)C(F)c1ccccc1 11a_106832991635_100000698975 [0,2,0,0,0,0|1,0,0]=3 6474 B12R1.34 CNC(=O)C(F)c1ccccc1 1626a_100102657272_100000698975 [0,2,0,0,0,0|1,0,0]=3 6475 B12R1.34 CNC(=O)C(F)c1ccccc1 240690a_100102657272_100000698975 [0,2,0,0,0,0|1,0,0]=3 6476 B12R1.34 CNC(=O)C(F)c1ccccc1 527a_100102657272_100000698975 [0,2,0,0,0,0|1,0,0]=3 6477 B12R1.34 CNC(=O)N(C)c1ccccc1 512a_106832991638_100000210012 [0,2,0,0,0,0|2,0,0]=4 6478 B12R1.34 CNC(=O)[C@@H](C)c1ccccc1 11a_106832991635_100000751047 [0,2,0,0,0,0|1,0,0]=3 6479 B12R1.34 CNC(=O)[C@@H](C)c1ccccc1 1626a_100102657272_100000751047 [0,2,0,0,0,0|1,0,0]=3 6480 B12R1.34 CNC(=O)[C@@H](C)c1ccccc1 240690a_100102657272_100000751047 [0,2,0,0,0,0|1,0,0]=3 6481 B12R1.34 CNC(=O)[C@@H](C)c1ccccc1 527a_100102657272_100000751047 [0,2,0,0,0,0|1,0,0]=3 6482 B12R1.34 CNC(=O)[C@H](O)c1ccccc1 240690a_100102657272_100000684486 [0,2,0,0,0,0|1,0,0]=3 6483 B12R1.34 CO[C@@H](C)[C@@H](N)c1ccccc1 34a_100134616770_200000210301 [0,2,0,0,0,0|0,0,2]=4 6484 B12R1.34 C[C@H](C(=O)CF)c1ccccc1 1458a_100000751047_100015361967 [0,2,0,0,0,0|1,0,0]=3 6485 B12R1.34 C[C@H](O[13CH3])[C@@H](N)c1ccccc1 34a_100134616770_200025704644 [0,2,0,0,0,0|0,0,2]=4 6486 B12R1.34 O=C(CF)C(F)c1ccccc1 1458a_100000698975_100015361967 [0,2,0,0,0,0|1,0,0]=3 6487 B12R1.34 O=C(CF)[C@H](O)c1ccccc1 1458a_100000684486_100015361967 [0,2,0,0,0,0|1,0,0]=3 6488 B12R1.124 CC(=C(C)c1ccccc1Br)C 271570a_200000049429_100000695589 [0,2,0,0,0,0|0,0,2]=4 6489 B12R1.124 CC(=C(C)c1ccccc1C)C 271570a_200000049429_100000210755 [0,2,0,0,0,0|0,0,2]=4 6490 B12R1.124 CC(=C(C)c1ccccc1Cl)C 271570a_200000049429_100000764095 [0,2,0,0,0,0|0,0,2]=4 6491 B12R1.124 CC(=C(C)c1ccccc1F)C 271570a_200000049429_100011215700 [0,2,0,0,0,0|0,0,2]=4 6492 B12R1.124 CC(=C(C)c1ccccc1N)C 271570a_200000049429_100000210017 [0,2,0,0,0,0|0,0,2]=4 6493 B12R1.124 CC(=C(C)c1ccccc1O)C 271570a_200000049429_100000739446 [0,2,0,0,0,0|0,0,2]=4 6494 B12R1.124 CC(=O)C(C)c1ccccc1Br 1458a_100012359601_200000210301 [0,2,0,0,0,0|1,0,0]=3 6495 B12R1.124 CC(=O)C(C)c1ccccc1Cl 1458a_100000070787_100000181259 [0,2,0,0,0,0|1,0,0]=3 6496 B12R1.124 CC(=O)C(C)c1ccccc1Cl 1458a_100011667492_200000210301 [0,2,0,0,0,0|1,0,0]=3 6497 B12R1.124 CC(=O)C(C)c1ccccc1F 1458a_100000070787_200000741388 [0,2,0,0,0,0|1,0,0]=3 6498 B12R1.124 CC(=O)C(O)c1ccccc1Br 1458a_200011356456_200000210301 [0,2,0,0,0,0|1,0,0]=3 6499 B12R1.124 CC(=O)C(O)c1ccccc1Cl 1458a_100011217820_200000210301 [0,2,0,0,0,0|1,0,0]=3 6500 B12R1.124 CC(=O)C(O)c1ccccc1F 1458a_100011219519_200000210301 [0,2,0,0,0,0|1,0,0]=3 6501 B12R1.124 CC(=O)N(C)c1ccccc1Br 11a_100020606079_100015343762 [0,2,0,0,0,0|2,0,0]=4 6502 B12R1.124 CC(=O)N(C)c1ccccc1Br 1626a_100020606079_100015343762 [0,2,0,0,0,0|2,0,0]=4 6503 B12R1.124 CC(=O)N(C)c1ccccc1C 11a_100000219699_100015343762 [0,2,0,0,0,0|2,0,0]=4 6504 B12R1.124 CC(=O)N(C)c1ccccc1C 1626a_100000219699_100015343762 [0,2,0,0,0,0|2,0,0]=4 6505 B12R1.124 CC(=O)N(C)c1ccccc1C 22a_100000219699_100000070787 [0,2,0,0,0,0|2,0,0]=4 6506 B12R1.124 CC(=O)N(C)c1ccccc1Cl 11a_100000219374_100015343762 [0,2,0,0,0,0|2,0,0]=4 6507 B12R1.124 CC(=O)N(C)c1ccccc1Cl 1626a_100000219374_100015343762 [0,2,0,0,0,0|2,0,0]=4 6508 B12R1.124 CC(=O)N(C)c1ccccc1F 11a_100000220357_100015343762 [0,2,0,0,0,0|2,0,0]=4 6509 B12R1.124 CC(=O)N(C)c1ccccc1F 1626a_100000220357_100015343762 [0,2,0,0,0,0|2,0,0]=4 6510 B12R1.124 CC(=O)N(C)c1ccccc1F 22a_100000220357_100000070787 [0,2,0,0,0,0|2,0,0]=4 6511 B12R1.124 CC(=O)N(C)c1ccccc1O 22a_100000033821_100000070787 [0,2,0,0,0,0|2,0,0]=4 6512 B12R1.124 CC(=O)N(C)c1ccccc1O 527a_100000033821_100103153847 [0,2,0,0,0,0|2,0,0]=4 6513 B12R1.124 CC(C(=O)[13CH3])c1ccccc1Br 1458a_100012359601_200025704644 [0,2,0,0,0,0|1,0,0]=3 6514 B12R1.124 CC(C(=O)[13CH3])c1ccccc1Cl 1458a_100011667492_200025704644 [0,2,0,0,0,0|1,0,0]=3 6515 B12R1.124 CC(c1ccccc1Br)N(C)C 2230a_100000692418_200000210301 [0,2,0,0,0,0|1,0,1]=4 6516 B12R1.124 CC(c1ccccc1Br)N(C)C 269982a_100000692418_200000210301 [0,2,0,0,0,0|1,0,1]=4 6517 B12R1.124 CC(c1ccccc1Br)N(C)[13CH3] 2230a_100000692418_200025704644 [0,2,0,0,0,0|1,0,1]=4 6518 B12R1.124 CC(c1ccccc1Br)N(C)[13CH3] 269982a_100000692418_200025704644 [0,2,0,0,0,0|1,0,1]=4 6519 B12R1.124 CC(c1ccccc1Cl)N(C)C 2230a_100102631434_100000181259 [0,2,0,0,0,0|1,0,1]=4 6520 B12R1.124 CC(c1ccccc1Cl)N(C)C 269982a_100102631434_100000181259 [0,2,0,0,0,0|1,0,1]=4 6521 B12R1.124 CC(c1ccccc1F)N(C)C 2230a_100000231110_200000210301 [0,2,0,0,0,0|1,0,1]=4 6522 B12R1.124 CC(c1ccccc1F)N(C)C 2230a_100102631434_200000741388 [0,2,0,0,0,0|1,0,1]=4 6523 B12R1.124 CC(c1ccccc1F)N(C)C 269982a_100000231110_200000210301 [0,2,0,0,0,0|1,0,1]=4 6524 B12R1.124 CC(c1ccccc1F)N(C)C 269982a_100102631434_200000741388 [0,2,0,0,0,0|1,0,1]=4 6525 B12R1.124 CC(c1ccccc1F)N(C)C 34a_100000231110_200000210301 [0,2,0,0,0,0|1,0,1]=4 6526 B12R1.124 CC(c1ccccc1F)N(C)[13CH3] 2230a_100000231110_200025704644 [0,2,0,0,0,0|1,0,1]=4 6527 B12R1.124 CC(c1ccccc1F)N(C)[13CH3] 269982a_100000231110_200025704644 [0,2,0,0,0,0|1,0,1]=4 6528 B12R1.124 CC(c1ccccc1F)N(C)[13CH3] 34a_100000231110_200025704644 [0,2,0,0,0,0|1,0,1]=4 6529 B12R1.124 [13CH3]C(=O)C(O)c1ccccc1Br 1458a_200011356456_200025704644 [0,2,0,0,0,0|1,0,0]=3 6530 B12R1.124 [13CH3]C(=O)C(O)c1ccccc1Cl 1458a_100011217820_200025704644 [0,2,0,0,0,0|1,0,0]=3 6531 B12R1.124 [13CH3]C(=O)C(O)c1ccccc1F 1458a_100011219519_200025704644 [0,2,0,0,0,0|1,0,0]=3 6532 B12R1.225 CC(=C(C)c1cccc(c1)Br)C 271570a_200000049429_100000691529 [0,2,0,0,0,0|0,0,2]=4 6533 B12R1.225 CC(=C(C)c1cccc(c1)C)C 271570a_200000049429_100011215228 [0,2,0,0,0,0|0,0,2]=4 6534 B12R1.225 CC(=C(C)c1cccc(c1)Cl)C 271570a_200000049429_100000699651 [0,2,0,0,0,0|0,0,2]=4 6535 B12R1.225 CC(=C(C)c1cccc(c1)F)C 271570a_200000049429_100000685547 [0,2,0,0,0,0|0,0,2]=4 6536 B12R1.225 CC(=C(C)c1cccc(c1)N)C 271570a_200000049429_100000210019 [0,2,0,0,0,0|0,0,2]=4 6537 B12R1.225 CC(=C(C)c1cccc(c1)O)C 271570a_200000049429_100000211634 [0,2,0,0,0,0|0,0,2]=4 6538 B12R1.225 CC(=C(C)c1cccc(c1)[S])C 271570a_200000049429_114929384022 [0,2,0,0,0,0|0,0,2]=4 6539 B12R1.225 CC(=O)C(C)c1cccc(c1)Br 1458a_100000722698_200000210301 [0,2,0,0,0,0|1,0,0]=3 6540 B12R1.225 CC(=O)C(C)c1cccc(c1)Cl 1458a_100000762818_200000210301 [0,2,0,0,0,0|1,0,0]=3 6541 B12R1.225 CC(=O)C(C)c1cccc(c1)F 1458a_100000762896_200000210301 [0,2,0,0,0,0|1,0,0]=3 6542 B12R1.225 CC(=O)C(O)c1cccc(c1)C 1458a_100011434945_200000210301 [0,2,0,0,0,0|1,0,0]=3 6543 B12R1.225 CC(=O)C(O)c1cccc(c1)Cl 1458a_100011216955_200000210301 [0,2,0,0,0,0|1,0,0]=3 6544 B12R1.225 CC(=O)C(O)c1cccc(c1)F 1458a_100011434943_200000210301 [0,2,0,0,0,0|1,0,0]=3 6545 B12R1.225 CC(=O)N(C)c1cccc(c1)Br 11a_100000219648_100015343762 [0,2,0,0,0,0|2,0,0]=4 6546 B12R1.225 CC(=O)N(C)c1cccc(c1)Br 1626a_100000219648_100015343762 [0,2,0,0,0,0|2,0,0]=4 6547 B12R1.225 CC(=O)N(C)c1cccc(c1)Br 22a_100000219648_100000070787 [0,2,0,0,0,0|2,0,0]=4 6548 B12R1.225 CC(=O)N(C)c1cccc(c1)Br 527a_100000219648_100103153847 [0,2,0,0,0,0|2,0,0]=4 6549 B12R1.225 CC(=O)N(C)c1cccc(c1)C 11a_100000219674_100015343762 [0,2,0,0,0,0|2,0,0]=4 6550 B12R1.225 CC(=O)N(C)c1cccc(c1)C 1626a_100000219674_100015343762 [0,2,0,0,0,0|2,0,0]=4 6551 B12R1.225 CC(=O)N(C)c1cccc(c1)C 22a_100000219674_100000070787 [0,2,0,0,0,0|2,0,0]=4 6552 B12R1.225 CC(=O)N(C)c1cccc(c1)Cl 11a_100000220044_100015343762 [0,2,0,0,0,0|2,0,0]=4 6553 B12R1.225 CC(=O)N(C)c1cccc(c1)Cl 1626a_100000220044_100015343762 [0,2,0,0,0,0|2,0,0]=4 6554 B12R1.225 CC(=O)N(C)c1cccc(c1)Cl 22a_100000220044_100000070787 [0,2,0,0,0,0|2,0,0]=4 6555 B12R1.225 CC(=O)N(C)c1cccc(c1)F 11a_100020633736_100015343762 [0,2,0,0,0,0|2,0,0]=4 6556 B12R1.225 CC(=O)N(C)c1cccc(c1)F 1626a_100020633736_100015343762 [0,2,0,0,0,0|2,0,0]=4 6557 B12R1.225 CC(=O)N(C)c1cccc(c1)F 22a_100020633736_100000070787 [0,2,0,0,0,0|2,0,0]=4 6558 B12R1.225 CC(=O)N(C)c1cccc(c1)I 11a_100000221217_100015343762 [0,2,0,0,0,0|2,0,0]=4 6559 B12R1.225 CC(=O)N(C)c1cccc(c1)I 1626a_100000221217_100015343762 [0,2,0,0,0,0|2,0,0]=4 6560 B12R1.225 CC(=O)N(C)c1cccc(c1)I 22a_100000221217_100000070787 [0,2,0,0,0,0|2,0,0]=4 6561 B12R1.225 CC(=O)N(C)c1cccc(c1)O 527a_100000756613_100103153847 [0,2,0,0,0,0|2,0,0]=4 6562 B12R1.225 CC(=O)[C@H](C)c1cccc(c1)C 1458a_200009911544_200000210301 [0,2,0,0,0,0|1,0,0]=3 6563 B12R1.225 CC(C(=O)[13CH3])c1cccc(c1)Br 1458a_100000722698_200025704644 [0,2,0,0,0,0|1,0,0]=3 6564 B12R1.225 CC(C(=O)[13CH3])c1cccc(c1)Cl 1458a_100000762818_200025704644 [0,2,0,0,0,0|1,0,0]=3 6565 B12R1.225 CC(C(=O)[13CH3])c1cccc(c1)F 1458a_100000762896_200025704644 [0,2,0,0,0,0|1,0,0]=3 6566 B12R1.225 CC(c1cccc(c1)Br)N(C)C 2230a_100025717457_200000210301 [0,2,0,0,0,0|1,0,1]=4 6567 B12R1.225 CC(c1cccc(c1)Br)N(C)C 269982a_100025717457_200000210301 [0,2,0,0,0,0|1,0,1]=4 6568 B12R1.225 CC(c1cccc(c1)Br)N(C)[13CH3] 2230a_100025717457_200025704644 [0,2,0,0,0,0|1,0,1]=4 6569 B12R1.225 CC(c1cccc(c1)Br)N(C)[13CH3] 269982a_100025717457_200025704644 [0,2,0,0,0,0|1,0,1]=4 6570 B12R1.225 CC(c1cccc(c1)F)N(C)C 2230a_100000231114_200000210301 [0,2,0,0,0,0|1,0,1]=4 6571 B12R1.225 CC(c1cccc(c1)F)N(C)C 269982a_100000231114_200000210301 [0,2,0,0,0,0|1,0,1]=4 6572 B12R1.225 CC(c1cccc(c1)F)N(C)C 34a_100000231114_200000210301 [0,2,0,0,0,0|1,0,1]=4 6573 B12R1.225 CC(c1cccc(c1)F)N(C)[13CH3] 2230a_100000231114_200025704644 [0,2,0,0,0,0|1,0,1]=4 6574 B12R1.225 CC(c1cccc(c1)F)N(C)[13CH3] 269982a_100000231114_200025704644 [0,2,0,0,0,0|1,0,1]=4 6575 B12R1.225 CC(c1cccc(c1)F)N(C)[13CH3] 34a_100000231114_200025704644 [0,2,0,0,0,0|1,0,1]=4 6576 B12R1.225 Cc1cccc(c1)C(O)C(=O)[13CH3] 1458a_100011434945_200025704644 [0,2,0,0,0,0|1,0,0]=3 6577 B12R1.225 Cc1cccc(c1)[C@@H](C)C(=O)[13CH3] 1458a_200009911544_200025704644 [0,2,0,0,0,0|1,0,0]=3 6578 B12R1.225 [13CH3]C(=O)C(O)c1cccc(c1)Cl 1458a_100011216955_200025704644 [0,2,0,0,0,0|1,0,0]=3 6579 B12R1.225 [13CH3]C(=O)C(O)c1cccc(c1)F 1458a_100011434943_200025704644 [0,2,0,0,0,0|1,0,0]=3 6580 B12R1.253 CC(=O)C(C)(C)c1ccccc1 1458a_100000070787_100000034625 [0,2,0,0,0,0|1,0,0]=3 6581 B12R1.253 CC(=O)C(C)(C)c1ccccc1 1458a_100000211857_200000210301 [0,2,0,0,0,0|1,0,0]=3 6582 B12R1.253 CC(=O)C(F)(F)c1ccccc1 1458a_100000070787_100000036403 [0,2,0,0,0,0|1,0,0]=3 6583 B12R1.253 CC(=O)[C@](C)(O)c1ccccc1 1458a_100000753667_200000210301 [0,2,0,0,0,0|1,0,0]=3 6584 B12R1.253 CC(C)(C(=O)[13CH3])c1ccccc1 1458a_100000211857_200025704644 [0,2,0,0,0,0|1,0,0]=3 6585 B12R1.253 CN(C)C(C)(C)c1ccccc1 2230a_100102631434_100000034625 [0,2,0,0,0,0|1,0,1]=4 6586 B12R1.253 CN(C)C(C)(C)c1ccccc1 269982a_100102631434_100000034625 [0,2,0,0,0,0|1,0,1]=4 6587 B12R1.253 CN(C)C(F)(F)c1ccccc1 269982a_100102631434_100000036403 [0,2,0,0,0,0|1,0,1]=4 6588 B12R1.253 C[C@](O)(C(=O)[13CH3])c1ccccc1 1458a_100000753667_200025704644 [0,2,0,0,0,0|1,0,0]=3 6589 B12R1.478 C=C(C)C(OC)c1ccccc1 34a_200011216824_200000210301 [0,2,0,0,0,0|0,0,0]=2 6590 B12R1.478 C=C(C)C(OC)c1ccccc1 7a_200011216824_200000210301 [0,2,0,0,0,0|0,0,0]=2 6591 B12R1.478 C=C(C)C(O[13CH3])c1ccccc1 34a_200011216824_200025704644 [0,2,0,0,0,0|0,0,0]=2 6592 B12R1.478 C=C(C)C(O[13CH3])c1ccccc1 7a_200011216824_200025704644 [0,2,0,0,0,0|0,0,0]=2 6593 B12R1.478 C=CC(c1ccccc1)N(C)C 2230a_100102631434_200000085779 [0,2,0,0,0,0|1,0,1]=4 6594 B12R1.478 C=CC(c1ccccc1)N(C)C 269982a_100102631434_200000085779 [0,2,0,0,0,0|1,0,1]=4 6595 B12R1.478 CC(=O)C(CO)c1ccccc1 1458a_100011218805_200000210301 [0,2,0,0,0,0|1,0,0]=3 6596 B12R1.478 CC(=O)C(S[13CH3])c1ccccc1 62a_100009888967_200025704644 [0,2,0,0,0,0|1,0,0]=3 6597 B12R1.478 CC(=O)C(S[13CH3])c1ccccc1 62a_200025704644_100009888967 [0,2,0,0,0,0|1,0,0]=3 6598 B12R1.478 CC(C)C(O[13CH3])c1ccccc1 34a_200011217822_200025704644 [0,2,0,0,0,0|0,0,2]=4 6599 B12R1.478 CC(C)C(O[13CH3])c1ccccc1 7a_200011217822_200025704644 [0,2,0,0,0,0|0,0,2]=4 6600 B12R1.478 CC(C)[C@H](N[13CH3])c1ccccc1 2230a_100015186014_200025704644 [0,2,0,0,0,0|0,0,2]=4 6601 B12R1.478 CC(C)[C@H](N[13CH3])c1ccccc1 34a_100015186014_200025704644 [0,2,0,0,0,0|0,0,2]=4 6602 B12R1.478 CCC(C(=O)C)c1ccccc1 1458a_100000211302_200000210301 [0,2,0,0,0,0|1,0,0]=3 6603 B12R1.478 CCC(C(=O)[13CH3])c1ccccc1 1458a_100000211302_200025704644 [0,2,0,0,0,0|1,0,0]=3 6604 B12R1.478 CCC(c1ccccc1)N(C)C 2230a_100000737544_200000210301 [0,2,0,0,0,0|1,0,1]=4 6605 B12R1.478 CCC(c1ccccc1)N(C)C 269982a_100000737544_200000210301 [0,2,0,0,0,0|1,0,1]=4 6606 B12R1.478 CCC(c1ccccc1)N(C)[13CH3] 2230a_100000737544_200025704644 [0,2,0,0,0,0|1,0,1]=4 6607 B12R1.478 CCC(c1ccccc1)N(C)[13CH3] 269982a_100000737544_200025704644 [0,2,0,0,0,0|1,0,1]=4 6608 B12R1.478 CCN(C(=O)C)c1ccccc1 11a_100000210013_100015343762 [0,2,0,0,0,0|2,0,0]=4 6609 B12R1.478 CCN(C(=O)C)c1ccccc1 1626a_100000210013_100015343762 [0,2,0,0,0,0|2,0,0]=4 6610 B12R1.478 CCN(C(=O)C)c1ccccc1 22a_100000210013_100000070787 [0,2,0,0,0,0|2,0,0]=4 6611 B12R1.478 CNC(C(=O)C)c1ccccc1 2230a_106832991635_100009888967 [0,2,0,0,0,0|1,0,0]=3 6612 B12R1.478 CNC(C(=O)C)c1ccccc1 7a_106832991635_100009888967 [0,2,0,0,0,0|1,0,0]=3 6613 B12R1.478 CNC(C(=O)N)c1ccccc1 2230a_106832991635_100000188848 [0,2,0,0,0,0|2,0,0]=4 6614 B12R1.478 CNC(C(=O)N)c1ccccc1 7a_106832991635_100000188848 [0,2,0,0,0,0|2,0,0]=4 6615 B12R1.478 CNC(C(=O)O)c1ccccc1 269956a_100000230147_200000210301 [0,2,0,0,0,0|2,0,0]=4 6616 B12R1.478 CN[C@@H](C(=O)N)c1ccccc1 2230a_100011423151_200000210301 [0,2,0,0,0,0|2,0,0]=4 6617 B12R1.478 CN[C@@H](c1ccccc1)[C@H](C)O 2230a_100134616770_200000210301 [0,2,0,0,0,0|1,0,1]=4 6618 B12R1.478 CN[C@H](c1ccccc1)C(C)C 2230a_100015186014_200000210301 [0,2,0,0,0,0|0,0,2]=4 6619 B12R1.478 CN[C@H](c1ccccc1)C(C)C 34a_100015186014_200000210301 [0,2,0,0,0,0|0,0,2]=4 6620 B12R1.478 COC(C(=O)N)c1ccccc1 34a_100011200849_200000210301 [0,2,0,0,0,0|2,0,0]=4 6621 B12R1.478 COC(C(=O)N)c1ccccc1 7a_100011200849_200000210301 [0,2,0,0,0,0|2,0,0]=4 6622 B12R1.478 COC(c1ccccc1)C(C)C 34a_200011217822_200000210301 [0,2,0,0,0,0|0,0,2]=4 6623 B12R1.478 COC(c1ccccc1)C(C)C 7a_200011217822_200000210301 [0,2,0,0,0,0|0,0,2]=4 6624 B12R1.478 CO[C@@H](C(=O)C)c1ccccc1 1458a_100000698336_200000210301 [0,2,0,0,0,0|1,0,0]=3 6625 B12R1.478 CO[C@@H](C(=O)[13CH3])c1ccccc1 1458a_100000698336_200025704644 [0,2,0,0,0,0|1,0,0]=3 6626 B12R1.478 CSC(C(=O)C)c1ccccc1 62a_100009888967_200000210301 [0,2,0,0,0,0|1,0,0]=3 6627 B12R1.478 CSC(C(=O)C)c1ccccc1 62a_200000210301_100009888967 [0,2,0,0,0,0|1,0,0]=3 6628 B12R1.478 CSC(C(=O)N)c1ccccc1 62a_100000188848_200000210301 [0,2,0,0,0,0|2,0,0]=4 6629 B12R1.478 CSC(C(=O)N)c1ccccc1 62a_200000210301_100000188848 [0,2,0,0,0,0|2,0,0]=4 6630 B12R1.478 C[C@H](O)[C@@H](N[13CH3])c1ccccc1 2230a_100134616770_200025704644 [0,2,0,0,0,0|1,0,1]=4 6631 B12R1.478 [13CH3]C(=O)C(CO)c1ccccc1 1458a_100011218805_200025704644 [0,2,0,0,0,0|1,0,0]=3 6632 B12R1.478 [13CH3]NC(C(=O)O)c1ccccc1 269956a_100000230147_200025704644 [0,2,0,0,0,0|2,0,0]=4 6633 B12R1.478 [13CH3]N[C@@H](C(=O)N)c1ccccc1 2230a_100011423151_200025704644 [0,2,0,0,0,0|2,0,0]=4 6634 B12R1.478 [13CH3]OC(C(=O)N)c1ccccc1 34a_100011200849_200025704644 [0,2,0,0,0,0|2,0,0]=4 6635 B12R1.478 [13CH3]OC(C(=O)N)c1ccccc1 7a_100011200849_200025704644 [0,2,0,0,0,0|2,0,0]=4 6636 B12R1.478 [13CH3]SC(C(=O)N)c1ccccc1 62a_100000188848_200025704644 [0,2,0,0,0,0|2,0,0]=4 6637 B12R1.478 [13CH3]SC(C(=O)N)c1ccccc1 62a_200025704644_100000188848 [0,2,0,0,0,0|2,0,0]=4 6638 B12R1.32 C#CCC(=O)C[n+]1ccccc1 1458a_200000086051_100000184674 [0,2,0,0,0,0|2,0,0]=4 6639 B12R1.32 C#CCC(=O)Cc1ccccc1 1458a_100011220946_100015291786 [0,2,0,0,0,0|1,0,0]=3 6640 B12R1.32 C#CCC(=O)Cc1ccccn1 1458a_100000233486_100000184674 [0,2,0,0,0,0|2,0,0]=4 6641 B12R1.32 C#CCC(=O)Cc1ccccn1 1458a_100011220946_100000721315 [0,2,0,0,0,0|2,0,0]=4 6642 B12R1.32 C#CCC(=O)Cc1cccnc1 1458a_100000737805_100000184674 [0,2,0,0,0,0|2,0,0]=4 6643 B12R1.32 C#CCC(=O)Cc1cccnc1 1458a_100011220946_100000733263 [0,2,0,0,0,0|2,0,0]=4 6644 B12R1.32 C#CCC(=O)Cc1ccncc1 1458a_100011220946_100000705612 [0,2,0,0,0,0|2,0,0]=4 6645 B12R1.32 C#CCC(=O)Nc1ccccc1 1626a_100000106764_100011220946 [0,2,0,0,0,0|2,0,0]=4 6646 B12R1.32 C#CCC(=O)Nc1ccccc1 527a_100000106764_100011220946 [0,2,0,0,0,0|2,0,0]=4 6647 B12R1.32 C#CCN(C)Cc1ccccc1 2230a_100000186898_100000038162 [0,2,0,0,0,0|1,0,1]=4 6648 B12R1.32 C#CCN(C)Cc1ccccc1 2230a_100000225692_100015291786 [0,2,0,0,0,0|1,0,1]=4 6649 B12R1.32 C#CCN(C)Cc1ccccc1 2230a_100000730907_200000210301 [0,2,0,0,0,0|1,0,1]=4 6650 B12R1.32 C#CCN(C)Cc1ccccc1 269982a_100000730907_200000210301 [0,2,0,0,0,0|1,0,1]=4 6651 B12R1.32 C#CCN(C)Cc1ccccc1 270004a_100000225692_100015611070 [0,2,0,0,0,0|1,0,1]=4 6652 B12R1.32 C#CCN(C)Cc1ccccc1 34a_100000225692_100015291786 [0,2,0,0,0,0|1,0,1]=4 6653 B12R1.32 C#CCN(C)Cc1ccccc1 34a_100000730907_200000210301 [0,2,0,0,0,0|1,0,1]=4 6654 B12R1.32 C#CCN([13CH3])Cc1ccccc1 2230a_100000730907_200025704644 [0,2,0,0,0,0|1,0,1]=4 6655 B12R1.32 C#CCN([13CH3])Cc1ccccc1 269982a_100000730907_200025704644 [0,2,0,0,0,0|1,0,1]=4 6656 B12R1.32 C#CCN([13CH3])Cc1ccccc1 34a_100000730907_200025704644 [0,2,0,0,0,0|1,0,1]=4 6657 B12R1.32 C/C(=C\c1ccccc1)/CO[13CH3] 34a_200025717232_200025704644 [0,2,0,0,0,0|0,0,2]=4 6658 B12R1.32 C/C(=C\c1ccccc1)/CO[13CH3] 7a_200025717232_200025704644 [0,2,0,0,0,0|0,0,2]=4 6659 B12R1.32 C=CCC(=O)C[n+]1ccccc1 1458a_200000086051_100000210623 [0,2,0,0,0,0|2,0,0]=4 6660 B12R1.32 C=CCC(=O)Cc1ccccc1 1458a_100000210193_100015291786 [0,2,0,0,0,0|1,0,0]=3 6661 B12R1.32 C=CCC(=O)Cc1ccccn1 1458a_100000210193_100000721315 [0,2,0,0,0,0|2,0,0]=4 6662 B12R1.32 C=CCC(=O)Cc1ccccn1 1458a_100000233486_100000210623 [0,2,0,0,0,0|2,0,0]=4 6663 B12R1.32 C=CCC(=O)Cc1cccnc1 1458a_100000210193_100000733263 [0,2,0,0,0,0|2,0,0]=4 6664 B12R1.32 C=CCC(=O)Cc1cccnc1 1458a_100000737805_100000210623 [0,2,0,0,0,0|2,0,0]=4 6665 B12R1.32 C=CCC(=O)Cc1ccncc1 1458a_100000210193_100000705612 [0,2,0,0,0,0|2,0,0]=4 6666 B12R1.32 C=CCC(=O)Nc1ccccc1 11a_100000106764_100000210193 [0,2,0,0,0,0|2,0,0]=4 6667 B12R1.32 C=CCC(=O)Nc1ccccc1 1626a_100000106764_100000210193 [0,2,0,0,0,0|2,0,0]=4 6668 B12R1.32 C=CCC(=O)Nc1ccccc1 22a_100000106764_100000210193 [0,2,0,0,0,0|2,0,0]=4 6669 B12R1.32 C=CCC(=O)Nc1ccccc1 527a_100000106764_100000210193 [0,2,0,0,0,0|2,0,0]=4 6670 B12R1.32 C=CCN(C)Cc1ccccc1 2230a_100000186898_100000210623 [0,2,0,0,0,0|1,0,0]=3 6671 B12R1.32 C=CCN(C)Cc1ccccc1 2230a_100000196212_200000210301 [0,2,0,0,0,0|1,0,0]=3 6672 B12R1.32 C=CCN(C)Cc1ccccc1 2230a_100000225617_100015291786 [0,2,0,0,0,0|1,0,0]=3 6673 B12R1.32 C=CCN(C)Cc1ccccc1 269982a_100000186898_100000210623 [0,2,0,0,0,0|1,0,0]=3 6674 B12R1.32 C=CCN(C)Cc1ccccc1 269982a_100000196212_200000210301 [0,2,0,0,0,0|1,0,0]=3 6675 B12R1.32 C=CCN(C)Cc1ccccc1 269982a_100000225617_100000211182 [0,2,0,0,0,0|1,0,0]=3 6676 B12R1.32 C=CCN(C)Cc1ccccc1 270004a_100000225617_100015611070 [0,2,0,0,0,0|1,0,0]=3 6677 B12R1.32 C=CCN(C)Cc1ccccn1 2230a_100000207498_100000210623 [0,2,0,0,0,0|2,0,0]=4 6678 B12R1.32 C=CCN(C)Cc1ccccn1 2230a_100000225617_100000721315 [0,2,0,0,0,0|2,0,0]=4 6679 B12R1.32 C=CCN(C)Cc1ccccn1 269982a_100000207498_100000210623 [0,2,0,0,0,0|2,0,0]=4 6680 B12R1.32 C=CCN(C)Cc1ccccn1 269982a_100000225617_100000721315 [0,2,0,0,0,0|2,0,0]=4 6681 B12R1.32 C=CCN(C)Cc1ccccn1 270004a_100000225617_100000209966 [0,2,0,0,0,0|2,0,0]=4 6682 B12R1.32 C=CCN(C)Cc1cccnc1 2230a_100000184577_100000210623 [0,2,0,0,0,0|2,0,0]=4 6683 B12R1.32 C=CCN(C)Cc1cccnc1 2230a_100000201331_200000210301 [0,2,0,0,0,0|2,0,0]=4 6684 B12R1.32 C=CCN(C)Cc1cccnc1 2230a_100000225617_100000741622 [0,2,0,0,0,0|2,0,0]=4 6685 B12R1.32 C=CCN(C)Cc1cccnc1 269982a_100000184577_100000210623 [0,2,0,0,0,0|2,0,0]=4 6686 B12R1.32 C=CCN(C)Cc1cccnc1 269982a_100000201331_200000210301 [0,2,0,0,0,0|2,0,0]=4 6687 B12R1.32 C=CCN(C)Cc1cccnc1 269982a_100000225617_100000733263 [0,2,0,0,0,0|2,0,0]=4 6688 B12R1.32 C=CCN(C)Cc1cccnc1 270004a_100000225617_100000209961 [0,2,0,0,0,0|2,0,0]=4 6689 B12R1.32 C=CCN(C)Cc1ccncc1 2230a_100000187231_100000210623 [0,2,0,0,0,0|2,0,0]=4 6690 B12R1.32 C=CCN(C)Cc1ccncc1 2230a_100000201359_200000210301 [0,2,0,0,0,0|2,0,0]=4 6691 B12R1.32 C=CCN(C)Cc1ccncc1 2230a_100000225617_100015193705 [0,2,0,0,0,0|2,0,0]=4 6692 B12R1.32 C=CCN(C)Cc1ccncc1 269982a_100000187231_100000210623 [0,2,0,0,0,0|2,0,0]=4 6693 B12R1.32 C=CCN(C)Cc1ccncc1 269982a_100000201359_200000210301 [0,2,0,0,0,0|2,0,0]=4 6694 B12R1.32 C=CCN(C)Cc1ccncc1 269982a_100000225617_100015193705 [0,2,0,0,0,0|2,0,0]=4 6695 B12R1.32 C=CCN([13CH3])Cc1ccccc1 2230a_100000196212_200025704644 [0,2,0,0,0,0|1,0,0]=3 6696 B12R1.32 C=CCN([13CH3])Cc1ccccc1 269982a_100000196212_200025704644 [0,2,0,0,0,0|1,0,0]=3 6697 B12R1.32 C=CCN([13CH3])Cc1cccnc1 2230a_100000201331_200025704644 [0,2,0,0,0,0|2,0,0]=4 6698 B12R1.32 C=CCN([13CH3])Cc1cccnc1 269982a_100000201331_200025704644 [0,2,0,0,0,0|2,0,0]=4 6699 B12R1.32 C=CCN([13CH3])Cc1ccncc1 2230a_100000201359_200025704644 [0,2,0,0,0,0|2,0,0]=4 6700 B12R1.32 C=CCN([13CH3])Cc1ccncc1 269982a_100000201359_200025704644 [0,2,0,0,0,0|2,0,0]=4 6701 B12R1.32 CC#CC(=O)Cc1ccccc1 1458a_100000763181_100015291786 [0,2,0,0,0,0|1,0,0]=3 6702 B12R1.32 CC#CC(=O)Cc1ccccn1 1458a_100000763181_100000721315 [0,2,0,0,0,0|2,0,0]=4 6703 B12R1.32 CC#CC(=O)Cc1cccnc1 1458a_100000763181_100000733263 [0,2,0,0,0,0|2,0,0]=4 6704 B12R1.32 CC#CC(=O)Cc1ccncc1 1458a_100000763181_100000705612 [0,2,0,0,0,0|2,0,0]=4 6705 B12R1.32 CC#CC(=O)Nc1ccccc1 22a_100000106764_100000763181 [0,2,0,0,0,0|2,0,0]=4 6706 B12R1.32 CC(CO[13CH3])Cc1ccccc1 34a_100012125295_200025704644 [0,2,0,0,0,0|0,0,2]=4 6707 B12R1.32 CC(CO[13CH3])Cc1ccccc1 7a_100012125295_200025704644 [0,2,0,0,0,0|0,0,2]=4 6708 B12R1.32 CC(Cc1ccccc1)OCF 34a_100000748627_100015361967 [0,2,0,0,0,0|0,0,2]=4 6709 B12R1.32 CC(Cc1ccccc1)OCF 7a_100000748627_100015361967 [0,2,0,0,0,0|0,0,2]=4 6710 B12R1.32 CC(Cc1ccccc1)SCF 62a_100015361967_200011218536 [0,2,0,0,0,0|0,0,2]=4 6711 B12R1.32 CC(Cc1ccccc1)SCF 62a_200011218536_100015361967 [0,2,0,0,0,0|0,0,2]=4 6712 B12R1.32 CC=CC(=O)Cc1ccccc1 1458a_100000210699_100015291786 [0,2,0,0,0,0|1,0,0]=3 6713 B12R1.32 CC=CC(=O)Cc1ccccn1 1458a_100000210699_100000721315 [0,2,0,0,0,0|2,0,0]=4 6714 B12R1.32 CC=CC(=O)Cc1cccnc1 1458a_100000210699_100000733263 [0,2,0,0,0,0|2,0,0]=4 6715 B12R1.32 CC=CC(=O)Cc1ccncc1 1458a_100000210699_100000705612 [0,2,0,0,0,0|2,0,0]=4 6716 B12R1.32 CC=CC(=O)Nc1ccccc1 11a_100000106764_100000210699 [0,2,0,0,0,0|2,0,0]=4 6717 B12R1.32 CC=CC(=O)Nc1ccccc1 1626a_100000106764_100000210699 [0,2,0,0,0,0|2,0,0]=4 6718 B12R1.32 CC=CC(=O)Nc1ccccc1 22a_100000106764_100000210699 [0,2,0,0,0,0|2,0,0]=4 6719 B12R1.32 CCCC(=O)C[n+]1ccccc1 1458a_200000086051_100000210303 [0,2,0,0,0,0|2,0,0]=4 6720 B12R1.32 CCCC(=O)Cc1ccccc1 1458a_100000211992_100015291786 [0,2,0,0,0,0|1,0,0]=3 6721 B12R1.32 CCCC(=O)Cc1ccccn1 1458a_100000211992_100000721315 [0,2,0,0,0,0|2,0,0]=4 6722 B12R1.32 CCCC(=O)Cc1ccccn1 1458a_100000233486_100000210303 [0,2,0,0,0,0|2,0,0]=4 6723 B12R1.32 CCCC(=O)Cc1cccnc1 1458a_100000211992_100000733263 [0,2,0,0,0,0|2,0,0]=4 6724 B12R1.32 CCCC(=O)Cc1cccnc1 1458a_100000737805_100000210303 [0,2,0,0,0,0|2,0,0]=4 6725 B12R1.32 CCCC(=O)Cc1ccncc1 1458a_100000211992_100000705612 [0,2,0,0,0,0|2,0,0]=4 6726 B12R1.32 CCCC(=O)Nc1ccccc1 11a_100000106764_100000211992 [0,2,0,0,0,0|2,0,0]=4 6727 B12R1.32 CCCC(=O)Nc1ccccc1 1626a_100000106764_100000211992 [0,2,0,0,0,0|2,0,0]=4 6728 B12R1.32 CCCC(=O)Nc1ccccc1 22a_100000106764_100000211992 [0,2,0,0,0,0|2,0,0]=4 6729 B12R1.32 CCCC(=O)Nc1ccccc1 527a_100000106764_100000211992 [0,2,0,0,0,0|2,0,0]=4 6730 B12R1.32 CCCN(C)Cc1ccccc1 2230a_100000184400_200000210301 [0,2,0,0,0,0|1,0,1]=4 6731 B12R1.32 CCCN(C)Cc1ccccc1 2230a_100000186898_100000210303 [0,2,0,0,0,0|1,0,1]=4 6732 B12R1.32 CCCN(C)Cc1ccccc1 2230a_100000747261_100015291786 [0,2,0,0,0,0|1,0,1]=4 6733 B12R1.32 CCCN(C)Cc1ccccc1 269982a_100000184400_200000210301 [0,2,0,0,0,0|1,0,1]=4 6734 B12R1.32 CCCN(C)Cc1ccccc1 269982a_100000186898_100000210303 [0,2,0,0,0,0|1,0,1]=4 6735 B12R1.32 CCCN(C)Cc1ccccc1 269982a_100000747261_100000211182 [0,2,0,0,0,0|1,0,1]=4 6736 B12R1.32 CCCN(C)Cc1ccccc1 270004a_100000747261_100015611070 [0,2,0,0,0,0|1,0,1]=4 6737 B12R1.32 CCCN([13CH3])Cc1ccccc1 2230a_100000184400_200025704644 [0,2,0,0,0,0|1,0,1]=4 6738 B12R1.32 CCCN([13CH3])Cc1ccccc1 269982a_100000184400_200025704644 [0,2,0,0,0,0|1,0,1]=4 6739 B12R1.32 CCNC(=O)C[n+]1ccccc1 11a_100015525214_200000086051 [0,2,0,0,0,0|2,0,0]=4 6740 B12R1.32 CCNC(=O)C[n+]1ccccc1 240690a_100015525214_200000086051 [0,2,0,0,0,0|2,0,0]=4 6741 B12R1.32 CCNC(=O)C[n+]1ccccc1 527a_100015525214_200000086051 [0,2,0,0,0,0|2,0,0]=4 6742 B12R1.32 CCNC(=O)Cc1ccccn1 11a_100015525214_100000233486 [0,2,0,0,0,0|2,0,0]=4 6743 B12R1.32 CCNC(=O)Cc1cccnc1 11a_100015525214_100000737805 [0,2,0,0,0,0|2,0,0]=4 6744 B12R1.32 CCNC(=O)Cc1cccnc1 240690a_100015525214_100000737805 [0,2,0,0,0,0|2,0,0]=4 6745 B12R1.32 CCNC(=O)Cc1cccnc1 527a_100015525214_100000737805 [0,2,0,0,0,0|2,0,0]=4 6746 B12R1.32 CCNC(=O)Cc1ccncc1 11a_100015525214_100011201483 [0,2,0,0,0,0|2,0,0]=4 6747 B12R1.32 CCNC(=O)Cc1ccncc1 240690a_100015525214_100011201483 [0,2,0,0,0,0|2,0,0]=4 6748 B12R1.32 CCNC(=O)Nc1ccccc1 2430a_100000106764_100015525214 [0,2,0,0,0,0|2,0,0]=4 6749 B12R1.32 CCOC(C)Cc1ccccc1 34a_100000748627_100000210202 [0,2,0,0,0,0|0,0,2]=4 6750 B12R1.32 CCOC(C)Cc1ccccc1 34a_100121572206_200011218536 [0,2,0,0,0,0|0,0,2]=4 6751 B12R1.32 CCOC(C)Cc1ccccc1 7a_100000748627_100000210202 [0,2,0,0,0,0|0,0,2]=4 6752 B12R1.32 CCSC(C)Cc1ccccc1 62a_100000210202_200011218536 [0,2,0,0,0,0|0,0,2]=4 6753 B12R1.32 CCSC(C)Cc1ccccc1 62a_200011218536_100000210202 [0,2,0,0,0,0|0,0,2]=4 6754 B12R1.32 CN(CC#N)Cc1ccccc1 2230a_100000186898_100011215382 [0,2,0,0,0,0|1,0,1]=4 6755 B12R1.32 CN(CC#N)Cc1ccccc1 2230a_100000743013_200000210301 [0,2,0,0,0,0|1,0,1]=4 6756 B12R1.32 CN(CC#N)Cc1ccccc1 2230a_100000748184_100015291786 [0,2,0,0,0,0|1,0,1]=4 6757 B12R1.32 CN(CC#N)Cc1ccccc1 269982a_100000186898_100011214920 [0,2,0,0,0,0|1,0,1]=4 6758 B12R1.32 CN(CC=O)Cc1ccccc1 2230a_100000186898_200015260668 [0,2,0,0,0,0|1,0,0]=3 6759 B12R1.32 CN(CC=O)Cc1ccccc1 269982a_100000186898_200015260668 [0,2,0,0,0,0|1,0,0]=3 6760 B12R1.32 CN(CC=O)Cc1ccccn1 2230a_100000207498_200015260668 [0,2,0,0,0,0|2,0,0]=4 6761 B12R1.32 CN(CC=O)Cc1ccccn1 269982a_100000207498_200015260668 [0,2,0,0,0,0|2,0,0]=4 6762 B12R1.32 CN(CC=O)Cc1cccnc1 2230a_100000184577_200015260668 [0,2,0,0,0,0|2,0,0]=4 6763 B12R1.32 CN(CC=O)Cc1cccnc1 269982a_100000184577_200015260668 [0,2,0,0,0,0|2,0,0]=4 6764 B12R1.32 CN(CC=O)Cc1ccncc1 2230a_100000187231_200015260668 [0,2,0,0,0,0|2,0,0]=4 6765 B12R1.32 CN(CC=O)Cc1ccncc1 269982a_100000187231_200015260668 [0,2,0,0,0,0|2,0,0]=4 6766 B12R1.32 CN(CCF)Cc1ccccc1 2230a_100000186898_100011217306 [0,2,0,0,0,0|1,0,1]=4 6767 B12R1.32 CN(CCF)Cc1ccccc1 269982a_100000186898_100011217306 [0,2,0,0,0,0|1,0,1]=4 6768 B12R1.32 CN(CCO)Cc1ccccc1 2230a_100000180844_200000210301 [0,2,0,0,0,0|1,0,1]=4 6769 B12R1.32 CN(CCO)Cc1ccccc1 2230a_100000186898_100000211926 [0,2,0,0,0,0|1,0,1]=4 6770 B12R1.32 CN(CCO)Cc1ccccc1 2230a_100000210263_100015291786 [0,2,0,0,0,0|1,0,1]=4 6771 B12R1.32 CN(CCO)Cc1ccccc1 269982a_100000180844_200000210301 [0,2,0,0,0,0|1,0,1]=4 6772 B12R1.32 CN(CCO)Cc1ccccc1 269982a_100000186898_100000211926 [0,2,0,0,0,0|1,0,1]=4 6773 B12R1.32 CN(CCO)Cc1ccccc1 269982a_100000210263_100000211182 [0,2,0,0,0,0|1,0,1]=4 6774 B12R1.32 CN(CCO)Cc1ccccc1 270004a_100000210263_100015611070 [0,2,0,0,0,0|1,0,1]=4 6775 B12R1.32 CNCC(=O)Cc1ccccc1 2230a_106832991635_100000233483 [0,2,0,0,0,0|1,0,0]=3 6776 B12R1.32 CNCC(=O)Cc1ccccc1 7a_106832991635_100000233483 [0,2,0,0,0,0|1,0,0]=3 6777 B12R1.32 CNCC(=O)Nc1ccccc1 2230a_106832991635_100000182850 [0,2,0,0,0,0|2,0,0]=4 6778 B12R1.32 CNCC(=O)Nc1ccccc1 34a_100102657272_100000182850 [0,2,0,0,0,0|2,0,0]=4 6779 B12R1.32 CNCC(=O)Nc1ccccc1 7a_106832991635_100000182850 [0,2,0,0,0,0|2,0,0]=4 6780 B12R1.32 CNCC(=O)Oc1ccccc1 2230a_106832991635_100009813826 [0,2,0,0,0,0|2,0,0]=4 6781 B12R1.32 CNCC(=O)Oc1ccccc1 34a_100102657272_100009813826 [0,2,0,0,0,0|2,0,0]=4 6782 B12R1.32 CNCC(=O)Oc1ccccc1 7a_106832991635_100009813826 [0,2,0,0,0,0|2,0,0]=4 6783 B12R1.32 CNCC(O)Cc1ccccc1 2230a_100000752270_200000210301 [0,2,0,0,0,0|1,0,1]=4 6784 B12R1.32 CNC[C@@H](O)Cc1ccccc1 2230a_106832991635_100000729385 [0,2,0,0,0,0|1,0,1]=4 6785 B12R1.32 CNC[C@@H](O)Cc1ccccc1 34a_100102657272_100000729385 [0,2,0,0,0,0|1,0,1]=4 6786 B12R1.32 CNC[C@@H](O)Cc1ccccc1 7a_106832991635_100000729385 [0,2,0,0,0,0|1,0,1]=4 6787 B12R1.32 CNNC(=O)C[n+]1ccccc1 22a_100016993582_200000086051 [0,2,0,0,0,0|2,0,0]=4 6788 B12R1.32 CNNC(=O)Cc1ccccn1 22a_100016993582_100000233486 [0,2,0,0,0,0|2,0,0]=4 6789 B12R1.32 CNNC(=O)Cc1cccnc1 22a_100016993582_100000737805 [0,2,0,0,0,0|2,0,0]=4 6790 B12R1.32 CNNC(=O)Cc1ccncc1 22a_100016993582_100011201483 [0,2,0,0,0,0|2,0,0]=4 6791 B12R1.32 COC/C(=C/c1ccccc1)/C 34a_200025717232_200000210301 [0,2,0,0,0,0|0,0,2]=4 6792 B12R1.32 COC/C(=C/c1ccccc1)/C 7a_200025717232_200000210301 [0,2,0,0,0,0|0,0,2]=4 6793 B12R1.32 COCC(=O)Cc1ccccc1 1458a_100000210968_100015291786 [0,2,0,0,0,0|1,0,0]=3 6794 B12R1.32 COCC(=O)Cc1ccccn1 1458a_100000210968_100000721315 [0,2,0,0,0,0|2,0,0]=4 6795 B12R1.32 COCC(=O)Cc1cccnc1 1458a_100000210968_100000733263 [0,2,0,0,0,0|2,0,0]=4 6796 B12R1.32 COCC(=O)Cc1ccncc1 1458a_100000210968_100000705612 [0,2,0,0,0,0|2,0,0]=4 6797 B12R1.32 COCC(=O)Nc1ccccc1 11a_100000106764_100000210968 [0,2,0,0,0,0|2,0,0]=4 6798 B12R1.32 COCC(=O)Nc1ccccc1 1626a_100000106764_100000210968 [0,2,0,0,0,0|2,0,0]=4 6799 B12R1.32 COCC(=O)Nc1ccccc1 22a_100000106764_100000210968 [0,2,0,0,0,0|2,0,0]=4 6800 B12R1.32 COCC(=O)Nc1ccccc1 34a_100000246334_200000210301 [0,2,0,0,0,0|2,0,0]=4 6801 B12R1.32 COCC(=O)Nc1ccccc1 34a_100138415774_100000182850 [0,2,0,0,0,0|2,0,0]=4 6802 B12R1.32 COCC(=O)Nc1ccccc1 527a_100000106764_100000210968 [0,2,0,0,0,0|2,0,0]=4 6803 B12R1.32 COCC(=O)Oc1ccccc1 34a_100138415774_100009813826 [0,2,0,0,0,0|2,0,0]=4 6804 B12R1.32 COCC(C)Cc1ccccc1 34a_100012125295_200000210301 [0,2,0,0,0,0|0,0,2]=4 6805 B12R1.32 COCC(C)Cc1ccccc1 7a_100012125295_200000210301 [0,2,0,0,0,0|0,0,2]=4 6806 B12R1.32 COCC(N)Cc1ccccc1 34a_100000739027_200000210301 [0,2,0,0,0,0|1,0,1]=4 6807 B12R1.32 COCN(C)Cc1ccccc1 2230a_100000186898_100000766300 [0,2,0,0,0,0|1,0,1]=4 6808 B12R1.32 COCN(C)Cc1ccccc1 269982a_100000186898_100000766300 [0,2,0,0,0,0|1,0,1]=4 6809 B12R1.32 COC[C@@H](O)Cc1ccccc1 34a_100138415774_100000729385 [0,2,0,0,0,0|1,0,1]=4 6810 B12R1.32 CSCC(=O)Cc1ccccc1 1458a_100000184570_100015291786 [0,2,0,0,0,0|1,0,0]=3 6811 B12R1.32 CSCC(=O)Cc1ccccc1 62a_100000233483_200000210301 [0,2,0,0,0,0|1,0,0]=3 6812 B12R1.32 CSCC(=O)Cc1ccccc1 62a_200000210301_100000233483 [0,2,0,0,0,0|1,0,0]=3 6813 B12R1.32 CSCC(=O)Cc1ccccn1 1458a_100000184570_100000721315 [0,2,0,0,0,0|2,0,0]=4 6814 B12R1.32 CSCC(=O)Cc1cccnc1 1458a_100000184570_100000733263 [0,2,0,0,0,0|2,0,0]=4 6815 B12R1.32 CSCC(=O)Cc1ccncc1 1458a_100000184570_100000705612 [0,2,0,0,0,0|2,0,0]=4 6816 B12R1.32 CSCC(=O)Nc1ccccc1 11a_100000106764_100000184570 [0,2,0,0,0,0|2,0,0]=4 6817 B12R1.32 CSCC(=O)Nc1ccccc1 1626a_100000106764_100000184570 [0,2,0,0,0,0|2,0,0]=4 6818 B12R1.32 CSCC(=O)Nc1ccccc1 22a_100000106764_100000184570 [0,2,0,0,0,0|2,0,0]=4 6819 B12R1.32 CSCC(=O)Nc1ccccc1 527a_100000106764_100000184570 [0,2,0,0,0,0|2,0,0]=4 6820 B12R1.32 CSCC(=O)Nc1ccccc1 62a_100012148978_200000210301 [0,2,0,0,0,0|2,0,0]=4 6821 B12R1.32 CSCC(=O)Nc1ccccc1 62a_200000210301_100000182850 [0,2,0,0,0,0|2,0,0]=4 6822 B12R1.32 CSCC(=O)Oc1ccccc1 62a_100009813826_200000210301 [0,2,0,0,0,0|2,0,0]=4 6823 B12R1.32 CSCC(=O)Oc1ccccc1 62a_200000210301_100009813826 [0,2,0,0,0,0|2,0,0]=4 6824 B12R1.32 CSCN(C)Cc1ccccc1 2230a_100000186898_100011218213 [0,2,0,0,0,0|1,0,1]=4 6825 B12R1.32 CSCN(C)Cc1ccccc1 269982a_100000186898_100011218213 [0,2,0,0,0,0|1,0,1]=4 6826 B12R1.32 CSC[C@@H](O)Cc1ccccc1 62a_100000729385_200000210301 [0,2,0,0,0,0|1,0,1]=4 6827 B12R1.32 CSC[C@@H](O)Cc1ccccc1 62a_200000210301_100000729385 [0,2,0,0,0,0|1,0,1]=4 6828 B12R1.32 N#CCC(=O)C[n+]1ccccc1 1458a_200000086051_100011214920 [0,2,0,0,0,0|2,0,0]=4 6829 B12R1.32 N#CCC(=O)Cc1ccccc1 1458a_100051588842_100015291786 [0,2,0,0,0,0|1,0,0]=3 6830 B12R1.32 N#CCC(=O)Cc1ccccn1 1458a_100000233486_100011214920 [0,2,0,0,0,0|2,0,0]=4 6831 B12R1.32 N#CCC(=O)Cc1ccccn1 1458a_100051588842_100000721315 [0,2,0,0,0,0|2,0,0]=4 6832 B12R1.32 N#CCC(=O)Cc1cccnc1 1458a_100000737805_100011214920 [0,2,0,0,0,0|2,0,0]=4 6833 B12R1.32 N#CCC(=O)Cc1cccnc1 1458a_100051588842_100000733263 [0,2,0,0,0,0|2,0,0]=4 6834 B12R1.32 N#CCC(=O)Cc1ccncc1 1458a_100051588842_100000705612 [0,2,0,0,0,0|2,0,0]=4 6835 B12R1.32 N#CCC(=O)Nc1ccccc1 1626a_100000106764_100051588842 [0,2,0,0,0,0|2,0,0]=4 6836 B12R1.32 N#CCC(=O)Nc1ccccc1 22a_100000106764_100051588842 [0,2,0,0,0,0|2,0,0]=4 6837 B12R1.32 O=C(C=CBr)Cc1ccccc1 1458a_100016273825_100015291786 [0,2,0,0,0,0|1,0,0]=3 6838 B12R1.32 O=C(C=CBr)Cc1ccccn1 1458a_100016273825_100000721315 [0,2,0,0,0,0|2,0,0]=4 6839 B12R1.32 O=C(C=CBr)Cc1cccnc1 1458a_100016273825_100000733263 [0,2,0,0,0,0|2,0,0]=4 6840 B12R1.32 O=C(C=CBr)Cc1ccncc1 1458a_100016273825_100000705612 [0,2,0,0,0,0|2,0,0]=4 6841 B12R1.32 O=C(C=CBr)Nc1ccccc1 1626a_100000106764_100016273825 [0,2,0,0,0,0|2,0,0]=4 6842 B12R1.32 O=C(C=CCl)Cc1ccccc1 1458a_200016279998_100015291786 [0,2,0,0,0,0|1,0,0]=3 6843 B12R1.32 O=C(C=CCl)Cc1ccccn1 1458a_200016279998_100000721315 [0,2,0,0,0,0|2,0,0]=4 6844 B12R1.32 O=C(C=CCl)Cc1cccnc1 1458a_200016279998_100000733263 [0,2,0,0,0,0|2,0,0]=4 6845 B12R1.32 O=C(C=CCl)Cc1ccncc1 1458a_200016279998_100000705612 [0,2,0,0,0,0|2,0,0]=4 6846 B12R1.32 O=C(C=CCl)Nc1ccccc1 11a_100000106764_200016279998 [0,2,0,0,0,0|2,0,0]=4 6847 B12R1.32 O=C(C=CCl)Nc1ccccc1 1626a_100000106764_200016279998 [0,2,0,0,0,0|2,0,0]=4 6848 B12R1.32 O=C(C=CI)Cc1ccccc1 1458a_100016256311_100015291786 [0,2,0,0,0,0|1,0,0]=3 6849 B12R1.32 O=C(C=CI)Cc1ccccn1 1458a_100016256311_100000721315 [0,2,0,0,0,0|2,0,0]=4 6850 B12R1.32 O=C(C=CI)Cc1cccnc1 1458a_100016256311_100000733263 [0,2,0,0,0,0|2,0,0]=4 6851 B12R1.32 O=C(C=CI)Cc1ccncc1 1458a_100016256311_100000705612 [0,2,0,0,0,0|2,0,0]=4 6852 B12R1.32 O=C(C=CI)Nc1ccccc1 1626a_100000106764_100016256311 [0,2,0,0,0,0|2,0,0]=4 6853 B12R1.32 O=C(CCF)C[n+]1ccccc1 1458a_200000086051_100011217306 [0,2,0,0,0,0|2,0,0]=4 6854 B12R1.32 O=C(CCF)Cc1ccccn1 1458a_100000233486_100011217306 [0,2,0,0,0,0|2,0,0]=4 6855 B12R1.32 O=C(CCF)Cc1cccnc1 1458a_100000737805_100011217306 [0,2,0,0,0,0|2,0,0]=4 6856 B12R1.32 O=C(CCO)C[n+]1ccccc1 1458a_200000086051_100000211926 [0,2,0,0,0,0|2,0,0]=4 6857 B12R1.32 O=C(CCO)Cc1ccccc1 1458a_100011216618_100015291786 [0,2,0,0,0,0|1,0,0]=3 6858 B12R1.32 O=C(CCO)Cc1ccccn1 1458a_100000233486_100000211926 [0,2,0,0,0,0|2,0,0]=4 6859 B12R1.32 O=C(CCO)Cc1ccccn1 1458a_100011216618_100000721315 [0,2,0,0,0,0|2,0,0]=4 6860 B12R1.32 O=C(CCO)Cc1cccnc1 1458a_100000737805_100000211926 [0,2,0,0,0,0|2,0,0]=4 6861 B12R1.32 O=C(CCO)Cc1cccnc1 1458a_100011216618_100000733263 [0,2,0,0,0,0|2,0,0]=4 6862 B12R1.32 O=C(CCO)Cc1ccncc1 1458a_100011216618_100000705612 [0,2,0,0,0,0|2,0,0]=4 6863 B12R1.32 O=C(CCO)Nc1ccccc1 22a_100000106764_100011216618 [0,2,0,0,0,0|2,0,0]=4 6864 B12R1.32 [13CH3]N(CC#N)Cc1ccccc1 2230a_100000743013_200025704644 [0,2,0,0,0,0|1,0,1]=4 6865 B12R1.32 [13CH3]N(CCO)Cc1ccccc1 2230a_100000180844_200025704644 [0,2,0,0,0,0|1,0,1]=4 6866 B12R1.32 [13CH3]N(CCO)Cc1ccccc1 269982a_100000180844_200025704644 [0,2,0,0,0,0|1,0,1]=4 6867 B12R1.32 [13CH3]NCC(O)Cc1ccccc1 2230a_100000752270_200025704644 [0,2,0,0,0,0|1,0,1]=4 6868 B12R1.32 [13CH3]OCC(=O)Nc1ccccc1 34a_100000246334_200025704644 [0,2,0,0,0,0|2,0,0]=4 6869 B12R1.32 [13CH3]OCC(N)Cc1ccccc1 34a_100000739027_200025704644 [0,2,0,0,0,0|1,0,1]=4 6870 B12R1.32 [13CH3]SCC(=O)Cc1ccccc1 62a_100000233483_200025704644 [0,2,0,0,0,0|1,0,0]=3 6871 B12R1.32 [13CH3]SCC(=O)Cc1ccccc1 62a_200025704644_100000233483 [0,2,0,0,0,0|1,0,0]=3 6872 B12R1.32 [13CH3]SCC(=O)Nc1ccccc1 62a_100012148978_200025704644 [0,2,0,0,0,0|2,0,0]=4 6873 B12R1.32 [13CH3]SCC(=O)Nc1ccccc1 62a_200025704644_100000182850 [0,2,0,0,0,0|2,0,0]=4 6874 B12R1.32 [13CH3]SCC(=O)Oc1ccccc1 62a_100009813826_200025704644 [0,2,0,0,0,0|2,0,0]=4 6875 B12R1.32 [13CH3]SCC(=O)Oc1ccccc1 62a_200025704644_100009813826 [0,2,0,0,0,0|2,0,0]=4 6876 B12R1.32 [13CH3]SC[C@@H](O)Cc1ccccc1 62a_100000729385_200025704644 [0,2,0,0,0,0|1,0,1]=4 6877 B12R1.32 [13CH3]SC[C@@H](O)Cc1ccccc1 62a_200025704644_100000729385 [0,2,0,0,0,0|1,0,1]=4 6878 B12R1.50 C#CC(=O)Cc1cccc(c1)Br 1458a_100000211873_100000211773 [0,2,0,0,0,0|1,0,1]=4 6879 B12R1.50 C#CC(=O)Cc1cccc(c1)C 1458a_100000211873_100000211840 [0,2,0,0,0,0|1,0,1]=4 6880 B12R1.50 C#CC(=O)Cc1cccc(c1)Cl 1458a_100000211873_100000181238 [0,2,0,0,0,0|1,0,1]=4 6881 B12R1.50 C#CC(=O)Cc1cccc(c1)F 1458a_100000211873_100000230114 [0,2,0,0,0,0|1,0,1]=4 6882 B12R1.50 C#CC(=O)Cc1cccc(c1)I 1458a_100000211873_100011218688 [0,2,0,0,0,0|1,0,1]=4 6883 B12R1.50 C#CC(=O)Cc1cccc(c1)O 1458a_100000211873_100011660834 [0,2,0,0,0,0|1,0,1]=4 6884 B12R1.50 C=CC(=O)Cc1cc(ccn1)Br 1458a_100000185746_100010173614 [0,2,0,0,0,0|2,0,0]=4 6885 B12R1.50 C=CC(=O)Cc1cc(ccn1)C 1458a_100000185746_100000718516 [0,2,0,0,0,0|2,0,0]=4 6886 B12R1.50 C=CC(=O)Cc1cc(ccn1)Cl 1458a_100000185746_100016988179 [0,2,0,0,0,0|2,0,0]=4 6887 B12R1.50 C=CC(=O)Cc1cccc(c1)Br 1458a_100000185746_100000211773 [0,2,0,0,0,0|1,0,0]=3 6888 B12R1.50 C=CC(=O)Cc1cccc(c1)C 1458a_100000185746_100000211840 [0,2,0,0,0,0|1,0,0]=3 6889 B12R1.50 C=CC(=O)Cc1cccc(c1)Cl 1458a_100000185746_100000181238 [0,2,0,0,0,0|1,0,0]=3 6890 B12R1.50 C=CC(=O)Cc1cccc(c1)F 1458a_100000185746_100000230114 [0,2,0,0,0,0|1,0,0]=3 6891 B12R1.50 C=CC(=O)Cc1cccc(c1)I 1458a_100000185746_100011218688 [0,2,0,0,0,0|1,0,0]=3 6892 B12R1.50 C=CC(=O)Cc1cccc(c1)O 1458a_100000185746_100011660834 [0,2,0,0,0,0|1,0,0]=3 6893 B12R1.50 C=CC(=O)Cc1cccc(n1)Br 1458a_100000185746_100009889011 [0,2,0,0,0,0|2,0,0]=4 6894 B12R1.50 C=CC(=O)Cc1cccc(n1)C 1458a_100000185746_100000757606 [0,2,0,0,0,0|2,0,0]=4 6895 B12R1.50 C=CC(=O)Cc1cccc(n1)Cl 1458a_100000185746_100000086093 [0,2,0,0,0,0|2,0,0]=4 6896 B12R1.50 C=CC(=O)Cc1cccc(n1)F 1458a_100000185746_100009819644 [0,2,0,0,0,0|2,0,0]=4 6897 B12R1.50 C=CC(=O)Cc1ccnc(c1)Br 1458a_100000185746_100010243470 [0,2,0,0,0,0|2,0,0]=4 6898 B12R1.50 C=CC(=O)Cc1ccnc(c1)C 1458a_100000185746_200020672517 [0,2,0,0,0,0|2,0,0]=4 6899 B12R1.50 C=CC(=O)Cc1ccnc(c1)Cl 1458a_100000185746_100000764220 [0,2,0,0,0,0|2,0,0]=4 6900 B12R1.50 C=CC(=O)Cc1cncc(c1)Br 1458a_100000185746_100011740620 [0,2,0,0,0,0|2,0,0]=4 6901 B12R1.50 C=CC(=O)Cc1cncc(c1)C 1458a_100000185746_100000716715 [0,2,0,0,0,0|2,0,0]=4 6902 B12R1.50 C=CC(=O)Cc1cncc(c1)Cl 1458a_100000185746_100016992070 [0,2,0,0,0,0|2,0,0]=4 6903 B12R1.50 C=CC(=O)Cc1cncc(c1)F 1458a_100000185746_100000725299 [0,2,0,0,0,0|2,0,0]=4 6904 B12R1.50 C=CC(=O)Nc1cccc(c1)Br 1626a_100000210019_100000185746 [0,2,0,0,0,0|2,0,0]=4 6905 B12R1.50 C=CC(=O)Nc1cccc(c1)Br 22a_100000210019_100000185746 [0,2,0,0,0,0|2,0,0]=4 6906 B12R1.50 C=CC(=O)Nc1cccc(c1)C 1626a_100000188690_100000185746 [0,2,0,0,0,0|2,0,0]=4 6907 B12R1.50 C=CC(=O)Nc1cccc(c1)C 22a_100000188690_100000185746 [0,2,0,0,0,0|2,0,0]=4 6908 B12R1.50 C=CC(=O)Nc1cccc(c1)Cl 1626a_100000185859_100000185746 [0,2,0,0,0,0|2,0,0]=4 6909 B12R1.50 C=CC(=O)Nc1cccc(c1)Cl 22a_100000185859_100000185746 [0,2,0,0,0,0|2,0,0]=4 6910 B12R1.50 C=CC(=O)Nc1cccc(c1)F 1626a_100000210047_100000185746 [0,2,0,0,0,0|2,0,0]=4 6911 B12R1.50 C=CC(=O)Nc1cccc(c1)F 22a_100000210047_100000185746 [0,2,0,0,0,0|2,0,0]=4 6912 B12R1.50 C=CC(=O)Nc1cccc(c1)I 1626a_100000211102_100000185746 [0,2,0,0,0,0|2,0,0]=4 6913 B12R1.50 C=CC(=O)Nc1cccc(c1)I 22a_100000211102_100000185746 [0,2,0,0,0,0|2,0,0]=4 6914 B12R1.50 C=CC(=O)Nc1cccc(c1)O 1626a_100000210217_100000185746 [0,2,0,0,0,0|2,0,0]=4 6915 B12R1.50 C=CC(=O)Nc1cccc(c1)O 22a_100000210217_100000185746 [0,2,0,0,0,0|2,0,0]=4 6916 B12R1.50 C=CC(C)Sc1cccc(c1)Br 62a_100011215867_100000691529 [0,2,0,0,0,0|1,0,1]=4 6917 B12R1.50 C=CC(C)Sc1cccc(c1)C 62a_100011215867_100011215228 [0,2,0,0,0,0|1,0,1]=4 6918 B12R1.50 C=CC(C)Sc1cccc(c1)Cl 62a_100011215867_100000699651 [0,2,0,0,0,0|1,0,1]=4 6919 B12R1.50 C=CC(C)Sc1cccc(c1)F 62a_100011215867_100000685547 [0,2,0,0,0,0|1,0,1]=4 6920 B12R1.50 C=CC(C)Sc1cccc(c1)N 62a_100011215867_100000210019 [0,2,0,0,0,0|1,0,1]=4 6921 B12R1.50 C=CC(C)Sc1cccc(c1)O 62a_100011215867_100000211634 [0,2,0,0,0,0|1,0,1]=4 6922 B12R1.50 C=CC(C)Sc1cccc(c1)[S] 62a_100011215867_114929384022 [0,2,0,0,0,0|1,0,1]=4 6923 B12R1.50 CC(=Cc1cccc(c1)Br)C#N 6a_100000210085_200000212204 [0,2,0,0,0,0|0,0,2]=4 6924 B12R1.50 CC(=Cc1cccc(c1)F)C#N 6a_100000210812_200000212204 [0,2,0,0,0,0|0,0,2]=4 6925 B12R1.50 CC(=Cc1cccc(c1)I)C#N 6a_100000014684_200000212204 [0,2,0,0,0,0|0,0,2]=4 6926 B12R1.50 CCC(=O)Cc1cc(ccn1)Br 1458a_100000210414_100010173614 [0,2,0,0,0,0|2,0,0]=4 6927 B12R1.50 CCC(=O)Cc1cc(ccn1)C 1458a_100000210414_100000718516 [0,2,0,0,0,0|2,0,0]=4 6928 B12R1.50 CCC(=O)Cc1cc(ccn1)Cl 1458a_100000210414_100016988179 [0,2,0,0,0,0|2,0,0]=4 6929 B12R1.50 CCC(=O)Cc1cccc(c1)Br 1458a_100000210414_100000211773 [0,2,0,0,0,0|1,0,0]=3 6930 B12R1.50 CCC(=O)Cc1cccc(c1)Br 1458a_100000747190_100000210202 [0,2,0,0,0,0|1,0,0]=3 6931 B12R1.50 CCC(=O)Cc1cccc(c1)C 1458a_100000210414_100000211840 [0,2,0,0,0,0|1,0,0]=3 6932 B12R1.50 CCC(=O)Cc1cccc(c1)C 1458a_100011206899_100000210202 [0,2,0,0,0,0|1,0,0]=3 6933 B12R1.50 CCC(=O)Cc1cccc(c1)Cl 1458a_100000210414_100000181238 [0,2,0,0,0,0|1,0,0]=3 6934 B12R1.50 CCC(=O)Cc1cccc(c1)Cl 1458a_100000749307_100000210202 [0,2,0,0,0,0|1,0,0]=3 6935 B12R1.50 CCC(=O)Cc1cccc(c1)F 1458a_100000210414_100000230114 [0,2,0,0,0,0|1,0,0]=3 6936 B12R1.50 CCC(=O)Cc1cccc(c1)F 1458a_100000211661_100000210202 [0,2,0,0,0,0|1,0,0]=3 6937 B12R1.50 CCC(=O)Cc1cccc(c1)I 1458a_100000210414_100011218688 [0,2,0,0,0,0|1,0,0]=3 6938 B12R1.50 CCC(=O)Cc1cccc(c1)I 1458a_100000238430_100000210202 [0,2,0,0,0,0|1,0,0]=3 6939 B12R1.50 CCC(=O)Cc1cccc(c1)O 1458a_100000210414_100011660834 [0,2,0,0,0,0|1,0,0]=3 6940 B12R1.50 CCC(=O)Cc1cccc(c1)O 1458a_100000745134_100000210202 [0,2,0,0,0,0|1,0,0]=3 6941 B12R1.50 CCC(=O)Cc1cccc(n1)Br 1458a_100000210414_100009889011 [0,2,0,0,0,0|2,0,0]=4 6942 B12R1.50 CCC(=O)Cc1cccc(n1)Br 1458a_100010201708_100000210202 [0,2,0,0,0,0|2,0,0]=4 6943 B12R1.50 CCC(=O)Cc1cccc(n1)C 1458a_100000210414_100000757606 [0,2,0,0,0,0|2,0,0]=4 6944 B12R1.50 CCC(=O)Cc1cccc(n1)C 1458a_100012001110_100000210202 [0,2,0,0,0,0|2,0,0]=4 6945 B12R1.50 CCC(=O)Cc1cccc(n1)Cl 1458a_100000090259_100000210202 [0,2,0,0,0,0|2,0,0]=4 6946 B12R1.50 CCC(=O)Cc1cccc(n1)Cl 1458a_100000210414_100000086093 [0,2,0,0,0,0|2,0,0]=4 6947 B12R1.50 CCC(=O)Cc1cccc(n1)F 1458a_100000096803_100000210202 [0,2,0,0,0,0|2,0,0]=4 6948 B12R1.50 CCC(=O)Cc1cccc(n1)F 1458a_100000210414_100009819644 [0,2,0,0,0,0|2,0,0]=4 6949 B12R1.50 CCC(=O)Cc1ccnc(c1)Br 1458a_100000210414_100010243470 [0,2,0,0,0,0|2,0,0]=4 6950 B12R1.50 CCC(=O)Cc1ccnc(c1)Br 1458a_100010126891_100000210202 [0,2,0,0,0,0|2,0,0]=4 6951 B12R1.50 CCC(=O)Cc1ccnc(c1)C 1458a_100000210414_200020672517 [0,2,0,0,0,0|2,0,0]=4 6952 B12R1.50 CCC(=O)Cc1ccnc(c1)Cl 1458a_100000210414_100000764220 [0,2,0,0,0,0|2,0,0]=4 6953 B12R1.50 CCC(=O)Cc1cncc(c1)Br 1458a_100000210414_100011740620 [0,2,0,0,0,0|2,0,0]=4 6954 B12R1.50 CCC(=O)Cc1cncc(c1)Br 1458a_100000239331_100000210202 [0,2,0,0,0,0|2,0,0]=4 6955 B12R1.50 CCC(=O)Cc1cncc(c1)C 1458a_100000210414_100000716715 [0,2,0,0,0,0|2,0,0]=4 6956 B12R1.50 CCC(=O)Cc1cncc(c1)Cl 1458a_100000210414_100016992070 [0,2,0,0,0,0|2,0,0]=4 6957 B12R1.50 CCC(=O)Cc1cncc(c1)F 1458a_100000210414_100000725299 [0,2,0,0,0,0|2,0,0]=4 6958 B12R1.50 CCC(=O)Cc1cncc(c1)F 1458a_100011667516_100000210202 [0,2,0,0,0,0|2,0,0]=4 6959 B12R1.50 CCC(=O)Nc1cccc(c1)Br 11a_100000210019_100000210414 [0,2,0,0,0,0|2,0,0]=4 6960 B12R1.50 CCC(=O)Nc1cccc(c1)Br 1626a_100000210019_100000210414 [0,2,0,0,0,0|2,0,0]=4 6961 B12R1.50 CCC(=O)Nc1cccc(c1)Br 22a_100000210019_100000210414 [0,2,0,0,0,0|2,0,0]=4 6962 B12R1.50 CCC(=O)Nc1cccc(c1)Br 527a_100000210019_100000210414 [0,2,0,0,0,0|2,0,0]=4 6963 B12R1.50 CCC(=O)Nc1cccc(c1)C 11a_100000188690_100000210414 [0,2,0,0,0,0|2,0,0]=4 6964 B12R1.50 CCC(=O)Nc1cccc(c1)C 1626a_100000188690_100000210414 [0,2,0,0,0,0|2,0,0]=4 6965 B12R1.50 CCC(=O)Nc1cccc(c1)C 22a_100000188690_100000210414 [0,2,0,0,0,0|2,0,0]=4 6966 B12R1.50 CCC(=O)Nc1cccc(c1)C 527a_100000188690_100000210414 [0,2,0,0,0,0|2,0,0]=4 6967 B12R1.50 CCC(=O)Nc1cccc(c1)Cl 11a_100000185859_100000210414 [0,2,0,0,0,0|2,0,0]=4 6968 B12R1.50 CCC(=O)Nc1cccc(c1)Cl 1626a_100000185859_100000210414 [0,2,0,0,0,0|2,0,0]=4 6969 B12R1.50 CCC(=O)Nc1cccc(c1)Cl 22a_100000185859_100000210414 [0,2,0,0,0,0|2,0,0]=4 6970 B12R1.50 CCC(=O)Nc1cccc(c1)F 11a_100000210047_100000210414 [0,2,0,0,0,0|2,0,0]=4 6971 B12R1.50 CCC(=O)Nc1cccc(c1)F 1626a_100000210047_100000210414 [0,2,0,0,0,0|2,0,0]=4 6972 B12R1.50 CCC(=O)Nc1cccc(c1)F 22a_100000210047_100000210414 [0,2,0,0,0,0|2,0,0]=4 6973 B12R1.50 CCC(=O)Nc1cccc(c1)F 527a_100000210047_100000210414 [0,2,0,0,0,0|2,0,0]=4 6974 B12R1.50 CCC(=O)Nc1cccc(c1)I 11a_100000211102_100000210414 [0,2,0,0,0,0|2,0,0]=4 6975 B12R1.50 CCC(=O)Nc1cccc(c1)I 1626a_100000211102_100000210414 [0,2,0,0,0,0|2,0,0]=4 6976 B12R1.50 CCC(=O)Nc1cccc(c1)I 22a_100000211102_100000210414 [0,2,0,0,0,0|2,0,0]=4 6977 B12R1.50 CCC(=O)Nc1cccc(c1)I 527a_100000211102_100000210414 [0,2,0,0,0,0|2,0,0]=4 6978 B12R1.50 CCC(=O)Nc1cccc(c1)O 1626a_100000210217_100000210414 [0,2,0,0,0,0|2,0,0]=4 6979 B12R1.50 CCC(=O)Nc1cccc(c1)O 22a_100000210217_100000210414 [0,2,0,0,0,0|2,0,0]=4 6980 B12R1.50 CCC(=O)Nc1cccc(c1)O 527a_100000210217_100000210414 [0,2,0,0,0,0|2,0,0]=4 6981 B12R1.50 CCN(C)Cc1cccc(c1)Br 2230a_100000187426_200000210301 [0,2,0,0,0,0|1,0,1]=4 6982 B12R1.50 CCN(C)Cc1cccc(c1)Br 2230a_100000187585_100000210202 [0,2,0,0,0,0|1,0,1]=4 6983 B12R1.50 CCN(C)Cc1cccc(c1)Br 2230a_100000225621_100000698116 [0,2,0,0,0,0|1,0,1]=4 6984 B12R1.50 CCN(C)Cc1cccc(c1)Br 269982a_100000187426_200000210301 [0,2,0,0,0,0|1,0,1]=4 6985 B12R1.50 CCN(C)Cc1cccc(c1)Br 269982a_100000187585_100000204670 [0,2,0,0,0,0|1,0,1]=4 6986 B12R1.50 CCN(C)Cc1cccc(c1)Br 269982a_100000225621_100000211773 [0,2,0,0,0,0|1,0,1]=4 6987 B12R1.50 CCN(C)Cc1cccc(c1)Br 26a_100000225621_100000210342 [0,2,0,0,0,0|1,0,1]=4 6988 B12R1.50 CCN(C)Cc1cccc(c1)C 2230a_100000225621_100000211840 [0,2,0,0,0,0|1,0,1]=4 6989 B12R1.50 CCN(C)Cc1cccc(c1)C 2230a_102495364743_100000210202 [0,2,0,0,0,0|1,0,1]=4 6990 B12R1.50 CCN(C)Cc1cccc(c1)C 2230a_102516607250_200000210301 [0,2,0,0,0,0|1,0,1]=4 6991 B12R1.50 CCN(C)Cc1cccc(c1)C 269982a_100000225621_100000211840 [0,2,0,0,0,0|1,0,1]=4 6992 B12R1.50 CCN(C)Cc1cccc(c1)C 269982a_102495364743_100000204670 [0,2,0,0,0,0|1,0,1]=4 6993 B12R1.50 CCN(C)Cc1cccc(c1)C 269982a_102516607250_200000210301 [0,2,0,0,0,0|1,0,1]=4 6994 B12R1.50 CCN(C)Cc1cccc(c1)C 34a_102495364743_100000210202 [0,2,0,0,0,0|1,0,1]=4 6995 B12R1.50 CCN(C)Cc1cccc(c1)Cl 2230a_100000201194_200000210301 [0,2,0,0,0,0|1,0,1]=4 6996 B12R1.50 CCN(C)Cc1cccc(c1)Cl 2230a_100000225621_100000181238 [0,2,0,0,0,0|1,0,1]=4 6997 B12R1.50 CCN(C)Cc1cccc(c1)Cl 2230a_100020629429_100000210202 [0,2,0,0,0,0|1,0,1]=4 6998 B12R1.50 CCN(C)Cc1cccc(c1)Cl 269982a_100000201194_200000210301 [0,2,0,0,0,0|1,0,1]=4 6999 B12R1.50 CCN(C)Cc1cccc(c1)Cl 269982a_100000225621_100000181238 [0,2,0,0,0,0|1,0,1]=4 7000 B12R1.50 CCN(C)Cc1cccc(c1)Cl 269982a_100020629429_100000204670 [0,2,0,0,0,0|1,0,1]=4 7001 B12R1.50 CCN(C)Cc1cccc(c1)F 2230a_100000184398_100000210202 [0,2,0,0,0,0|1,0,1]=4 7002 B12R1.50 CCN(C)Cc1cccc(c1)F 2230a_100000195558_200000210301 [0,2,0,0,0,0|1,0,1]=4 7003 B12R1.50 CCN(C)Cc1cccc(c1)F 2230a_100000225621_100000230114 [0,2,0,0,0,0|1,0,1]=4 7004 B12R1.50 CCN(C)Cc1cccc(c1)F 269982a_100000184398_100000204670 [0,2,0,0,0,0|1,0,1]=4 7005 B12R1.50 CCN(C)Cc1cccc(c1)F 269982a_100000195558_200000210301 [0,2,0,0,0,0|1,0,1]=4 7006 B12R1.50 CCN(C)Cc1cccc(c1)F 269982a_100000225621_100000230114 [0,2,0,0,0,0|1,0,1]=4 7007 B12R1.50 CCN(C)Cc1cccc(c1)F 34a_100000184398_100000210202 [0,2,0,0,0,0|1,0,1]=4 7008 B12R1.50 CCN(C)Cc1cccc(c1)F 34a_100000195558_200000210301 [0,2,0,0,0,0|1,0,1]=4 7009 B12R1.50 CCN(C)Cc1cccc(c1)I 2230a_100000225621_100011218688 [0,2,0,0,0,0|1,0,1]=4 7010 B12R1.50 CCN(C)Cc1cccc(c1)I 269982a_100000225621_100011218688 [0,2,0,0,0,0|1,0,1]=4 7011 B12R1.50 CCN(C)Cc1cccc(c1)O 2230a_100000201218_200000210301 [0,2,0,0,0,0|1,0,1]=4 7012 B12R1.50 CCN(C)Cc1cccc(c1)O 2230a_100000207540_100000210202 [0,2,0,0,0,0|1,0,1]=4 7013 B12R1.50 CCN(C)Cc1cccc(c1)O 2230a_100000225621_100011660834 [0,2,0,0,0,0|1,0,1]=4 7014 B12R1.50 CCN(C)Cc1cccc(c1)O 269982a_100000201218_200000210301 [0,2,0,0,0,0|1,0,1]=4 7015 B12R1.50 CCN(C)Cc1cccc(c1)O 269982a_100000207540_100000204670 [0,2,0,0,0,0|1,0,1]=4 7016 B12R1.50 CCN(C)Cc1cccc(c1)O 269982a_100000225621_100000084143 [0,2,0,0,0,0|1,0,1]=4 7017 B12R1.50 CCN([13CH3])Cc1cccc(c1)Br 2230a_100000187426_200025704644 [0,2,0,0,0,0|1,0,1]=4 7018 B12R1.50 CCN([13CH3])Cc1cccc(c1)Br 269982a_100000187426_200025704644 [0,2,0,0,0,0|1,0,1]=4 7019 B12R1.50 CCN([13CH3])Cc1cccc(c1)C 2230a_102516607250_200025704644 [0,2,0,0,0,0|1,0,1]=4 7020 B12R1.50 CCN([13CH3])Cc1cccc(c1)C 269982a_102516607250_200025704644 [0,2,0,0,0,0|1,0,1]=4 7021 B12R1.50 CCN([13CH3])Cc1cccc(c1)Cl 2230a_100000201194_200025704644 [0,2,0,0,0,0|1,0,1]=4 7022 B12R1.50 CCN([13CH3])Cc1cccc(c1)Cl 269982a_100000201194_200025704644 [0,2,0,0,0,0|1,0,1]=4 7023 B12R1.50 CCN([13CH3])Cc1cccc(c1)F 2230a_100000195558_200025704644 [0,2,0,0,0,0|1,0,1]=4 7024 B12R1.50 CCN([13CH3])Cc1cccc(c1)F 269982a_100000195558_200025704644 [0,2,0,0,0,0|1,0,1]=4 7025 B12R1.50 CCN([13CH3])Cc1cccc(c1)F 34a_100000195558_200025704644 [0,2,0,0,0,0|1,0,1]=4 7026 B12R1.50 CCN([13CH3])Cc1cccc(c1)O 2230a_100000201218_200025704644 [0,2,0,0,0,0|1,0,1]=4 7027 B12R1.50 CCN([13CH3])Cc1cccc(c1)O 269982a_100000201218_200025704644 [0,2,0,0,0,0|1,0,1]=4 7028 B12R1.50 CN(CF)Cc1cccc(c1)Br 269982a_100000187585_100015361967 [0,2,0,0,0,0|1,0,1]=4 7029 B12R1.50 CN(CF)Cc1cccc(c1)Cl 269982a_100020629429_100015361967 [0,2,0,0,0,0|1,0,1]=4 7030 B12R1.50 CN(CF)Cc1cccc(c1)F 269982a_100000184398_100015361967 [0,2,0,0,0,0|1,0,1]=4 7031 B12R1.50 CN(CF)Cc1cccc(c1)F 34a_100000184398_100015361967 [0,2,0,0,0,0|1,0,1]=4 7032 B12R1.50 CN(CF)Cc1cccc(c1)O 269982a_100000207540_100015361967 [0,2,0,0,0,0|1,0,1]=4 7033 B12R1.50 CNC(=O)Cc1cccc(c1)Br 11a_106832991635_100000747190 [0,2,0,0,0,0|1,0,0]=3 7034 B12R1.50 CNC(=O)Cc1cccc(c1)Br 240690a_100102657272_100000747190 [0,2,0,0,0,0|1,0,0]=3 7035 B12R1.50 CNC(=O)Cc1cccc(c1)Br 527a_100102657272_100000747190 [0,2,0,0,0,0|1,0,0]=3 7036 B12R1.50 CNC(=O)Cc1cccc(c1)C 11a_106832991635_100011206899 [0,2,0,0,0,0|1,0,0]=3 7037 B12R1.50 CNC(=O)Cc1cccc(c1)C 1626a_100102657272_100011206899 [0,2,0,0,0,0|1,0,0]=3 7038 B12R1.50 CNC(=O)Cc1cccc(c1)C 240690a_100102657272_100011206899 [0,2,0,0,0,0|1,0,0]=3 7039 B12R1.50 CNC(=O)Cc1cccc(c1)C 527a_100102657272_100011206899 [0,2,0,0,0,0|1,0,0]=3 7040 B12R1.50 CNC(=O)Cc1cccc(c1)Cl 11a_106832991635_100000749307 [0,2,0,0,0,0|1,0,0]=3 7041 B12R1.50 CNC(=O)Cc1cccc(c1)Cl 1626a_100102657272_100000749307 [0,2,0,0,0,0|1,0,0]=3 7042 B12R1.50 CNC(=O)Cc1cccc(c1)Cl 240690a_100102657272_100000749307 [0,2,0,0,0,0|1,0,0]=3 7043 B12R1.50 CNC(=O)Cc1cccc(c1)Cl 527a_100102657272_100000749307 [0,2,0,0,0,0|1,0,0]=3 7044 B12R1.50 CNC(=O)Cc1cccc(c1)F 11a_106832991635_100000211661 [0,2,0,0,0,0|1,0,0]=3 7045 B12R1.50 CNC(=O)Cc1cccc(c1)F 1626a_100102657272_100000211661 [0,2,0,0,0,0|1,0,0]=3 7046 B12R1.50 CNC(=O)Cc1cccc(c1)F 240690a_100102657272_100000211661 [0,2,0,0,0,0|1,0,0]=3 7047 B12R1.50 CNC(=O)Cc1cccc(c1)F 527a_100102657272_100000211661 [0,2,0,0,0,0|1,0,0]=3 7048 B12R1.50 CNC(=O)Cc1cccc(c1)I 11a_106832991635_100000238430 [0,2,0,0,0,0|1,0,0]=3 7049 B12R1.50 CNC(=O)Cc1cccc(c1)I 1626a_100102657272_100000238430 [0,2,0,0,0,0|1,0,0]=3 7050 B12R1.50 CNC(=O)Cc1cccc(c1)I 240690a_100102657272_100000238430 [0,2,0,0,0,0|1,0,0]=3 7051 B12R1.50 CNC(=O)Cc1cccc(c1)I 527a_100102657272_100000238430 [0,2,0,0,0,0|1,0,0]=3 7052 B12R1.50 CNC(=O)Cc1cccc(c1)O 240690a_100102657272_100000745134 [0,2,0,0,0,0|1,0,0]=3 7053 B12R1.50 CNC(=O)Cc1cccc(c1)O 527a_100102657272_100000745134 [0,2,0,0,0,0|1,0,0]=3 7054 B12R1.50 CNC(=O)Cc1cccc(n1)Br 11a_106832991635_100010201708 [0,2,0,0,0,0|2,0,0]=4 7055 B12R1.50 CNC(=O)Cc1cccc(n1)Br 240690a_100102657272_100010201708 [0,2,0,0,0,0|2,0,0]=4 7056 B12R1.50 CNC(=O)Cc1cccc(n1)Br 527a_100102657272_100010201708 [0,2,0,0,0,0|2,0,0]=4 7057 B12R1.50 CNC(=O)Cc1cccc(n1)C 11a_106832991635_100012001110 [0,2,0,0,0,0|2,0,0]=4 7058 B12R1.50 CNC(=O)Cc1cccc(n1)C 1626a_100102657272_100012001110 [0,2,0,0,0,0|2,0,0]=4 7059 B12R1.50 CNC(=O)Cc1cccc(n1)C 240690a_100102657272_100012001110 [0,2,0,0,0,0|2,0,0]=4 7060 B12R1.50 CNC(=O)Cc1cccc(n1)C 527a_100102657272_100012001110 [0,2,0,0,0,0|2,0,0]=4 7061 B12R1.50 CNC(=O)Cc1cccc(n1)Cl 11a_106832991635_100000090259 [0,2,0,0,0,0|2,0,0]=4 7062 B12R1.50 CNC(=O)Cc1cccc(n1)Cl 1626a_100102657272_100000090259 [0,2,0,0,0,0|2,0,0]=4 7063 B12R1.50 CNC(=O)Cc1cccc(n1)Cl 240690a_100102657272_100000090259 [0,2,0,0,0,0|2,0,0]=4 7064 B12R1.50 CNC(=O)Cc1cccc(n1)F 11a_106832991635_100000096803 [0,2,0,0,0,0|2,0,0]=4 7065 B12R1.50 CNC(=O)Cc1cccc(n1)F 1626a_100102657272_100000096803 [0,2,0,0,0,0|2,0,0]=4 7066 B12R1.50 CNC(=O)Cc1cccc(n1)F 240690a_100102657272_100000096803 [0,2,0,0,0,0|2,0,0]=4 7067 B12R1.50 CNC(=O)Cc1ccnc(c1)Br 11a_106832991635_100010126891 [0,2,0,0,0,0|2,0,0]=4 7068 B12R1.50 CNC(=O)Cc1ccnc(c1)Br 240690a_100102657272_100010126891 [0,2,0,0,0,0|2,0,0]=4 7069 B12R1.50 CNC(=O)Cc1ccnc(c1)Br 527a_100102657272_100010126891 [0,2,0,0,0,0|2,0,0]=4 7070 B12R1.50 CNC(=O)Cc1ccnc(c1)Cl 11a_106832991635_100000085289 [0,2,0,0,0,0|2,0,0]=4 7071 B12R1.50 CNC(=O)Cc1ccnc(c1)Cl 1626a_100102657272_100000085289 [0,2,0,0,0,0|2,0,0]=4 7072 B12R1.50 CNC(=O)Cc1ccnc(c1)Cl 240690a_100102657272_100000085289 [0,2,0,0,0,0|2,0,0]=4 7073 B12R1.50 CNC(=O)Cc1ccnc(c1)Cl 527a_100102657272_100000085289 [0,2,0,0,0,0|2,0,0]=4 7074 B12R1.50 CNC(=O)Cc1cncc(c1)Br 11a_106832991635_100000239331 [0,2,0,0,0,0|2,0,0]=4 7075 B12R1.50 CNC(=O)Cc1cncc(c1)Br 240690a_100102657272_100000239331 [0,2,0,0,0,0|2,0,0]=4 7076 B12R1.50 CNC(=O)Cc1cncc(c1)Br 527a_100102657272_100000239331 [0,2,0,0,0,0|2,0,0]=4 7077 B12R1.50 CNC(=O)Cc1cncc(c1)F 11a_106832991635_100011667516 [0,2,0,0,0,0|2,0,0]=4 7078 B12R1.50 CNC(=O)Cc1cncc(c1)F 240690a_100102657272_100011667516 [0,2,0,0,0,0|2,0,0]=4 7079 B12R1.50 CNC(=O)Cc1cncc(c1)F 527a_100102657272_100011667516 [0,2,0,0,0,0|2,0,0]=4 7080 B12R1.50 CNC(=O)Nc1cccc(c1)Br 2430a_100000210019_100102657272 [0,2,0,0,0,0|2,0,0]=4 7081 B12R1.50 CNC(=O)Nc1cccc(c1)Br 512a_100000210019_100102657272 [0,2,0,0,0,0|2,0,0]=4 7082 B12R1.50 CNC(=O)Nc1cccc(c1)C 2430a_100000188690_100102657272 [0,2,0,0,0,0|2,0,0]=4 7083 B12R1.50 CNC(=O)Nc1cccc(c1)C 512a_100000188690_100102657272 [0,2,0,0,0,0|2,0,0]=4 7084 B12R1.50 CNC(=O)Nc1cccc(c1)Cl 2430a_100000185859_100102657272 [0,2,0,0,0,0|2,0,0]=4 7085 B12R1.50 CNC(=O)Nc1cccc(c1)F 2430a_100000210047_100102657272 [0,2,0,0,0,0|2,0,0]=4 7086 B12R1.50 CNC(=O)Nc1cccc(c1)F 512a_100000210047_100102657272 [0,2,0,0,0,0|2,0,0]=4 7087 B12R1.50 CNC(=O)Nc1cccc(c1)I 2430a_100000211102_100102657272 [0,2,0,0,0,0|2,0,0]=4 7088 B12R1.50 CNC(=O)Nc1cccc(c1)I 512a_100000211102_100102657272 [0,2,0,0,0,0|2,0,0]=4 7089 B12R1.50 CNC(=O)Nc1cccc(c1)O 2430a_100000210217_100102657272 [0,2,0,0,0,0|2,0,0]=4 7090 B12R1.50 CNC(=O)Nc1cccc(c1)O 512a_100000210217_100102657272 [0,2,0,0,0,0|2,0,0]=4 7091 B12R1.50 CNC(C)Cc1cccc(c1)Br 270004a_106832991635_100000689217 [0,2,0,0,0,0|0,0,2]=4 7092 B12R1.50 CNC(C)Cc1cccc(c1)Cl 270004a_106832991635_100000727212 [0,2,0,0,0,0|0,0,2]=4 7093 B12R1.50 CNC(C)Cc1cccc(c1)F 270004a_106832991635_100000687711 [0,2,0,0,0,0|0,0,2]=4 7094 B12R1.50 COC(=O)Cc1cc(ccn1)O 271570a_203496583355_100010275543 [0,2,0,0,0,0|2,0,0]=4 7095 B12R1.50 COC(=O)Cc1cccc(c1)O 271570a_203496583355_100000699549 [0,2,0,0,0,0|1,0,0]=3 7096 B12R1.50 COC(=O)Cc1cccc(n1)O 271570a_203496583355_100000094215 [0,2,0,0,0,0|2,0,0]=4 7097 B12R1.50 COC(=O)Cc1ccnc(c1)O 271570a_203496583355_100010135589 [0,2,0,0,0,0|2,0,0]=4 7098 B12R1.50 Cc1cc(ccn1)CC(=O)CO 1458a_100000210174_200020672517 [0,2,0,0,0,0|2,0,0]=4 7099 B12R1.50 Cc1cccc(c1)CC(=O)CF 1458a_100011206899_100015361967 [0,2,0,0,0,0|1,0,0]=3 7100 B12R1.50 Cc1cccc(c1)CC(=O)CO 1458a_100000210174_100000211840 [0,2,0,0,0,0|1,0,0]=3 7101 B12R1.50 Cc1cccc(c1)CN(C)CF 269982a_102495364743_100015361967 [0,2,0,0,0,0|1,0,1]=4 7102 B12R1.50 Cc1cccc(c1)CN(C)CF 34a_102495364743_100015361967 [0,2,0,0,0,0|1,0,1]=4 7103 B12R1.50 Cc1cccc(c1)NC(=O)CO 22a_100000188690_100000210174 [0,2,0,0,0,0|2,0,0]=4 7104 B12R1.50 Cc1cccc(c1)NC(=O)CO 527a_100000188690_100000210174 [0,2,0,0,0,0|2,0,0]=4 7105 B12R1.50 Cc1cccc(n1)CC(=O)CF 1458a_100012001110_100015361967 [0,2,0,0,0,0|2,0,0]=4 7106 B12R1.50 Cc1cccc(n1)CC(=O)CO 1458a_100000210174_100000757606 [0,2,0,0,0,0|2,0,0]=4 7107 B12R1.50 Cc1ccnc(c1)CC(=O)CO 1458a_100000210174_100000718516 [0,2,0,0,0,0|2,0,0]=4 7108 B12R1.50 Cc1cncc(c1)CC(=O)CO 1458a_100000210174_100000716715 [0,2,0,0,0,0|2,0,0]=4 7109 B12R1.50 NC(CO)Cc1cccc(c1)O 271570a_203496583355_114802770106 [0,2,0,0,0,0|1,0,1]=4 7110 B12R1.50 O=C(CF)Cc1cccc(c1)Br 1458a_100000747190_100015361967 [0,2,0,0,0,0|1,0,0]=3 7111 B12R1.50 O=C(CF)Cc1cccc(c1)Cl 1458a_100000749307_100015361967 [0,2,0,0,0,0|1,0,0]=3 7112 B12R1.50 O=C(CF)Cc1cccc(c1)F 1458a_100000211661_100015361967 [0,2,0,0,0,0|1,0,0]=3 7113 B12R1.50 O=C(CF)Cc1cccc(c1)I 1458a_100000238430_100015361967 [0,2,0,0,0,0|1,0,0]=3 7114 B12R1.50 O=C(CF)Cc1cccc(c1)O 1458a_100000745134_100015361967 [0,2,0,0,0,0|1,0,0]=3 7115 B12R1.50 O=C(CF)Cc1cccc(n1)Br 1458a_100010201708_100015361967 [0,2,0,0,0,0|2,0,0]=4 7116 B12R1.50 O=C(CF)Cc1cccc(n1)Cl 1458a_100000090259_100015361967 [0,2,0,0,0,0|2,0,0]=4 7117 B12R1.50 O=C(CF)Cc1cccc(n1)F 1458a_100000096803_100015361967 [0,2,0,0,0,0|2,0,0]=4 7118 B12R1.50 O=C(CF)Cc1ccnc(c1)Br 1458a_100010126891_100015361967 [0,2,0,0,0,0|2,0,0]=4 7119 B12R1.50 O=C(CF)Cc1cncc(c1)Br 1458a_100000239331_100015361967 [0,2,0,0,0,0|2,0,0]=4 7120 B12R1.50 O=C(CF)Cc1cncc(c1)F 1458a_100011667516_100015361967 [0,2,0,0,0,0|2,0,0]=4 7121 B12R1.50 O=C(CO)Cc1cc(ccn1)Br 1458a_100000210174_100010173614 [0,2,0,0,0,0|2,0,0]=4 7122 B12R1.50 O=C(CO)Cc1cc(ccn1)Cl 1458a_100000210174_100016988179 [0,2,0,0,0,0|2,0,0]=4 7123 B12R1.50 O=C(CO)Cc1cccc(c1)Br 1458a_100000210174_100000211773 [0,2,0,0,0,0|1,0,0]=3 7124 B12R1.50 O=C(CO)Cc1cccc(c1)Cl 1458a_100000210174_100000181238 [0,2,0,0,0,0|1,0,0]=3 7125 B12R1.50 O=C(CO)Cc1cccc(c1)F 1458a_100000210174_100000230114 [0,2,0,0,0,0|1,0,0]=3 7126 B12R1.50 O=C(CO)Cc1cccc(c1)I 1458a_100000210174_100011218688 [0,2,0,0,0,0|1,0,0]=3 7127 B12R1.50 O=C(CO)Cc1cccc(c1)O 1458a_100000210174_100011660834 [0,2,0,0,0,0|1,0,0]=3 7128 B12R1.50 O=C(CO)Cc1cccc(n1)Br 1458a_100000210174_100009889011 [0,2,0,0,0,0|2,0,0]=4 7129 B12R1.50 O=C(CO)Cc1cccc(n1)Cl 1458a_100000210174_100000086093 [0,2,0,0,0,0|2,0,0]=4 7130 B12R1.50 O=C(CO)Cc1cccc(n1)F 1458a_100000210174_100009819644 [0,2,0,0,0,0|2,0,0]=4 7131 B12R1.50 O=C(CO)Cc1ccnc(c1)Br 1458a_100000210174_100010243470 [0,2,0,0,0,0|2,0,0]=4 7132 B12R1.50 O=C(CO)Cc1ccnc(c1)Cl 1458a_100000210174_100000764220 [0,2,0,0,0,0|2,0,0]=4 7133 B12R1.50 O=C(CO)Cc1cncc(c1)Br 1458a_100000210174_100011740620 [0,2,0,0,0,0|2,0,0]=4 7134 B12R1.50 O=C(CO)Cc1cncc(c1)Cl 1458a_100000210174_100016992070 [0,2,0,0,0,0|2,0,0]=4 7135 B12R1.50 O=C(CO)Cc1cncc(c1)F 1458a_100000210174_100000725299 [0,2,0,0,0,0|2,0,0]=4 7136 B12R1.50 O=C(CO)Nc1cccc(c1)Br 22a_100000210019_100000210174 [0,2,0,0,0,0|2,0,0]=4 7137 B12R1.50 O=C(CO)Nc1cccc(c1)Br 527a_100000210019_100000210174 [0,2,0,0,0,0|2,0,0]=4 7138 B12R1.50 O=C(CO)Nc1cccc(c1)Cl 22a_100000185859_100000210174 [0,2,0,0,0,0|2,0,0]=4 7139 B12R1.50 O=C(CO)Nc1cccc(c1)F 22a_100000210047_100000210174 [0,2,0,0,0,0|2,0,0]=4 7140 B12R1.50 O=C(CO)Nc1cccc(c1)F 527a_100000210047_100000210174 [0,2,0,0,0,0|2,0,0]=4 7141 B12R1.50 O=C(CO)Nc1cccc(c1)I 22a_100000211102_100000210174 [0,2,0,0,0,0|2,0,0]=4 7142 B12R1.50 O=C(CO)Nc1cccc(c1)I 527a_100000211102_100000210174 [0,2,0,0,0,0|2,0,0]=4 7143 B12R1.50 O=C(CO)Nc1cccc(c1)O 22a_100000210217_100000210174 [0,2,0,0,0,0|2,0,0]=4 7144 B12R1.50 O=C(CO)Nc1cccc(c1)O 527a_100000210217_100000210174 [0,2,0,0,0,0|2,0,0]=4 7145 B12R1.118 C#CC(Cc1ccccc1)OC 34a_100000685211_200000210301 [0,2,0,0,0,0|0,0,2]=4 7146 B12R1.118 C#CC(Cc1ccccc1)OC 7a_100000685211_200000210301 [0,2,0,0,0,0|0,0,2]=4 7147 B12R1.118 C#CC(Cc1ccccc1)O[13CH3] 34a_100000685211_200025704644 [0,2,0,0,0,0|0,0,2]=4 7148 B12R1.118 C#CC(Cc1ccccc1)O[13CH3] 7a_100000685211_200025704644 [0,2,0,0,0,0|0,0,2]=4 7149 B12R1.118 CCC(Cc1ccccc1)NC 270004a_106832991635_100000212045 [0,2,0,0,0,0|0,0,2]=4 7150 B12R1.118 CCC(Cc1ccccc1)OC 7a_100000760156_200000210301 [0,2,0,0,0,0|0,0,2]=4 7151 B12R1.118 CCC(Cc1ccccc1)O[13CH3] 7a_100000760156_200025704644 [0,2,0,0,0,0|0,0,2]=4 7152 B12R1.118 CCN(CC)Cc1ccccc1 2230a_100000186914_100000210202 [0,2,0,0,0,0|1,0,1]=4 7153 B12R1.118 CCN(CC)Cc1ccccc1 2230a_100000724800_100015291786 [0,2,0,0,0,0|1,0,1]=4 7154 B12R1.118 CCN(CC)Cc1ccccc1 269956a_100000042499_100015291786 [0,2,0,0,0,0|1,0,1]=4 7155 B12R1.118 CCN(CC)Cc1ccccc1 269982a_100000186914_100000204670 [0,2,0,0,0,0|1,0,1]=4 7156 B12R1.118 CCN(CC)Cc1ccccc1 269982a_100000724800_100000211182 [0,2,0,0,0,0|1,0,1]=4 7157 B12R1.118 CCN(CC)Cc1ccccc1 270004a_100000724800_100015611070 [0,2,0,0,0,0|1,0,1]=4 7158 B12R1.118 CCN(CF)Cc1ccccc1 269982a_100000186914_100015361967 [0,2,0,0,0,0|1,0,1]=4 7159 B12R1.118 CNC(C#N)Cc1ccccc1 2230a_100000746547_200000210301 [0,2,0,0,0,0|0,0,2]=4 7160 B12R1.118 CNC(C#N)Cc1ccccc1 7a_106832991635_100000183401 [0,2,0,0,0,0|0,0,2]=4 7161 B12R1.118 CNC(CO)Cc1ccccc1 2230a_100000739027_200000210301 [0,2,0,0,0,0|0,0,2]=4 7162 B12R1.118 COC(CN)Cc1ccccc1 34a_100000752270_200000210301 [0,2,0,0,0,0|0,0,2]=4 7163 B12R1.118 CO[C@H](CCl)Cc1ccccc1 7a_100000729385_200000210301 [0,2,0,0,0,0|0,0,2]=4 7164 B12R1.118 CSC(C#N)Cc1ccccc1 62a_100000183401_200000210301 [0,2,0,0,0,0|0,0,2]=4 7165 B12R1.118 CSC(C#N)Cc1ccccc1 62a_200000210301_100000183401 [0,2,0,0,0,0|0,0,2]=4 7166 B12R1.118 [13CH3]NC(C#N)Cc1ccccc1 2230a_100000746547_200025704644 [0,2,0,0,0,0|0,0,2]=4 7167 B12R1.118 [13CH3]NC(CO)Cc1ccccc1 2230a_100000739027_200025704644 [0,2,0,0,0,0|0,0,2]=4 7168 B12R1.118 [13CH3]OC(CN)Cc1ccccc1 34a_100000752270_200025704644 [0,2,0,0,0,0|0,0,2]=4 7169 B12R1.118 [13CH3]O[C@H](CCl)Cc1ccccc1 7a_100000729385_200025704644 [0,2,0,0,0,0|0,0,2]=4 7170 B12R1.118 [13CH3]SC(C#N)Cc1ccccc1 62a_100000183401_200025704644 [0,2,0,0,0,0|0,0,2]=4 7171 B12R1.118 [13CH3]SC(C#N)Cc1ccccc1 62a_200025704644_100000183401 [0,2,0,0,0,0|0,0,2]=4 7172 B12R1.194 CC(C)(Cc1ccccc1)O[13CH3] 7a_100011215222_200025704644 [0,2,0,0,0,0|0,0,2]=4 7173 B12R1.194 CNS(=O)(=O)Cc1ccccc1 270084a_100102657272_100000211737 [0,2,0,0,0,0|2,0,0]=4 7174 B12R1.194 CNS(=O)(=O)Cc1ccccc1 274078a_100102657272_100000211737 [0,2,0,0,0,0|2,0,0]=4 7175 B12R1.194 CNS(=O)(=O)Cc1ccccc1 40a_100102657272_100000235865 [0,2,0,0,0,0|2,0,0]=4 7176 B12R1.194 COC(C)(C)Cc1ccccc1 7a_100011215222_200000210301 [0,2,0,0,0,0|0,0,2]=4 7177 B12R1.371 C#CC(=O)Cc1ccccc1Br 1458a_100000211873_100000184730 [0,2,0,0,0,0|1,0,1]=4 7178 B12R1.371 C#CC(=O)Cc1ccccc1C 1458a_100000211873_100000211839 [0,2,0,0,0,0|1,0,1]=4 7179 B12R1.371 C#CC(=O)Cc1ccccc1Cl 1458a_100000211873_100000187162 [0,2,0,0,0,0|1,0,1]=4 7180 B12R1.371 C#CC(=O)Cc1ccccc1F 1458a_100000211873_100000187165 [0,2,0,0,0,0|1,0,1]=4 7181 B12R1.371 C#CC(=O)Cc1ccccc1I 1458a_100000211873_100011216222 [0,2,0,0,0,0|1,0,1]=4 7182 B12R1.371 C=CC(=O)Cc1ccccc1Br 1458a_100000185746_100000184730 [0,2,0,0,0,0|1,0,0]=3 7183 B12R1.371 C=CC(=O)Cc1ccccc1C 1458a_100000185746_100000211839 [0,2,0,0,0,0|1,0,0]=3 7184 B12R1.371 C=CC(=O)Cc1ccccc1Cl 1458a_100000185746_100000187162 [0,2,0,0,0,0|1,0,0]=3 7185 B12R1.371 C=CC(=O)Cc1ccccc1F 1458a_100000185746_100000187165 [0,2,0,0,0,0|1,0,0]=3 7186 B12R1.371 C=CC(=O)Cc1ccccc1I 1458a_100000185746_100011216222 [0,2,0,0,0,0|1,0,0]=3 7187 B12R1.371 C=CC(=O)Cc1cccnc1Br 1458a_100000185746_100010140945 [0,2,0,0,0,0|2,0,0]=4 7188 B12R1.371 C=CC(=O)Cc1cccnc1C 1458a_100000185746_100000732876 [0,2,0,0,0,0|2,0,0]=4 7189 B12R1.371 C=CC(=O)Cc1cccnc1Cl 1458a_100000185746_100000045678 [0,2,0,0,0,0|2,0,0]=4 7190 B12R1.371 C=CC(=O)Cc1cccnc1F 1458a_100000185746_100000099810 [0,2,0,0,0,0|2,0,0]=4 7191 B12R1.371 C=CC(=O)Cc1ccncc1C 1458a_100000185746_100020672808 [0,2,0,0,0,0|2,0,0]=4 7192 B12R1.371 C=CC(=O)Cc1ccncc1Cl 1458a_100000185746_100000763264 [0,2,0,0,0,0|2,0,0]=4 7193 B12R1.371 C=CC(=O)Cc1cnccc1C 1458a_100000185746_100000690890 [0,2,0,0,0,0|2,0,0]=4 7194 B12R1.371 C=CC(=O)Cc1ncccc1Br 1458a_100000185746_100025702911 [0,2,0,0,0,0|2,0,0]=4 7195 B12R1.371 C=CC(=O)Cc1ncccc1C 1458a_100000185746_100000696600 [0,2,0,0,0,0|2,0,0]=4 7196 B12R1.371 C=CC(=O)Cc1ncccc1Cl 1458a_100000185746_100000099807 [0,2,0,0,0,0|2,0,0]=4 7197 B12R1.371 C=CC(=O)Cc1ncccc1F 1458a_100000185746_100000104219 [0,2,0,0,0,0|2,0,0]=4 7198 B12R1.371 C=CC(=O)Cc1ncccc1O 1458a_100000185746_200020655725 [0,2,0,0,0,0|2,0,0]=4 7199 B12R1.371 C=CC(=O)Nc1ccccc1Br 1626a_100000210017_100000185746 [0,2,0,0,0,0|2,0,0]=4 7200 B12R1.371 C=CC(=O)Nc1ccccc1C 1626a_100015192222_100000185746 [0,2,0,0,0,0|2,0,0]=4 7201 B12R1.371 C=CC(=O)Nc1ccccc1C 22a_100015192222_100000185746 [0,2,0,0,0,0|2,0,0]=4 7202 B12R1.371 C=CC(=O)Nc1ccccc1Cl 1626a_100000185783_100000185746 [0,2,0,0,0,0|2,0,0]=4 7203 B12R1.371 C=CC(=O)Nc1ccccc1Cl 22a_100000185783_100000185746 [0,2,0,0,0,0|2,0,0]=4 7204 B12R1.371 C=CC(=O)Nc1ccccc1F 1626a_100000210422_100000185746 [0,2,0,0,0,0|2,0,0]=4 7205 B12R1.371 C=CC(=O)Nc1ccccc1F 22a_100000210422_100000185746 [0,2,0,0,0,0|2,0,0]=4 7206 B12R1.371 C=CC(=O)Nc1ccccc1I 1626a_100000210053_100000185746 [0,2,0,0,0,0|2,0,0]=4 7207 B12R1.371 C=CC(=O)Nc1ccccc1O 22a_100000185747_100000185746 [0,2,0,0,0,0|2,0,0]=4 7208 B12R1.371 C=CC(C)Sc1ccccc1Br 62a_100011215867_100000695589 [0,2,0,0,0,0|1,0,1]=4 7209 B12R1.371 C=CC(C)Sc1ccccc1C 62a_100011215867_100000210755 [0,2,0,0,0,0|1,0,1]=4 7210 B12R1.371 C=CC(C)Sc1ccccc1Cl 62a_100011215867_100000764095 [0,2,0,0,0,0|1,0,1]=4 7211 B12R1.371 C=CC(C)Sc1ccccc1F 62a_100011215867_100011215700 [0,2,0,0,0,0|1,0,1]=4 7212 B12R1.371 C=CC(C)Sc1ccccc1N 62a_100011215867_100000210017 [0,2,0,0,0,0|1,0,1]=4 7213 B12R1.371 C=CC(C)Sc1ccccc1O 62a_100011215867_100000739446 [0,2,0,0,0,0|1,0,1]=4 7214 B12R1.371 CCC(=O)Cc1ccccc1Br 1458a_100000210414_100000184730 [0,2,0,0,0,0|1,0,0]=3 7215 B12R1.371 CCC(=O)Cc1ccccc1Br 1458a_100000751119_100000210202 [0,2,0,0,0,0|1,0,0]=3 7216 B12R1.371 CCC(=O)Cc1ccccc1C 1458a_100000210414_100000211839 [0,2,0,0,0,0|1,0,0]=3 7217 B12R1.371 CCC(=O)Cc1ccccc1C 1458a_100000212180_100000210202 [0,2,0,0,0,0|1,0,0]=3 7218 B12R1.371 CCC(=O)Cc1ccccc1Cl 1458a_100000183793_100000210202 [0,2,0,0,0,0|1,0,0]=3 7219 B12R1.371 CCC(=O)Cc1ccccc1Cl 1458a_100000210414_100000187162 [0,2,0,0,0,0|1,0,0]=3 7220 B12R1.371 CCC(=O)Cc1ccccc1F 1458a_100000210414_100000187165 [0,2,0,0,0,0|1,0,0]=3 7221 B12R1.371 CCC(=O)Cc1ccccc1F 1458a_100000212012_100000210202 [0,2,0,0,0,0|1,0,0]=3 7222 B12R1.371 CCC(=O)Cc1ccccc1I 1458a_100000036491_100000210202 [0,2,0,0,0,0|1,0,0]=3 7223 B12R1.371 CCC(=O)Cc1ccccc1I 1458a_100000210414_100011216222 [0,2,0,0,0,0|1,0,0]=3 7224 B12R1.371 CCC(=O)Cc1ccccc1O 1458a_100000743006_100000210202 [0,2,0,0,0,0|1,0,0]=3 7225 B12R1.371 CCC(=O)Cc1cccnc1Br 1458a_100000210414_100010140945 [0,2,0,0,0,0|2,0,0]=4 7226 B12R1.371 CCC(=O)Cc1cccnc1C 1458a_100000210414_100000732876 [0,2,0,0,0,0|2,0,0]=4 7227 B12R1.371 CCC(=O)Cc1cccnc1Cl 1458a_100000093521_100000210202 [0,2,0,0,0,0|2,0,0]=4 7228 B12R1.371 CCC(=O)Cc1cccnc1Cl 1458a_100000210414_100000045678 [0,2,0,0,0,0|2,0,0]=4 7229 B12R1.371 CCC(=O)Cc1cccnc1F 1458a_100000210414_100000099810 [0,2,0,0,0,0|2,0,0]=4 7230 B12R1.371 CCC(=O)Cc1ccncc1C 1458a_100000210414_100020672808 [0,2,0,0,0,0|2,0,0]=4 7231 B12R1.371 CCC(=O)Cc1ccncc1Cl 1458a_100000210414_100000763264 [0,2,0,0,0,0|2,0,0]=4 7232 B12R1.371 CCC(=O)Cc1cnccc1C 1458a_100000210414_100000690890 [0,2,0,0,0,0|2,0,0]=4 7233 B12R1.371 CCC(=O)Cc1ncccc1Br 1458a_100000210414_100025702911 [0,2,0,0,0,0|2,0,0]=4 7234 B12R1.371 CCC(=O)Cc1ncccc1Br 1458a_200012357574_100000210202 [0,2,0,0,0,0|2,0,0]=4 7235 B12R1.371 CCC(=O)Cc1ncccc1C 1458a_100000210414_100000696600 [0,2,0,0,0,0|2,0,0]=4 7236 B12R1.371 CCC(=O)Cc1ncccc1C 1458a_200000722269_100000210202 [0,2,0,0,0,0|2,0,0]=4 7237 B12R1.371 CCC(=O)Cc1ncccc1Cl 1458a_100000210414_100000099807 [0,2,0,0,0,0|2,0,0]=4 7238 B12R1.371 CCC(=O)Cc1ncccc1Cl 1458a_100011998755_100000210202 [0,2,0,0,0,0|2,0,0]=4 7239 B12R1.371 CCC(=O)Cc1ncccc1F 1458a_100000210414_100000104219 [0,2,0,0,0,0|2,0,0]=4 7240 B12R1.371 CCC(=O)Cc1ncccc1O 1458a_100000210414_200020655725 [0,2,0,0,0,0|2,0,0]=4 7241 B12R1.371 CCC(=O)Cn1ccccc1=O 1458a_100000189665_100000210202 [0,2,0,0,0,0|2,0,0]=4 7242 B12R1.371 CCC(=O)Nc1ccccc1Br 11a_100000210017_100000210414 [0,2,0,0,0,0|2,0,0]=4 7243 B12R1.371 CCC(=O)Nc1ccccc1Br 1626a_100000210017_100000210414 [0,2,0,0,0,0|2,0,0]=4 7244 B12R1.371 CCC(=O)Nc1ccccc1C 11a_100015192222_100000210414 [0,2,0,0,0,0|2,0,0]=4 7245 B12R1.371 CCC(=O)Nc1ccccc1C 1626a_100015192222_100000210414 [0,2,0,0,0,0|2,0,0]=4 7246 B12R1.371 CCC(=O)Nc1ccccc1C 22a_100015192222_100000210414 [0,2,0,0,0,0|2,0,0]=4 7247 B12R1.371 CCC(=O)Nc1ccccc1C 527a_100015192222_100000210414 [0,2,0,0,0,0|2,0,0]=4 7248 B12R1.371 CCC(=O)Nc1ccccc1Cl 11a_100000185783_100000210414 [0,2,0,0,0,0|2,0,0]=4 7249 B12R1.371 CCC(=O)Nc1ccccc1Cl 1626a_100000185783_100000210414 [0,2,0,0,0,0|2,0,0]=4 7250 B12R1.371 CCC(=O)Nc1ccccc1Cl 22a_100000185783_100000210414 [0,2,0,0,0,0|2,0,0]=4 7251 B12R1.371 CCC(=O)Nc1ccccc1Cl 527a_100000185783_100000210414 [0,2,0,0,0,0|2,0,0]=4 7252 B12R1.371 CCC(=O)Nc1ccccc1F 11a_100000210422_100000210414 [0,2,0,0,0,0|2,0,0]=4 7253 B12R1.371 CCC(=O)Nc1ccccc1F 1626a_100000210422_100000210414 [0,2,0,0,0,0|2,0,0]=4 7254 B12R1.371 CCC(=O)Nc1ccccc1F 22a_100000210422_100000210414 [0,2,0,0,0,0|2,0,0]=4 7255 B12R1.371 CCC(=O)Nc1ccccc1F 527a_100000210422_100000210414 [0,2,0,0,0,0|2,0,0]=4 7256 B12R1.371 CCC(=O)Nc1ccccc1I 11a_100000210053_100000210414 [0,2,0,0,0,0|2,0,0]=4 7257 B12R1.371 CCC(=O)Nc1ccccc1I 1626a_100000210053_100000210414 [0,2,0,0,0,0|2,0,0]=4 7258 B12R1.371 CCC(=O)Nc1ccccc1O 22a_100000185747_100000210414 [0,2,0,0,0,0|2,0,0]=4 7259 B12R1.371 CCC(=O)Nc1ccccc1O 271570a_203496583355_100000153536 [0,2,0,0,0,0|2,0,0]=4 7260 B12R1.371 CCC(=O)Nc1ccccc1O 527a_100000185747_100000210414 [0,2,0,0,0,0|2,0,0]=4 7261 B12R1.371 CCN(C)Cc1ccccc1Br 2230a_100000184654_100000210202 [0,2,0,0,0,0|1,0,1]=4 7262 B12R1.371 CCN(C)Cc1ccccc1Br 2230a_100000225621_100000184730 [0,2,0,0,0,0|1,0,1]=4 7263 B12R1.371 CCN(C)Cc1ccccc1Br 269982a_100000184654_100000204670 [0,2,0,0,0,0|1,0,1]=4 7264 B12R1.371 CCN(C)Cc1ccccc1Br 269982a_100000225621_100000184730 [0,2,0,0,0,0|1,0,1]=4 7265 B12R1.371 CCN(C)Cc1ccccc1Br 26a_100000225621_100000181306 [0,2,0,0,0,0|1,0,1]=4 7266 B12R1.371 CCN(C)Cc1ccccc1C 2230a_100000184421_100000210202 [0,2,0,0,0,0|1,0,1]=4 7267 B12R1.371 CCN(C)Cc1ccccc1C 2230a_100000201206_200000210301 [0,2,0,0,0,0|1,0,1]=4 7268 B12R1.371 CCN(C)Cc1ccccc1C 2230a_100000225621_100000211839 [0,2,0,0,0,0|1,0,1]=4 7269 B12R1.371 CCN(C)Cc1ccccc1C 269982a_100000184421_100000204670 [0,2,0,0,0,0|1,0,1]=4 7270 B12R1.371 CCN(C)Cc1ccccc1C 269982a_100000201206_200000210301 [0,2,0,0,0,0|1,0,1]=4 7271 B12R1.371 CCN(C)Cc1ccccc1C 269982a_100000225621_100000211839 [0,2,0,0,0,0|1,0,1]=4 7272 B12R1.371 CCN(C)Cc1ccccc1Cl 2230a_100000184507_100000210202 [0,2,0,0,0,0|1,0,1]=4 7273 B12R1.371 CCN(C)Cc1ccccc1Cl 2230a_100000201176_200000210301 [0,2,0,0,0,0|1,0,1]=4 7274 B12R1.371 CCN(C)Cc1ccccc1Cl 2230a_100000225621_100000187162 [0,2,0,0,0,0|1,0,1]=4 7275 B12R1.371 CCN(C)Cc1ccccc1Cl 269982a_100000184507_100000204670 [0,2,0,0,0,0|1,0,1]=4 7276 B12R1.371 CCN(C)Cc1ccccc1Cl 269982a_100000201176_200000210301 [0,2,0,0,0,0|1,0,1]=4 7277 B12R1.371 CCN(C)Cc1ccccc1Cl 269982a_100000225621_100000187162 [0,2,0,0,0,0|1,0,1]=4 7278 B12R1.371 CCN(C)Cc1ccccc1Cl 26a_100000225621_100000210172 [0,2,0,0,0,0|1,0,1]=4 7279 B12R1.371 CCN(C)Cc1ccccc1F 2230a_100000225621_100000211605 [0,2,0,0,0,0|1,0,1]=4 7280 B12R1.371 CCN(C)Cc1ccccc1F 2230a_100000742528_100000210202 [0,2,0,0,0,0|1,0,1]=4 7281 B12R1.371 CCN(C)Cc1ccccc1F 2230a_100015186831_200000210301 [0,2,0,0,0,0|1,0,1]=4 7282 B12R1.371 CCN(C)Cc1ccccc1F 269982a_100000225621_100000211605 [0,2,0,0,0,0|1,0,1]=4 7283 B12R1.371 CCN(C)Cc1ccccc1F 269982a_100000742528_100000204670 [0,2,0,0,0,0|1,0,1]=4 7284 B12R1.371 CCN(C)Cc1ccccc1F 269982a_100015186831_200000210301 [0,2,0,0,0,0|1,0,1]=4 7285 B12R1.371 CCN(C)Cc1ccccc1F 34a_100000742528_100000210202 [0,2,0,0,0,0|1,0,1]=4 7286 B12R1.371 CCN(C)Cc1ccccc1F 34a_100015186831_200000210301 [0,2,0,0,0,0|1,0,1]=4 7287 B12R1.371 CCN(C)Cc1ccccc1I 2230a_100000225621_100011215278 [0,2,0,0,0,0|1,0,1]=4 7288 B12R1.371 CCN(C)Cc1ccccc1I 269982a_100000225621_100011215278 [0,2,0,0,0,0|1,0,1]=4 7289 B12R1.371 CCN(C)Cc1ccccc1O 2230a_100011223546_200000210301 [0,2,0,0,0,0|1,0,1]=4 7290 B12R1.371 CCN(C)Cc1ccccc1O 2230a_100015189988_100000210202 [0,2,0,0,0,0|1,0,1]=4 7291 B12R1.371 CCN(C)Cc1ccccc1O 269982a_100011223546_200000210301 [0,2,0,0,0,0|1,0,1]=4 7292 B12R1.371 CCN(C)Cc1ccccc1O 269982a_100015189988_100000204670 [0,2,0,0,0,0|1,0,1]=4 7293 B12R1.371 CCN([13CH3])Cc1ccccc1C 2230a_100000201206_200025704644 [0,2,0,0,0,0|1,0,1]=4 7294 B12R1.371 CCN([13CH3])Cc1ccccc1C 269982a_100000201206_200025704644 [0,2,0,0,0,0|1,0,1]=4 7295 B12R1.371 CCN([13CH3])Cc1ccccc1Cl 2230a_100000201176_200025704644 [0,2,0,0,0,0|1,0,1]=4 7296 B12R1.371 CCN([13CH3])Cc1ccccc1Cl 269982a_100000201176_200025704644 [0,2,0,0,0,0|1,0,1]=4 7297 B12R1.371 CCN([13CH3])Cc1ccccc1F 2230a_100015186831_200025704644 [0,2,0,0,0,0|1,0,1]=4 7298 B12R1.371 CCN([13CH3])Cc1ccccc1F 269982a_100015186831_200025704644 [0,2,0,0,0,0|1,0,1]=4 7299 B12R1.371 CCN([13CH3])Cc1ccccc1F 34a_100015186831_200025704644 [0,2,0,0,0,0|1,0,1]=4 7300 B12R1.371 CCN([13CH3])Cc1ccccc1O 2230a_100011223546_200025704644 [0,2,0,0,0,0|1,0,1]=4 7301 B12R1.371 CCN([13CH3])Cc1ccccc1O 269982a_100011223546_200025704644 [0,2,0,0,0,0|1,0,1]=4 7302 B12R1.371 CN(CF)Cc1ccccc1Br 269982a_100000184654_100015361967 [0,2,0,0,0,0|1,0,1]=4 7303 B12R1.371 CN(CF)Cc1ccccc1Cl 269982a_100000184507_100015361967 [0,2,0,0,0,0|1,0,1]=4 7304 B12R1.371 CN(CF)Cc1ccccc1F 269982a_100000742528_100015361967 [0,2,0,0,0,0|1,0,1]=4 7305 B12R1.371 CN(CF)Cc1ccccc1F 34a_100000742528_100015361967 [0,2,0,0,0,0|1,0,1]=4 7306 B12R1.371 CN(CF)Cc1ccccc1O 269982a_100015189988_100015361967 [0,2,0,0,0,0|1,0,1]=4 7307 B12R1.371 CNC(=O)Cc1ccccc1Br 11a_106832991635_100000751119 [0,2,0,0,0,0|1,0,0]=3 7308 B12R1.371 CNC(=O)Cc1ccccc1Br 240690a_100102657272_100000751119 [0,2,0,0,0,0|1,0,0]=3 7309 B12R1.371 CNC(=O)Cc1ccccc1Br 527a_100102657272_100000751119 [0,2,0,0,0,0|1,0,0]=3 7310 B12R1.371 CNC(=O)Cc1ccccc1C 11a_106832991635_100000212180 [0,2,0,0,0,0|1,0,0]=3 7311 B12R1.371 CNC(=O)Cc1ccccc1C 1626a_100102657272_100000212180 [0,2,0,0,0,0|1,0,0]=3 7312 B12R1.371 CNC(=O)Cc1ccccc1C 240690a_100102657272_100000212180 [0,2,0,0,0,0|1,0,0]=3 7313 B12R1.371 CNC(=O)Cc1ccccc1C 527a_100102657272_100000212180 [0,2,0,0,0,0|1,0,0]=3 7314 B12R1.371 CNC(=O)Cc1ccccc1Cl 11a_106832991635_100000183793 [0,2,0,0,0,0|1,0,0]=3 7315 B12R1.371 CNC(=O)Cc1ccccc1Cl 1626a_100102657272_100000183793 [0,2,0,0,0,0|1,0,0]=3 7316 B12R1.371 CNC(=O)Cc1ccccc1Cl 240690a_100102657272_100000183793 [0,2,0,0,0,0|1,0,0]=3 7317 B12R1.371 CNC(=O)Cc1ccccc1Cl 527a_100102657272_100000183793 [0,2,0,0,0,0|1,0,0]=3 7318 B12R1.371 CNC(=O)Cc1ccccc1F 11a_106832991635_100000212012 [0,2,0,0,0,0|1,0,0]=3 7319 B12R1.371 CNC(=O)Cc1ccccc1F 1626a_100102657272_100000212012 [0,2,0,0,0,0|1,0,0]=3 7320 B12R1.371 CNC(=O)Cc1ccccc1F 240690a_100102657272_100000212012 [0,2,0,0,0,0|1,0,0]=3 7321 B12R1.371 CNC(=O)Cc1ccccc1F 527a_100102657272_100000212012 [0,2,0,0,0,0|1,0,0]=3 7322 B12R1.371 CNC(=O)Cc1ccccc1I 11a_106832991635_100000036491 [0,2,0,0,0,0|1,0,0]=3 7323 B12R1.371 CNC(=O)Cc1ccccc1I 1626a_100102657272_100000036491 [0,2,0,0,0,0|1,0,0]=3 7324 B12R1.371 CNC(=O)Cc1ccccc1I 240690a_100102657272_100000036491 [0,2,0,0,0,0|1,0,0]=3 7325 B12R1.371 CNC(=O)Cc1ccccc1I 527a_100102657272_100000036491 [0,2,0,0,0,0|1,0,0]=3 7326 B12R1.371 CNC(=O)Cc1ccccc1O 240690a_100102657272_100000743006 [0,2,0,0,0,0|1,0,0]=3 7327 B12R1.371 CNC(=O)Cc1ccccc1O 271570a_203496583355_200009816160 [0,2,0,0,0,0|1,0,0]=3 7328 B12R1.371 CNC(=O)Cc1ccccc1O 527a_100102657272_100000743006 [0,2,0,0,0,0|1,0,0]=3 7329 B12R1.371 CNC(=O)Cc1cccnc1Cl 11a_106832991635_100000093521 [0,2,0,0,0,0|2,0,0]=4 7330 B12R1.371 CNC(=O)Cc1cccnc1Cl 1626a_100102657272_100000093521 [0,2,0,0,0,0|2,0,0]=4 7331 B12R1.371 CNC(=O)Cc1cccnc1Cl 240690a_100102657272_100000093521 [0,2,0,0,0,0|2,0,0]=4 7332 B12R1.371 CNC(=O)Cc1cccnc1Cl 527a_100102657272_100000093521 [0,2,0,0,0,0|2,0,0]=4 7333 B12R1.371 CNC(=O)Cc1ncccc1Br 11a_106832991635_200012357574 [0,2,0,0,0,0|2,0,0]=4 7334 B12R1.371 CNC(=O)Cc1ncccc1Br 240690a_100102657272_200012357574 [0,2,0,0,0,0|2,0,0]=4 7335 B12R1.371 CNC(=O)Cc1ncccc1C 11a_106832991635_200000722269 [0,2,0,0,0,0|2,0,0]=4 7336 B12R1.371 CNC(=O)Cc1ncccc1C 1626a_100102657272_200000722269 [0,2,0,0,0,0|2,0,0]=4 7337 B12R1.371 CNC(=O)Cc1ncccc1C 240690a_100102657272_200000722269 [0,2,0,0,0,0|2,0,0]=4 7338 B12R1.371 CNC(=O)Cc1ncccc1Cl 11a_106832991635_100011998755 [0,2,0,0,0,0|2,0,0]=4 7339 B12R1.371 CNC(=O)Cc1ncccc1Cl 240690a_100102657272_100011998755 [0,2,0,0,0,0|2,0,0]=4 7340 B12R1.371 CNC(=O)Cc1ncccc1Cl 527a_100102657272_100011998755 [0,2,0,0,0,0|2,0,0]=4 7341 B12R1.371 CNC(=O)Cn1ccccc1=O 1626a_100102657272_100000189665 [0,2,0,0,0,0|2,0,0]=4 7342 B12R1.371 CNC(=O)Cn1ccccc1=O 240690a_100102657272_100000189665 [0,2,0,0,0,0|2,0,0]=4 7343 B12R1.371 CNC(=O)Cn1ccccc1=O 527a_100102657272_100000189665 [0,2,0,0,0,0|2,0,0]=4 7344 B12R1.371 CNC(=O)Nc1ccccc1Br 2430a_100000210017_100102657272 [0,2,0,0,0,0|2,0,0]=4 7345 B12R1.371 CNC(=O)Nc1ccccc1C 2430a_100015192222_100102657272 [0,2,0,0,0,0|2,0,0]=4 7346 B12R1.371 CNC(=O)Nc1ccccc1Cl 2430a_100000185783_100102657272 [0,2,0,0,0,0|2,0,0]=4 7347 B12R1.371 CNC(=O)Nc1ccccc1F 2430a_100000210422_100102657272 [0,2,0,0,0,0|2,0,0]=4 7348 B12R1.371 CNC(=O)Nc1ccccc1I 2430a_100000210053_100102657272 [0,2,0,0,0,0|2,0,0]=4 7349 B12R1.371 CNC(=O)Nc1ccccc1O 2430a_100000185747_100102657272 [0,2,0,0,0,0|2,0,0]=4 7350 B12R1.371 CNC(C)Cc1ccccc1Br 270004a_106832991635_100011350739 [0,2,0,0,0,0|0,0,2]=4 7351 B12R1.371 CNC(C)Cc1ccccc1C 270004a_106832991635_200000764500 [0,2,0,0,0,0|0,0,2]=4 7352 B12R1.371 CNC(C)Cc1ccccc1Cl 270004a_106832991635_100000758791 [0,2,0,0,0,0|0,0,2]=4 7353 B12R1.371 CNC(C)Cc1ccccc1F 270004a_106832991635_100000709178 [0,2,0,0,0,0|0,0,2]=4 7354 B12R1.371 COC(=O)Cc1ccccc1O 271570a_203496583355_100000699816 [0,2,0,0,0,0|1,0,0]=3 7355 B12R1.371 COC(=O)Cc1cccnc1O 271570a_203496583355_100010293180 [0,2,0,0,0,0|2,0,0]=4 7356 B12R1.371 COC(=O)Cc1ncccc1O 271570a_203496583355_100012347948 [0,2,0,0,0,0|2,0,0]=4 7357 B12R1.371 COC(=O)Nc1ccccc1O 271570a_203496583355_100000216184 [0,2,0,0,0,0|2,0,0]=4 7358 B12R1.371 Cc1ccccc1CC(=O)CF 1458a_100000212180_100015361967 [0,2,0,0,0,0|1,0,0]=3 7359 B12R1.371 Cc1ccccc1CC(=O)CO 1458a_100000210174_100000211839 [0,2,0,0,0,0|1,0,0]=3 7360 B12R1.371 Cc1ccccc1CN(C)CF 269982a_100000184421_100015361967 [0,2,0,0,0,0|1,0,1]=4 7361 B12R1.371 Cc1ccccc1NC(=O)CO 22a_100015192222_100000210174 [0,2,0,0,0,0|2,0,0]=4 7362 B12R1.371 Cc1ccccc1NC(=O)CO 527a_100015192222_100000210174 [0,2,0,0,0,0|2,0,0]=4 7363 B12R1.371 Cc1cccnc1CC(=O)CF 1458a_200000722269_100015361967 [0,2,0,0,0,0|2,0,0]=4 7364 B12R1.371 Cc1cccnc1CC(=O)CO 1458a_100000210174_100000696600 [0,2,0,0,0,0|2,0,0]=4 7365 B12R1.371 Cc1ccncc1CC(=O)CO 1458a_100000210174_100000690890 [0,2,0,0,0,0|2,0,0]=4 7366 B12R1.371 Cc1cnccc1CC(=O)CO 1458a_100000210174_100020672808 [0,2,0,0,0,0|2,0,0]=4 7367 B12R1.371 Cc1ncccc1CC(=O)CO 1458a_100000210174_100000732876 [0,2,0,0,0,0|2,0,0]=4 7368 B12R1.371 NNC(=O)Cc1ccccc1O 271570a_203496583355_200010210069 [0,2,0,0,0,0|2,0,0]=4 7369 B12R1.371 O=C(CF)Cc1ccccc1Br 1458a_100000751119_100015361967 [0,2,0,0,0,0|1,0,0]=3 7370 B12R1.371 O=C(CF)Cc1ccccc1Cl 1458a_100000183793_100015361967 [0,2,0,0,0,0|1,0,0]=3 7371 B12R1.371 O=C(CF)Cc1ccccc1F 1458a_100000212012_100015361967 [0,2,0,0,0,0|1,0,0]=3 7372 B12R1.371 O=C(CF)Cc1ccccc1I 1458a_100000036491_100015361967 [0,2,0,0,0,0|1,0,0]=3 7373 B12R1.371 O=C(CF)Cc1ccccc1O 1458a_100000743006_100015361967 [0,2,0,0,0,0|1,0,0]=3 7374 B12R1.371 O=C(CF)Cc1cccnc1Cl 1458a_100000093521_100015361967 [0,2,0,0,0,0|2,0,0]=4 7375 B12R1.371 O=C(CF)Cc1ncccc1Br 1458a_200012357574_100015361967 [0,2,0,0,0,0|2,0,0]=4 7376 B12R1.371 O=C(CF)Cc1ncccc1Cl 1458a_100011998755_100015361967 [0,2,0,0,0,0|2,0,0]=4 7377 B12R1.371 O=C(CF)Cn1ccccc1=O 1458a_100000189665_100015361967 [0,2,0,0,0,0|2,0,0]=4 7378 B12R1.371 O=C(CO)Cc1ccccc1Br 1458a_100000210174_100000184730 [0,2,0,0,0,0|1,0,0]=3 7379 B12R1.371 O=C(CO)Cc1ccccc1Cl 1458a_100000210174_100000187162 [0,2,0,0,0,0|1,0,0]=3 7380 B12R1.371 O=C(CO)Cc1ccccc1F 1458a_100000210174_100000187165 [0,2,0,0,0,0|1,0,0]=3 7381 B12R1.371 O=C(CO)Cc1ccccc1I 1458a_100000210174_100011216222 [0,2,0,0,0,0|1,0,0]=3 7382 B12R1.371 O=C(CO)Cc1cccnc1Br 1458a_100000210174_100010140945 [0,2,0,0,0,0|2,0,0]=4 7383 B12R1.371 O=C(CO)Cc1cccnc1Cl 1458a_100000210174_100000045678 [0,2,0,0,0,0|2,0,0]=4 7384 B12R1.371 O=C(CO)Cc1cccnc1F 1458a_100000210174_100000099810 [0,2,0,0,0,0|2,0,0]=4 7385 B12R1.371 O=C(CO)Cc1ccncc1Cl 1458a_100000210174_100000763264 [0,2,0,0,0,0|2,0,0]=4 7386 B12R1.371 O=C(CO)Cc1ncccc1Br 1458a_100000210174_100025702911 [0,2,0,0,0,0|2,0,0]=4 7387 B12R1.371 O=C(CO)Cc1ncccc1Cl 1458a_100000210174_100000099807 [0,2,0,0,0,0|2,0,0]=4 7388 B12R1.371 O=C(CO)Cc1ncccc1F 1458a_100000210174_100000104219 [0,2,0,0,0,0|2,0,0]=4 7389 B12R1.371 O=C(CO)Cc1ncccc1O 1458a_100000210174_200020655725 [0,2,0,0,0,0|2,0,0]=4 7390 B12R1.371 O=C(CO)Nc1ccccc1Cl 22a_100000185783_100000210174 [0,2,0,0,0,0|2,0,0]=4 7391 B12R1.371 O=C(CO)Nc1ccccc1Cl 527a_100000185783_100000210174 [0,2,0,0,0,0|2,0,0]=4 7392 B12R1.371 O=C(CO)Nc1ccccc1F 22a_100000210422_100000210174 [0,2,0,0,0,0|2,0,0]=4 7393 B12R1.371 O=C(CO)Nc1ccccc1F 527a_100000210422_100000210174 [0,2,0,0,0,0|2,0,0]=4 7394 B12R1.371 O=C(CO)Nc1ccccc1O 22a_100000185747_100000210174 [0,2,0,0,0,0|2,0,0]=4 7395 B12R1.371 O=C(CO)Nc1ccccc1O 527a_100000185747_100000210174 [0,2,0,0,0,0|2,0,0]=4 7396 B12R1.75 C#Cc1ccccc1NC(=O)C 11a_100011470550_100015343762 [0,2,0,0,0,0|2,0,0]=4 7397 B12R1.75 C#Cc1ccccc1NC(=O)C 1626a_100011470550_100015343762 [0,2,0,0,0,0|2,0,0]=4 7398 B12R1.75 C#Cc1ccccc1NC(=O)C 22a_100011470550_100000070787 [0,2,0,0,0,0|2,0,0]=4 7399 B12R1.75 C=Cc1ccccc1CC(=O)C 271570a_100011290941_100011350739 [0,2,0,0,0,0|1,0,0]=3 7400 B12R1.75 C=Cc1ccccc1CC(=O)N 271570a_100011290941_200009814924 [0,2,0,0,0,0|2,0,0]=4 7401 B12R1.75 C=Cc1ccccc1CN(C)C 271570a_100011290941_100000174758 [0,2,0,0,0,0|1,0,1]=4 7402 B12R1.75 C=Cc1ccccc1NC(=O)C 11a_100012022501_100015343762 [0,2,0,0,0,0|2,0,0]=4 7403 B12R1.75 C=Cc1ccccc1NC(=O)C 1626a_100012022501_100015343762 [0,2,0,0,0,0|2,0,0]=4 7404 B12R1.75 C=Cc1ccccc1NC(=O)C 22a_100012022501_100000070787 [0,2,0,0,0,0|2,0,0]=4 7405 B12R1.75 C=Cc1ccccc1NC(=O)C 271570a_100011290941_100000153524 [0,2,0,0,0,0|2,0,0]=4 7406 B12R1.75 C=Cc1ccccc1OC(=O)C 271570a_100011290941_100000051690 [0,2,0,0,0,0|2,0,0]=4 7407 B12R1.75 CC(=Cc1ccccc1C#N)C 271570a_100102525489_100000188569 [0,2,0,0,0,0|0,0,2]=4 7408 B12R1.75 CC(=Cc1ccccc1C=O)C 271570a_100102525489_100000211189 [0,2,0,0,0,0|0,0,2]=4 7409 B12R1.75 CC(=Cc1ccccc1CN)C 271570a_100102525489_100000689332 [0,2,0,0,0,0|0,0,2]=4 7410 B12R1.75 CC(=Cc1ccccc1CO)C 271570a_100102525489_100000187465 [0,2,0,0,0,0|0,0,2]=4 7411 B12R1.75 CC(=Cc1ccccc1NN)C 271570a_100102525489_100000241748 [0,2,0,0,0,0|0,0,2]=4 7412 B12R1.75 CC(=O)Cc1ccccc1C#N 1458a_100000070787_100000181865 [0,2,0,0,0,0|1,0,0]=3 7413 B12R1.75 CC(=O)Cc1ccccc1C#N 1458a_100000238613_200000210301 [0,2,0,0,0,0|1,0,0]=3 7414 B12R1.75 CC(=O)Cc1ccccc1C=O 1458a_100000070787_200009853537 [0,2,0,0,0,0|1,0,0]=3 7415 B12R1.75 CC(=O)Cc1ccccc1CO 1458a_100000070787_100009816955 [0,2,0,0,0,0|1,0,0]=3 7416 B12R1.75 CC(=O)Cc1ccccc1S[13CH3] 62a_100011350739_200025704644 [0,2,0,0,0,0|1,0,0]=3 7417 B12R1.75 CC(=O)Cc1ccccc1S[13CH3] 62a_200025704644_100011350739 [0,2,0,0,0,0|1,0,0]=3 7418 B12R1.75 CC(=O)Cc1cccnc1C#N 1458a_100000070787_100011768898 [0,2,0,0,0,0|2,0,0]=4 7419 B12R1.75 CC(=O)Cc1ncccc1C#N 1458a_100000070787_100000099805 [0,2,0,0,0,0|2,0,0]=4 7420 B12R1.75 CC(=O)Nc1ccccc1C#N 11a_100000211148_100015343762 [0,2,0,0,0,0|2,0,0]=4 7421 B12R1.75 CC(=O)Nc1ccccc1C#N 1626a_100000211148_100015343762 [0,2,0,0,0,0|2,0,0]=4 7422 B12R1.75 CC(=O)Nc1ccccc1CO 22a_100000212039_100000070787 [0,2,0,0,0,0|2,0,0]=4 7423 B12R1.75 CC(=O)Nc1ccccc1N[13CH3] 34a_100011193560_200025704644 [0,2,0,0,0,0|2,0,0]=4 7424 B12R1.75 CC(=O)Nc1ccccc1O[13CH3] 34a_100000185124_200025704644 [0,2,0,0,0,0|2,0,0]=4 7425 B12R1.75 CC(=O)Nc1ccccc1O[13CH3] 7a_100000185124_200025704644 [0,2,0,0,0,0|2,0,0]=4 7426 B12R1.75 CC(=O)Nc1ccccc1S[13CH3] 62a_200025704644_100000153524 [0,2,0,0,0,0|2,0,0]=4 7427 B12R1.75 CC(=O)Oc1ccccc1S[13CH3] 62a_100000051690_200025704644 [0,2,0,0,0,0|2,0,0]=4 7428 B12R1.75 CC(=O)Oc1ccccc1S[13CH3] 62a_200025704644_100000051690 [0,2,0,0,0,0|2,0,0]=4 7429 B12R1.75 CCc1ccccc1C=C(C)C 271570a_100102525489_100011215823 [0,2,0,0,0,0|0,0,2]=4 7430 B12R1.75 CCc1ccccc1CN(C)C 270004a_100102631434_100011219594 [0,2,0,0,0,0|1,0,1]=4 7431 B12R1.75 CCc1ccccc1NC(=O)C 11a_100000212081_100015343762 [0,2,0,0,0,0|2,0,0]=4 7432 B12R1.75 CCc1ccccc1NC(=O)C 1626a_100000212081_100015343762 [0,2,0,0,0,0|2,0,0]=4 7433 B12R1.75 CCc1ccccc1NC(=O)C 22a_100000212081_100000070787 [0,2,0,0,0,0|2,0,0]=4 7434 B12R1.75 CCc1ccccc1NC(=O)C 527a_100000212081_100103153847 [0,2,0,0,0,0|2,0,0]=4 7435 B12R1.75 CN(C)Cc1ccccc1C#N 2230a_100000225633_200000210301 [0,2,0,0,0,0|1,0,1]=4 7436 B12R1.75 CN(C)Cc1ccccc1C#N 2230a_100102631434_100000181865 [0,2,0,0,0,0|1,0,1]=4 7437 B12R1.75 CN(C)Cc1ccccc1C#N 269982a_100000225633_200000210301 [0,2,0,0,0,0|1,0,1]=4 7438 B12R1.75 CN(C)Cc1ccccc1C#N 269982a_100102631434_100000181865 [0,2,0,0,0,0|1,0,1]=4 7439 B12R1.75 CN(C)Cc1ccccc1C=O 2230a_100102631434_200009853537 [0,2,0,0,0,0|1,0,1]=4 7440 B12R1.75 CN(C)Cc1ccccc1C=O 269982a_100102631434_200009853537 [0,2,0,0,0,0|1,0,1]=4 7441 B12R1.75 CN(C)Cc1ccccc1CO 2230a_100000044721_200000210301 [0,2,0,0,0,0|1,0,1]=4 7442 B12R1.75 CN(C)Cc1ccccc1CO 2230a_100102631434_100009816955 [0,2,0,0,0,0|1,0,1]=4 7443 B12R1.75 CN(C)Cc1ccccc1CO 269982a_100000044721_200000210301 [0,2,0,0,0,0|1,0,1]=4 7444 B12R1.75 CN(C)Cc1ccccc1CO 269982a_100102631434_100009816955 [0,2,0,0,0,0|1,0,1]=4 7445 B12R1.75 CN(C)Cc1ccccc1S[13CH3] 62a_100000174758_200025704644 [0,2,0,0,0,0|1,0,1]=4 7446 B12R1.75 CN(C)Cc1ccccc1S[13CH3] 62a_200025704644_100000174758 [0,2,0,0,0,0|1,0,1]=4 7447 B12R1.75 CN([13CH3])Cc1ccccc1C#N 2230a_100000225633_200025704644 [0,2,0,0,0,0|1,0,1]=4 7448 B12R1.75 CN([13CH3])Cc1ccccc1C#N 269982a_100000225633_200025704644 [0,2,0,0,0,0|1,0,1]=4 7449 B12R1.75 CN([13CH3])Cc1ccccc1CO 2230a_100000044721_200025704644 [0,2,0,0,0,0|1,0,1]=4 7450 B12R1.75 CN([13CH3])Cc1ccccc1CO 269982a_100000044721_200025704644 [0,2,0,0,0,0|1,0,1]=4 7451 B12R1.75 CNc1ccccc1C=C(C)C 271570a_100102525489_100020606079 [0,2,0,0,0,0|0,0,2]=4 7452 B12R1.75 CNc1ccccc1NC(=O)C 34a_100011193560_200000210301 [0,2,0,0,0,0|2,0,0]=4 7453 B12R1.75 COc1ccccc1C=C(C)C 271570a_100102525489_100000174000 [0,2,0,0,0,0|0,0,2]=4 7454 B12R1.75 COc1ccccc1CC(=O)C 1458a_100000070787_100000210004 [0,2,0,0,0,0|1,0,0]=3 7455 B12R1.75 COc1ccccc1CC(=O)C 1458a_100000211604_200000210301 [0,2,0,0,0,0|1,0,0]=3 7456 B12R1.75 COc1ccccc1CC(=O)[13CH3] 1458a_100000211604_200025704644 [0,2,0,0,0,0|1,0,0]=3 7457 B12R1.75 COc1ccccc1CN(C)C 2230a_100000184376_200000210301 [0,2,0,0,0,0|1,0,1]=4 7458 B12R1.75 COc1ccccc1CN(C)C 2230a_100102631434_100000210004 [0,2,0,0,0,0|1,0,1]=4 7459 B12R1.75 COc1ccccc1CN(C)C 269982a_100000184376_200000210301 [0,2,0,0,0,0|1,0,1]=4 7460 B12R1.75 COc1ccccc1CN(C)C 269982a_100102631434_100000210004 [0,2,0,0,0,0|1,0,1]=4 7461 B12R1.75 COc1ccccc1CN(C)C 270004a_100102631434_100000169842 [0,2,0,0,0,0|1,0,1]=4 7462 B12R1.75 COc1ccccc1CN(C)[13CH3] 2230a_100000184376_200025704644 [0,2,0,0,0,0|1,0,1]=4 7463 B12R1.75 COc1ccccc1CN(C)[13CH3] 269982a_100000184376_200025704644 [0,2,0,0,0,0|1,0,1]=4 7464 B12R1.75 COc1ccccc1NC(=O)C 11a_100000210025_100015343762 [0,2,0,0,0,0|2,0,0]=4 7465 B12R1.75 COc1ccccc1NC(=O)C 1626a_100000210025_100015343762 [0,2,0,0,0,0|2,0,0]=4 7466 B12R1.75 COc1ccccc1NC(=O)C 22a_100000210025_100000070787 [0,2,0,0,0,0|2,0,0]=4 7467 B12R1.75 COc1ccccc1NC(=O)C 34a_100000185124_200000210301 [0,2,0,0,0,0|2,0,0]=4 7468 B12R1.75 COc1ccccc1NC(=O)C 527a_100000210025_100103153847 [0,2,0,0,0,0|2,0,0]=4 7469 B12R1.75 COc1ccccc1NC(=O)C 7a_100000185124_200000210301 [0,2,0,0,0,0|2,0,0]=4 7470 B12R1.75 COc1cnccc1CC(=O)C 1458a_100000070787_100020635607 [0,2,0,0,0,0|2,0,0]=4 7471 B12R1.75 COc1ncccc1CC(=O)C 1458a_100000070787_100020631285 [0,2,0,0,0,0|2,0,0]=4 7472 B12R1.75 CSc1ccccc1C=C(C)C 271570a_100102525489_100011217816 [0,2,0,0,0,0|0,0,2]=4 7473 B12R1.75 CSc1ccccc1CC(=O)C 1458a_100000070787_100000699184 [0,2,0,0,0,0|1,0,0]=3 7474 B12R1.75 CSc1ccccc1CC(=O)C 62a_100011350739_200000210301 [0,2,0,0,0,0|1,0,0]=3 7475 B12R1.75 CSc1ccccc1CC(=O)C 62a_200000210301_100011350739 [0,2,0,0,0,0|1,0,0]=3 7476 B12R1.75 CSc1ccccc1CC(=O)N 62a_200000210301_200009814924 [0,2,0,0,0,0|2,0,0]=4 7477 B12R1.75 CSc1ccccc1CC(=O)N 62a_200009814924_200000210301 [0,2,0,0,0,0|2,0,0]=4 7478 B12R1.75 CSc1ccccc1CN(C)C 2230a_100102631434_100000699184 [0,2,0,0,0,0|1,0,1]=4 7479 B12R1.75 CSc1ccccc1CN(C)C 269982a_100102631434_100000699184 [0,2,0,0,0,0|1,0,1]=4 7480 B12R1.75 CSc1ccccc1CN(C)C 270004a_100102631434_100011217347 [0,2,0,0,0,0|1,0,1]=4 7481 B12R1.75 CSc1ccccc1CN(C)C 62a_100000174758_200000210301 [0,2,0,0,0,0|1,0,1]=4 7482 B12R1.75 CSc1ccccc1CN(C)C 62a_200000210301_100000174758 [0,2,0,0,0,0|1,0,1]=4 7483 B12R1.75 CSc1ccccc1NC(=O)C 11a_100000211160_100015343762 [0,2,0,0,0,0|2,0,0]=4 7484 B12R1.75 CSc1ccccc1NC(=O)C 22a_100000211160_100000070787 [0,2,0,0,0,0|2,0,0]=4 7485 B12R1.75 CSc1ccccc1NC(=O)C 62a_200000210301_100000153524 [0,2,0,0,0,0|2,0,0]=4 7486 B12R1.75 CSc1ccccc1OC(=O)C 62a_100000051690_200000210301 [0,2,0,0,0,0|2,0,0]=4 7487 B12R1.75 CSc1ccccc1OC(=O)C 62a_200000210301_100000051690 [0,2,0,0,0,0|2,0,0]=4 7488 B12R1.75 [13CH3]C(=O)Cc1ccccc1C#N 1458a_100000238613_200025704644 [0,2,0,0,0,0|1,0,0]=3 7489 B12R1.75 [13CH3]Sc1ccccc1CC(=O)N 62a_200009814924_200025704644 [0,2,0,0,0,0|2,0,0]=4 7490 B12R1.75 [13CH3]Sc1ccccc1CC(=O)N 62a_200025704644_200009814924 [0,2,0,0,0,0|2,0,0]=4 7491 B12R1.127 CC(=Cc1cc(ccc1Br)Br)C 271570a_100102525489_100011483371 [0,2,0,0,0,0|0,0,2]=4 7492 B12R1.127 CC(=Cc1cc(ccc1Br)C)C 271570a_100102525489_100012353751 [0,2,0,0,0,0|0,0,2]=4 7493 B12R1.127 CC(=Cc1cc(ccc1Br)Cl)C 271570a_100102525489_100012339723 [0,2,0,0,0,0|0,0,2]=4 7494 B12R1.127 CC(=Cc1cc(ccc1Br)F)C 271570a_100102525489_100011217576 [0,2,0,0,0,0|0,0,2]=4 7495 B12R1.127 CC(=Cc1cc(ccc1Br)N)C 271570a_100102525489_100000750459 [0,2,0,0,0,0|0,0,2]=4 7496 B12R1.127 CC(=Cc1cc(ccc1Br)O)C 271570a_100102525489_100012339312 [0,2,0,0,0,0|0,0,2]=4 7497 B12R1.127 CC(=Cc1cc(ccc1C)Br)C 271570a_100102525489_100011344865 [0,2,0,0,0,0|0,0,2]=4 7498 B12R1.127 CC(=Cc1cc(ccc1C)C)C 271570a_100102525489_100000210833 [0,2,0,0,0,0|0,0,2]=4 7499 B12R1.127 CC(=Cc1cc(ccc1C)Cl)C 271570a_100102525489_100011263213 [0,2,0,0,0,0|0,0,2]=4 7500 B12R1.127 CC(=Cc1cc(ccc1C)F)C 271570a_100102525489_100011218078 [0,2,0,0,0,0|0,0,2]=4 7501 B12R1.127 CC(=Cc1cc(ccc1C)N)C 271570a_100102525489_100000736455 [0,2,0,0,0,0|0,0,2]=4 7502 B12R1.127 CC(=Cc1cc(ccc1C)O)C 271570a_100102525489_100011380479 [0,2,0,0,0,0|0,0,2]=4 7503 B12R1.127 CC(=Cc1cc(ccc1Cl)Br)C 271570a_100102525489_100011772130 [0,2,0,0,0,0|0,0,2]=4 7504 B12R1.127 CC(=Cc1cc(ccc1Cl)C)C 271570a_100102525489_100012356289 [0,2,0,0,0,0|0,0,2]=4 7505 B12R1.127 CC(=Cc1cc(ccc1Cl)Cl)C 271570a_100102525489_100000707729 [0,2,0,0,0,0|0,0,2]=4 7506 B12R1.127 CC(=Cc1cc(ccc1Cl)F)C 271570a_100102525489_100011217299 [0,2,0,0,0,0|0,0,2]=4 7507 B12R1.127 CC(=Cc1cc(ccc1Cl)N)C 271570a_100102525489_100012360549 [0,2,0,0,0,0|0,0,2]=4 7508 B12R1.127 CC(=Cc1cc(ccc1Cl)O)C 271570a_100102525489_100000049588 [0,2,0,0,0,0|0,0,2]=4 7509 B12R1.127 CC(=Cc1cc(ccc1F)Br)C 271570a_100102525489_100011217312 [0,2,0,0,0,0|0,0,2]=4 7510 B12R1.127 CC(=Cc1cc(ccc1F)C)C 271570a_100102525489_100000736223 [0,2,0,0,0,0|0,0,2]=4 7511 B12R1.127 CC(=Cc1cc(ccc1F)Cl)C 271570a_100102525489_100011218116 [0,2,0,0,0,0|0,0,2]=4 7512 B12R1.127 CC(=Cc1cc(ccc1F)F)C 271570a_100102525489_100000750033 [0,2,0,0,0,0|0,0,2]=4 7513 B12R1.127 CC(=Cc1cc(ccc1F)N)C 271570a_100102525489_100000760356 [0,2,0,0,0,0|0,0,2]=4 7514 B12R1.127 CC(=Cc1cc(ccc1F)O)C 271570a_100102525489_100000693481 [0,2,0,0,0,0|0,0,2]=4 7515 B12R1.127 CC(=Cc1cc(ccc1N)Br)C 271570a_100102525489_100000187925 [0,2,0,0,0,0|0,0,2]=4 7516 B12R1.127 CC(=Cc1cc(ccc1N)C)C 271570a_100102525489_100000210942 [0,2,0,0,0,0|0,0,2]=4 7517 B12R1.127 CC(=Cc1cc(ccc1N)Cl)C 271570a_100102525489_100000761889 [0,2,0,0,0,0|0,0,2]=4 7518 B12R1.127 CC(=Cc1cc(ccc1N)F)C 271570a_100102525489_100000760547 [0,2,0,0,0,0|0,0,2]=4 7519 B12R1.127 CC(=Cc1cc(ccc1N)N)C 271570a_100102525489_100011534242 [0,2,0,0,0,0|0,0,2]=4 7520 B12R1.127 CC(=Cc1cc(ccc1N)O)C 271570a_100102525489_100012001276 [0,2,0,0,0,0|0,0,2]=4 7521 B12R1.127 CC(=Cc1cc(ccc1O)Br)C 271570a_100102525489_100012355227 [0,2,0,0,0,0|0,0,2]=4 7522 B12R1.127 CC(=Cc1cc(ccc1O)C)C 271570a_100102525489_100000765521 [0,2,0,0,0,0|0,0,2]=4 7523 B12R1.127 CC(=Cc1cc(ccc1O)Cl)C 271570a_100102525489_100011356953 [0,2,0,0,0,0|0,0,2]=4 7524 B12R1.127 CC(=Cc1cc(ccc1O)F)C 271570a_100102525489_100000211999 [0,2,0,0,0,0|0,0,2]=4 7525 B12R1.127 CC(=Cc1cc(ccc1O)N)C 271570a_100102525489_100011534360 [0,2,0,0,0,0|0,0,2]=4 7526 B12R1.127 CC(=Cc1cc(ccc1O)O)C 271570a_100102525489_100009813629 [0,2,0,0,0,0|0,0,2]=4 7527 B12R1.127 CC(=O)Cc1cc(ccc1Br)Br 1458a_100000070787_100011982794 [0,2,0,0,0,0|1,0,0]=3 7528 B12R1.127 CC(=O)Cc1cc(ccc1Br)Br 1458a_100010004897_200000210301 [0,2,0,0,0,0|1,0,0]=3 7529 B12R1.127 CC(=O)Cc1cc(ccc1Br)C 1458a_100010004923_200000210301 [0,2,0,0,0,0|1,0,0]=3 7530 B12R1.127 CC(=O)Cc1cc(ccc1Br)Cl 1458a_100000070787_100000733903 [0,2,0,0,0,0|1,0,0]=3 7531 B12R1.127 CC(=O)Cc1cc(ccc1Br)Cl 1458a_100000690875_200000210301 [0,2,0,0,0,0|1,0,0]=3 7532 B12R1.127 CC(=O)Cc1cc(ccc1Br)F 1458a_100000070787_100000736370 [0,2,0,0,0,0|1,0,0]=3 7533 B12R1.127 CC(=O)Cc1cc(ccc1Br)F 1458a_100000690878_200000210301 [0,2,0,0,0,0|1,0,0]=3 7534 B12R1.127 CC(=O)Cc1cc(ccc1Br)I 1458a_100000070787_100012355412 [0,2,0,0,0,0|1,0,0]=3 7535 B12R1.127 CC(=O)Cc1cc(ccc1C)Br 1458a_100010244045_200000210301 [0,2,0,0,0,0|1,0,0]=3 7536 B12R1.127 CC(=O)Cc1cc(ccc1C)C 1458a_100000070787_100000184699 [0,2,0,0,0,0|1,0,0]=3 7537 B12R1.127 CC(=O)Cc1cc(ccc1C)C 1458a_100000749331_200000210301 [0,2,0,0,0,0|1,0,0]=3 7538 B12R1.127 CC(=O)Cc1cc(ccc1C)Cl 1458a_100000070787_100012186985 [0,2,0,0,0,0|1,0,0]=3 7539 B12R1.127 CC(=O)Cc1cc(ccc1C)F 1458a_100000070787_100000709795 [0,2,0,0,0,0|1,0,0]=3 7540 B12R1.127 CC(=O)Cc1cc(ccc1C)F 1458a_100011219217_200000210301 [0,2,0,0,0,0|1,0,0]=3 7541 B12R1.127 CC(=O)Cc1cc(ccc1Cl)Br 1458a_100000070787_100000763347 [0,2,0,0,0,0|1,0,0]=3 7542 B12R1.127 CC(=O)Cc1cc(ccc1Cl)Br 1458a_100011600618_200000210301 [0,2,0,0,0,0|1,0,0]=3 7543 B12R1.127 CC(=O)Cc1cc(ccc1Cl)C 1458a_100000070787_100009871730 [0,2,0,0,0,0|1,0,0]=3 7544 B12R1.127 CC(=O)Cc1cc(ccc1Cl)Cl 1458a_100000070787_100000754809 [0,2,0,0,0,0|1,0,0]=3 7545 B12R1.127 CC(=O)Cc1cc(ccc1Cl)Cl 1458a_100000748246_200000210301 [0,2,0,0,0,0|1,0,0]=3 7546 B12R1.127 CC(=O)Cc1cc(ccc1Cl)F 1458a_100000070787_100000709952 [0,2,0,0,0,0|1,0,0]=3 7547 B12R1.127 CC(=O)Cc1cc(ccc1Cl)F 1458a_100011830335_200000210301 [0,2,0,0,0,0|1,0,0]=3 7548 B12R1.127 CC(=O)Cc1cc(ccc1Cl)I 1458a_100000070787_100010188191 [0,2,0,0,0,0|1,0,0]=3 7549 B12R1.127 CC(=O)Cc1cc(ccc1F)Br 1458a_100000070787_100000736399 [0,2,0,0,0,0|1,0,0]=3 7550 B12R1.127 CC(=O)Cc1cc(ccc1F)Br 1458a_100000690877_200000210301 [0,2,0,0,0,0|1,0,0]=3 7551 B12R1.127 CC(=O)Cc1cc(ccc1F)C 1458a_100000070787_100011260760 [0,2,0,0,0,0|1,0,0]=3 7552 B12R1.127 CC(=O)Cc1cc(ccc1F)C 1458a_100011667363_200000210301 [0,2,0,0,0,0|1,0,0]=3 7553 B12R1.127 CC(=O)Cc1cc(ccc1F)Cl 1458a_100000070787_100000716957 [0,2,0,0,0,0|1,0,0]=3 7554 B12R1.127 CC(=O)Cc1cc(ccc1F)Cl 1458a_100011217548_200000210301 [0,2,0,0,0,0|1,0,0]=3 7555 B12R1.127 CC(=O)Cc1cc(ccc1F)F 1458a_100000070787_100000741279 [0,2,0,0,0,0|1,0,0]=3 7556 B12R1.127 CC(=O)Cc1cc(ccc1F)F 1458a_100000762760_200000210301 [0,2,0,0,0,0|1,0,0]=3 7557 B12R1.127 CC(=O)Cc1cc(ccc1F)I 1458a_100000070787_200010149601 [0,2,0,0,0,0|1,0,0]=3 7558 B12R1.127 CC(=O)Cc1cc(ccc1I)Br 1458a_100000070787_100012362523 [0,2,0,0,0,0|1,0,0]=3 7559 B12R1.127 CC(=O)Cc1cc(ccc1I)Cl 1458a_100000070787_100012348826 [0,2,0,0,0,0|1,0,0]=3 7560 B12R1.127 CC(=O)Cc1cc(ccc1I)F 1458a_100000070787_100010149606 [0,2,0,0,0,0|1,0,0]=3 7561 B12R1.127 CC(=O)Cc1cc(ccc1O)Br 1458a_100010072483_200000210301 [0,2,0,0,0,0|1,0,0]=3 7562 B12R1.127 CC(=O)Cc1cc(ccc1O)F 1458a_100000070787_100010161318 [0,2,0,0,0,0|1,0,0]=3 7563 B12R1.127 CC(=O)Cc1cc(ccc1O)O 1458a_100000038496_200000210301 [0,2,0,0,0,0|1,0,0]=3 7564 B12R1.127 CC(=O)Cc1cc(ccc1O)O 271570a_203496583355_200010006938 [0,2,0,0,0,0|1,0,0]=3 7565 B12R1.127 CC(=O)Cc1cc(cnc1Br)Br 1458a_100000070787_100010253922 [0,2,0,0,0,0|2,0,0]=4 7566 B12R1.127 CC(=O)Cc1cc(cnc1Cl)Br 1458a_100000070787_100009816982 [0,2,0,0,0,0|2,0,0]=4 7567 B12R1.127 CC(=O)Cc1nc(ccc1Cl)C 1458a_100000070787_200009852033 [0,2,0,0,0,0|2,0,0]=4 7568 B12R1.127 CC(=O)Cc1nc(ccc1Cl)Cl 1458a_100000070787_100000059412 [0,2,0,0,0,0|2,0,0]=4 7569 B12R1.127 CC(=O)Cc1nc(ccc1F)Br 1458a_100000070787_100010065826 [0,2,0,0,0,0|2,0,0]=4 7570 B12R1.127 CC(=O)Cc1nc(ccc1F)Cl 1458a_100000070787_100009881012 [0,2,0,0,0,0|2,0,0]=4 7571 B12R1.127 CC(=O)Cc1nc(ccc1O)C 1458a_100000070787_100020630696 [0,2,0,0,0,0|2,0,0]=4 7572 B12R1.127 CC(=O)Cn1cc(ccc1=O)Br 1458a_200000738489_200000210301 [0,2,0,0,0,0|2,0,0]=4 7573 B12R1.127 CC(=O)Cn1cc(ccc1=O)C 1458a_100009850670_200000210301 [0,2,0,0,0,0|2,0,0]=4 7574 B12R1.127 CC(=O)Nc1cc(ccc1Br)Br 11a_100000737762_100015343762 [0,2,0,0,0,0|2,0,0]=4 7575 B12R1.127 CC(=O)Nc1cc(ccc1Br)Br 1626a_100000737762_100015343762 [0,2,0,0,0,0|2,0,0]=4 7576 B12R1.127 CC(=O)Nc1cc(ccc1Br)C 11a_100000745044_100015343762 [0,2,0,0,0,0|2,0,0]=4 7577 B12R1.127 CC(=O)Nc1cc(ccc1Br)C 1626a_100000745044_100015343762 [0,2,0,0,0,0|2,0,0]=4 7578 B12R1.127 CC(=O)Nc1cc(ccc1Br)Cl 11a_100000687073_100015343762 [0,2,0,0,0,0|2,0,0]=4 7579 B12R1.127 CC(=O)Nc1cc(ccc1Br)Cl 1626a_100000687073_100015343762 [0,2,0,0,0,0|2,0,0]=4 7580 B12R1.127 CC(=O)Nc1cc(ccc1Br)F 11a_100000687223_100015343762 [0,2,0,0,0,0|2,0,0]=4 7581 B12R1.127 CC(=O)Nc1cc(ccc1Br)F 1626a_100000687223_100015343762 [0,2,0,0,0,0|2,0,0]=4 7582 B12R1.127 CC(=O)Nc1cc(ccc1Br)I 11a_100000750456_100015343762 [0,2,0,0,0,0|2,0,0]=4 7583 B12R1.127 CC(=O)Nc1cc(ccc1Br)I 1626a_100000750456_100015343762 [0,2,0,0,0,0|2,0,0]=4 7584 B12R1.127 CC(=O)Nc1cc(ccc1Br)O 22a_100011999798_100000070787 [0,2,0,0,0,0|2,0,0]=4 7585 B12R1.127 CC(=O)Nc1cc(ccc1Br)O 527a_100011999798_100103153847 [0,2,0,0,0,0|2,0,0]=4 7586 B12R1.127 CC(=O)Nc1cc(ccc1C)Br 11a_100000741167_100015343762 [0,2,0,0,0,0|2,0,0]=4 7587 B12R1.127 CC(=O)Nc1cc(ccc1C)Br 1626a_100000741167_100015343762 [0,2,0,0,0,0|2,0,0]=4 7588 B12R1.127 CC(=O)Nc1cc(ccc1C)Br 22a_100000741167_100000070787 [0,2,0,0,0,0|2,0,0]=4 7589 B12R1.127 CC(=O)Nc1cc(ccc1C)Br 527a_100000741167_100103153847 [0,2,0,0,0,0|2,0,0]=4 7590 B12R1.127 CC(=O)Nc1cc(ccc1C)C 11a_100000185781_100015343762 [0,2,0,0,0,0|2,0,0]=4 7591 B12R1.127 CC(=O)Nc1cc(ccc1C)C 1626a_100000185781_100015343762 [0,2,0,0,0,0|2,0,0]=4 7592 B12R1.127 CC(=O)Nc1cc(ccc1C)C 22a_100000185781_100000070787 [0,2,0,0,0,0|2,0,0]=4 7593 B12R1.127 CC(=O)Nc1cc(ccc1C)Cl 11a_100000211374_100015343762 [0,2,0,0,0,0|2,0,0]=4 7594 B12R1.127 CC(=O)Nc1cc(ccc1C)Cl 1626a_100000211374_100015343762 [0,2,0,0,0,0|2,0,0]=4 7595 B12R1.127 CC(=O)Nc1cc(ccc1C)Cl 22a_100000211374_100000070787 [0,2,0,0,0,0|2,0,0]=4 7596 B12R1.127 CC(=O)Nc1cc(ccc1C)Cl 527a_100000211374_100103153847 [0,2,0,0,0,0|2,0,0]=4 7597 B12R1.127 CC(=O)Nc1cc(ccc1C)F 11a_100000211107_100015343762 [0,2,0,0,0,0|2,0,0]=4 7598 B12R1.127 CC(=O)Nc1cc(ccc1C)F 1626a_100000211107_100015343762 [0,2,0,0,0,0|2,0,0]=4 7599 B12R1.127 CC(=O)Nc1cc(ccc1C)F 22a_100000211107_100000070787 [0,2,0,0,0,0|2,0,0]=4 7600 B12R1.127 CC(=O)Nc1cc(ccc1C)I 11a_100000761890_100015343762 [0,2,0,0,0,0|2,0,0]=4 7601 B12R1.127 CC(=O)Nc1cc(ccc1C)I 1626a_100000761890_100015343762 [0,2,0,0,0,0|2,0,0]=4 7602 B12R1.127 CC(=O)Nc1cc(ccc1C)I 22a_100000761890_100000070787 [0,2,0,0,0,0|2,0,0]=4 7603 B12R1.127 CC(=O)Nc1cc(ccc1C)I 527a_100000761890_100103153847 [0,2,0,0,0,0|2,0,0]=4 7604 B12R1.127 CC(=O)Nc1cc(ccc1C)O 22a_100011216113_100000070787 [0,2,0,0,0,0|2,0,0]=4 7605 B12R1.127 CC(=O)Nc1cc(ccc1C)O 271570a_203496583355_100011344836 [0,2,0,0,0,0|2,0,0]=4 7606 B12R1.127 CC(=O)Nc1cc(ccc1C)O 527a_100011216113_100103153847 [0,2,0,0,0,0|2,0,0]=4 7607 B12R1.127 CC(=O)Nc1cc(ccc1Cl)Br 11a_100000750497_100015343762 [0,2,0,0,0,0|2,0,0]=4 7608 B12R1.127 CC(=O)Nc1cc(ccc1Cl)Br 1626a_100000750497_100015343762 [0,2,0,0,0,0|2,0,0]=4 7609 B12R1.127 CC(=O)Nc1cc(ccc1Cl)C 11a_100011215360_100015343762 [0,2,0,0,0,0|2,0,0]=4 7610 B12R1.127 CC(=O)Nc1cc(ccc1Cl)C 1626a_100011215360_100015343762 [0,2,0,0,0,0|2,0,0]=4 7611 B12R1.127 CC(=O)Nc1cc(ccc1Cl)C 22a_100011215360_100000070787 [0,2,0,0,0,0|2,0,0]=4 7612 B12R1.127 CC(=O)Nc1cc(ccc1Cl)Cl 11a_100000184485_100015343762 [0,2,0,0,0,0|2,0,0]=4 7613 B12R1.127 CC(=O)Nc1cc(ccc1Cl)Cl 1626a_100000184485_100015343762 [0,2,0,0,0,0|2,0,0]=4 7614 B12R1.127 CC(=O)Nc1cc(ccc1Cl)F 11a_100000751338_100015343762 [0,2,0,0,0,0|2,0,0]=4 7615 B12R1.127 CC(=O)Nc1cc(ccc1Cl)F 1626a_100000751338_100015343762 [0,2,0,0,0,0|2,0,0]=4 7616 B12R1.127 CC(=O)Nc1cc(ccc1Cl)I 11a_200000761891_100015343762 [0,2,0,0,0,0|2,0,0]=4 7617 B12R1.127 CC(=O)Nc1cc(ccc1Cl)I 1626a_200000761891_100015343762 [0,2,0,0,0,0|2,0,0]=4 7618 B12R1.127 CC(=O)Nc1cc(ccc1Cl)O 527a_100011934297_100103153847 [0,2,0,0,0,0|2,0,0]=4 7619 B12R1.127 CC(=O)Nc1cc(ccc1F)Br 11a_100000740924_100015343762 [0,2,0,0,0,0|2,0,0]=4 7620 B12R1.127 CC(=O)Nc1cc(ccc1F)Br 1626a_100000740924_100015343762 [0,2,0,0,0,0|2,0,0]=4 7621 B12R1.127 CC(=O)Nc1cc(ccc1F)Br 22a_100000740924_100000070787 [0,2,0,0,0,0|2,0,0]=4 7622 B12R1.127 CC(=O)Nc1cc(ccc1F)C 11a_100000211285_100015343762 [0,2,0,0,0,0|2,0,0]=4 7623 B12R1.127 CC(=O)Nc1cc(ccc1F)C 1626a_100000211285_100015343762 [0,2,0,0,0,0|2,0,0]=4 7624 B12R1.127 CC(=O)Nc1cc(ccc1F)C 22a_100000211285_100000070787 [0,2,0,0,0,0|2,0,0]=4 7625 B12R1.127 CC(=O)Nc1cc(ccc1F)C 527a_100000211285_100103153847 [0,2,0,0,0,0|2,0,0]=4 7626 B12R1.127 CC(=O)Nc1cc(ccc1F)Cl 11a_100000212115_100015343762 [0,2,0,0,0,0|2,0,0]=4 7627 B12R1.127 CC(=O)Nc1cc(ccc1F)Cl 1626a_100000212115_100015343762 [0,2,0,0,0,0|2,0,0]=4 7628 B12R1.127 CC(=O)Nc1cc(ccc1F)F 11a_100000210742_100015343762 [0,2,0,0,0,0|2,0,0]=4 7629 B12R1.127 CC(=O)Nc1cc(ccc1F)F 1626a_100000210742_100015343762 [0,2,0,0,0,0|2,0,0]=4 7630 B12R1.127 CC(=O)Nc1cc(ccc1F)F 22a_100000210742_100000070787 [0,2,0,0,0,0|2,0,0]=4 7631 B12R1.127 CC(=O)Nc1cc(ccc1F)I 11a_100011464823_100015343762 [0,2,0,0,0,0|2,0,0]=4 7632 B12R1.127 CC(=O)Nc1cc(ccc1F)I 1626a_100011464823_100015343762 [0,2,0,0,0,0|2,0,0]=4 7633 B12R1.127 CC(=O)Nc1cc(ccc1F)O 1626a_100012017239_100015343762 [0,2,0,0,0,0|2,0,0]=4 7634 B12R1.127 CC(=O)Nc1cc(ccc1F)O 22a_100012017239_100000070787 [0,2,0,0,0,0|2,0,0]=4 7635 B12R1.127 CC(=O)Nc1cc(ccc1F)O 271570a_203496583355_200011951791 [0,2,0,0,0,0|2,0,0]=4 7636 B12R1.127 CC(=O)Nc1cc(ccc1F)O 527a_100012017239_100103153847 [0,2,0,0,0,0|2,0,0]=4 7637 B12R1.127 CC(=O)Nc1cc(ccc1I)Br 11a_100000743836_100015343762 [0,2,0,0,0,0|2,0,0]=4 7638 B12R1.127 CC(=O)Nc1cc(ccc1I)Br 1626a_100000743836_100015343762 [0,2,0,0,0,0|2,0,0]=4 7639 B12R1.127 CC(=O)Nc1cc(ccc1I)C 11a_100011216686_100015343762 [0,2,0,0,0,0|2,0,0]=4 7640 B12R1.127 CC(=O)Nc1cc(ccc1I)C 1626a_100011216686_100015343762 [0,2,0,0,0,0|2,0,0]=4 7641 B12R1.127 CC(=O)Nc1cc(ccc1I)Cl 11a_100000761886_100015343762 [0,2,0,0,0,0|2,0,0]=4 7642 B12R1.127 CC(=O)Nc1cc(ccc1I)Cl 1626a_100000761886_100015343762 [0,2,0,0,0,0|2,0,0]=4 7643 B12R1.127 CC(=O)Nc1cc(ccc1I)Cl 22a_100000761886_100000070787 [0,2,0,0,0,0|2,0,0]=4 7644 B12R1.127 CC(=O)Nc1cc(ccc1I)F 11a_100011218093_100015343762 [0,2,0,0,0,0|2,0,0]=4 7645 B12R1.127 CC(=O)Nc1cc(ccc1I)F 1626a_100011218093_100015343762 [0,2,0,0,0,0|2,0,0]=4 7646 B12R1.127 CC(=O)Nc1cc(ccc1O)Br 22a_100000752626_100000070787 [0,2,0,0,0,0|2,0,0]=4 7647 B12R1.127 CC(=O)Nc1cc(ccc1O)Br 527a_100000752626_100103153847 [0,2,0,0,0,0|2,0,0]=4 7648 B12R1.127 CC(=O)Nc1cc(ccc1O)C 22a_100011215204_100000070787 [0,2,0,0,0,0|2,0,0]=4 7649 B12R1.127 CC(=O)Nc1cc(ccc1O)C 271570a_203496583355_100000182586 [0,2,0,0,0,0|2,0,0]=4 7650 B12R1.127 CC(=O)Nc1cc(ccc1O)C 527a_100011215204_100103153847 [0,2,0,0,0,0|2,0,0]=4 7651 B12R1.127 CC(=O)Nc1cc(ccc1O)Cl 22a_100000210500_100000070787 [0,2,0,0,0,0|2,0,0]=4 7652 B12R1.127 CC(=O)Nc1cc(ccc1O)Cl 527a_100000210500_100103153847 [0,2,0,0,0,0|2,0,0]=4 7653 B12R1.127 CC(=O)Nc1cc(ccc1O)F 22a_100000759472_100000070787 [0,2,0,0,0,0|2,0,0]=4 7654 B12R1.127 CC(=O)Nc1cc(ccc1O)F 271570a_203496583355_100012558231 [0,2,0,0,0,0|2,0,0]=4 7655 B12R1.127 CC(=O)Nc1cc(ccc1O)F 527a_100000759472_100103153847 [0,2,0,0,0,0|2,0,0]=4 7656 B12R1.127 CC(=O)Nc1cc(ccc1O)I 22a_100000753495_100000070787 [0,2,0,0,0,0|2,0,0]=4 7657 B12R1.127 CC(=O)Nc1cc(ccc1O)I 527a_100000753495_100103153847 [0,2,0,0,0,0|2,0,0]=4 7658 B12R1.127 CC(=O)Oc1cc(ccc1C)O 271570a_203496583355_100103282185 [0,2,0,0,0,0|2,0,0]=4 7659 B12R1.127 CC(=O)Oc1cc(ccc1O)F 271570a_203496583355_200015685721 [0,2,0,0,0,0|2,0,0]=4 7660 B12R1.127 CN(C)Cc1cc(ccc1Br)Br 2230a_100102631434_100011982794 [0,2,0,0,0,0|1,0,1]=4 7661 B12R1.127 CN(C)Cc1cc(ccc1Br)Br 269982a_100102631434_100011982794 [0,2,0,0,0,0|1,0,1]=4 7662 B12R1.127 CN(C)Cc1cc(ccc1Br)Br 270004a_100102631434_100011266429 [0,2,0,0,0,0|1,0,1]=4 7663 B12R1.127 CN(C)Cc1cc(ccc1Br)Cl 2230a_100000711432_200000210301 [0,2,0,0,0,0|1,0,1]=4 7664 B12R1.127 CN(C)Cc1cc(ccc1Br)Cl 2230a_100102631434_100000733903 [0,2,0,0,0,0|1,0,1]=4 7665 B12R1.127 CN(C)Cc1cc(ccc1Br)Cl 269982a_100000711432_200000210301 [0,2,0,0,0,0|1,0,1]=4 7666 B12R1.127 CN(C)Cc1cc(ccc1Br)Cl 269982a_100102631434_100000733903 [0,2,0,0,0,0|1,0,1]=4 7667 B12R1.127 CN(C)Cc1cc(ccc1Br)Cl 270004a_100102631434_100000746314 [0,2,0,0,0,0|1,0,1]=4 7668 B12R1.127 CN(C)Cc1cc(ccc1Br)F 2230a_100102631434_100000736370 [0,2,0,0,0,0|1,0,1]=4 7669 B12R1.127 CN(C)Cc1cc(ccc1Br)F 269982a_100102631434_100000736370 [0,2,0,0,0,0|1,0,1]=4 7670 B12R1.127 CN(C)Cc1cc(ccc1Br)F 270004a_100102631434_100000766564 [0,2,0,0,0,0|1,0,1]=4 7671 B12R1.127 CN(C)Cc1cc(ccc1Br)I 2230a_100102631434_100012355412 [0,2,0,0,0,0|1,0,1]=4 7672 B12R1.127 CN(C)Cc1cc(ccc1Br)I 269982a_100102631434_100012355412 [0,2,0,0,0,0|1,0,1]=4 7673 B12R1.127 CN(C)Cc1cc(ccc1Cl)Br 2230a_100102631434_100000763347 [0,2,0,0,0,0|1,0,1]=4 7674 B12R1.127 CN(C)Cc1cc(ccc1Cl)Br 269982a_100102631434_100000763347 [0,2,0,0,0,0|1,0,1]=4 7675 B12R1.127 CN(C)Cc1cc(ccc1Cl)Br 270004a_100102631434_100000746309 [0,2,0,0,0,0|1,0,1]=4 7676 B12R1.127 CN(C)Cc1cc(ccc1Cl)Cl 2230a_100102631434_100000756322 [0,2,0,0,0,0|1,0,1]=4 7677 B12R1.127 CN(C)Cc1cc(ccc1Cl)Cl 2230a_106354212996_200000210301 [0,2,0,0,0,0|1,0,1]=4 7678 B12R1.127 CN(C)Cc1cc(ccc1Cl)Cl 269982a_100102631434_100000754809 [0,2,0,0,0,0|1,0,1]=4 7679 B12R1.127 CN(C)Cc1cc(ccc1Cl)Cl 269982a_106354212996_200000210301 [0,2,0,0,0,0|1,0,1]=4 7680 B12R1.127 CN(C)Cc1cc(ccc1Cl)Cl 270004a_100102631434_100000746308 [0,2,0,0,0,0|1,0,1]=4 7681 B12R1.127 CN(C)Cc1cc(ccc1Cl)Cl 34a_106354212996_200000210301 [0,2,0,0,0,0|1,0,1]=4 7682 B12R1.127 CN(C)Cc1cc(ccc1Cl)F 2230a_100102631434_100000709952 [0,2,0,0,0,0|1,0,1]=4 7683 B12R1.127 CN(C)Cc1cc(ccc1Cl)F 269982a_100102631434_100000709952 [0,2,0,0,0,0|1,0,1]=4 7684 B12R1.127 CN(C)Cc1cc(ccc1Cl)F 270004a_100102631434_100011218309 [0,2,0,0,0,0|1,0,1]=4 7685 B12R1.127 CN(C)Cc1cc(ccc1Cl)I 2230a_100102631434_100010188191 [0,2,0,0,0,0|1,0,1]=4 7686 B12R1.127 CN(C)Cc1cc(ccc1Cl)I 269982a_100102631434_100010188191 [0,2,0,0,0,0|1,0,1]=4 7687 B12R1.127 CN(C)Cc1cc(ccc1F)Br 2230a_100000748472_200000210301 [0,2,0,0,0,0|1,0,1]=4 7688 B12R1.127 CN(C)Cc1cc(ccc1F)Br 2230a_100102631434_100000736399 [0,2,0,0,0,0|1,0,1]=4 7689 B12R1.127 CN(C)Cc1cc(ccc1F)Br 269982a_100000748472_200000210301 [0,2,0,0,0,0|1,0,1]=4 7690 B12R1.127 CN(C)Cc1cc(ccc1F)Br 269982a_100102631434_100000736399 [0,2,0,0,0,0|1,0,1]=4 7691 B12R1.127 CN(C)Cc1cc(ccc1F)Br 270004a_100102631434_100000211465 [0,2,0,0,0,0|1,0,1]=4 7692 B12R1.127 CN(C)Cc1cc(ccc1F)Br 34a_100000748472_200000210301 [0,2,0,0,0,0|1,0,1]=4 7693 B12R1.127 CN(C)Cc1cc(ccc1F)Cl 2230a_100102631434_100000716957 [0,2,0,0,0,0|1,0,1]=4 7694 B12R1.127 CN(C)Cc1cc(ccc1F)Cl 269982a_100102631434_100000716957 [0,2,0,0,0,0|1,0,1]=4 7695 B12R1.127 CN(C)Cc1cc(ccc1F)Cl 270004a_100102631434_100000745245 [0,2,0,0,0,0|1,0,1]=4 7696 B12R1.127 CN(C)Cc1cc(ccc1F)F 2230a_100000724026_200000210301 [0,2,0,0,0,0|1,0,1]=4 7697 B12R1.127 CN(C)Cc1cc(ccc1F)F 2230a_100102631434_100000741279 [0,2,0,0,0,0|1,0,1]=4 7698 B12R1.127 CN(C)Cc1cc(ccc1F)F 269982a_100000724026_200000210301 [0,2,0,0,0,0|1,0,1]=4 7699 B12R1.127 CN(C)Cc1cc(ccc1F)F 269982a_100102631434_100000685659 [0,2,0,0,0,0|1,0,1]=4 7700 B12R1.127 CN(C)Cc1cc(ccc1F)F 270004a_100102631434_100000740046 [0,2,0,0,0,0|1,0,1]=4 7701 B12R1.127 CN(C)Cc1cc(ccc1F)F 34a_100000724026_200000210301 [0,2,0,0,0,0|1,0,1]=4 7702 B12R1.127 CN(C)Cc1cc(ccc1F)I 2230a_100102631434_200010149601 [0,2,0,0,0,0|1,0,1]=4 7703 B12R1.127 CN(C)Cc1cc(ccc1F)I 269982a_100102631434_200010149601 [0,2,0,0,0,0|1,0,1]=4 7704 B12R1.127 CN(C)Cc1cc(ccc1F)O 271570a_203496583355_100011597561 [0,2,0,0,0,0|1,0,1]=4 7705 B12R1.127 CN(C)Cc1cc(ccc1I)Br 2230a_100102631434_100012362523 [0,2,0,0,0,0|1,0,1]=4 7706 B12R1.127 CN(C)Cc1cc(ccc1I)Br 269982a_100102631434_100012362523 [0,2,0,0,0,0|1,0,1]=4 7707 B12R1.127 CN(C)Cc1cc(ccc1I)Br 270004a_100102631434_100010185651 [0,2,0,0,0,0|1,0,1]=4 7708 B12R1.127 CN(C)Cc1cc(ccc1I)Cl 2230a_100102631434_100012348826 [0,2,0,0,0,0|1,0,1]=4 7709 B12R1.127 CN(C)Cc1cc(ccc1I)Cl 269982a_100102631434_100012348826 [0,2,0,0,0,0|1,0,1]=4 7710 B12R1.127 CN(C)Cc1cc(ccc1I)Cl 270004a_100102631434_100010254386 [0,2,0,0,0,0|1,0,1]=4 7711 B12R1.127 CN(C)Cc1cc(ccc1I)F 2230a_100102631434_100010149606 [0,2,0,0,0,0|1,0,1]=4 7712 B12R1.127 CN(C)Cc1cc(ccc1I)F 269982a_100102631434_100010149606 [0,2,0,0,0,0|1,0,1]=4 7713 B12R1.127 CN(C)Cc1cc(ccc1I)F 270004a_100102631434_100010186294 [0,2,0,0,0,0|1,0,1]=4 7714 B12R1.127 CN(C)Cc1cc(ccc1O)Br 2230a_100011602694_200000210301 [0,2,0,0,0,0|1,0,1]=4 7715 B12R1.127 CN(C)Cc1cc(ccc1O)Br 269982a_100011602694_200000210301 [0,2,0,0,0,0|1,0,1]=4 7716 B12R1.127 CN(C)Cc1cc(ccc1O)Cl 2230a_100000712467_200000210301 [0,2,0,0,0,0|1,0,1]=4 7717 B12R1.127 CN(C)Cc1cc(ccc1O)Cl 269982a_100000712467_200000210301 [0,2,0,0,0,0|1,0,1]=4 7718 B12R1.127 CN(C)Cc1cc(ccc1O)F 2230a_114855342409_200000210301 [0,2,0,0,0,0|1,0,1]=4 7719 B12R1.127 CN(C)Cc1cc(ccc1O)F 269982a_100102631434_100010161318 [0,2,0,0,0,0|1,0,1]=4 7720 B12R1.127 CN(C)Cc1cc(ccc1O)F 269982a_114855342409_200000210301 [0,2,0,0,0,0|1,0,1]=4 7721 B12R1.127 CN(C)Cc1cc(ccc1O)F 34a_114855342409_200000210301 [0,2,0,0,0,0|1,0,1]=4 7722 B12R1.127 CN(C)Cc1cc(ccc1O)O 271570a_203496583355_100011934597 [0,2,0,0,0,0|1,0,1]=4 7723 B12R1.127 CN([13CH3])Cc1cc(ccc1Br)Cl 2230a_100000711432_200025704644 [0,2,0,0,0,0|1,0,1]=4 7724 B12R1.127 CN([13CH3])Cc1cc(ccc1Br)Cl 269982a_100000711432_200025704644 [0,2,0,0,0,0|1,0,1]=4 7725 B12R1.127 CN([13CH3])Cc1cc(ccc1Cl)Cl 2230a_106354212996_200025704644 [0,2,0,0,0,0|1,0,1]=4 7726 B12R1.127 CN([13CH3])Cc1cc(ccc1Cl)Cl 269982a_106354212996_200025704644 [0,2,0,0,0,0|1,0,1]=4 7727 B12R1.127 CN([13CH3])Cc1cc(ccc1Cl)Cl 34a_106354212996_200025704644 [0,2,0,0,0,0|1,0,1]=4 7728 B12R1.127 CN([13CH3])Cc1cc(ccc1F)Br 2230a_100000748472_200025704644 [0,2,0,0,0,0|1,0,1]=4 7729 B12R1.127 CN([13CH3])Cc1cc(ccc1F)Br 269982a_100000748472_200025704644 [0,2,0,0,0,0|1,0,1]=4 7730 B12R1.127 CN([13CH3])Cc1cc(ccc1F)Br 34a_100000748472_200025704644 [0,2,0,0,0,0|1,0,1]=4 7731 B12R1.127 CN([13CH3])Cc1cc(ccc1F)F 2230a_100000724026_200025704644 [0,2,0,0,0,0|1,0,1]=4 7732 B12R1.127 CN([13CH3])Cc1cc(ccc1F)F 269982a_100000724026_200025704644 [0,2,0,0,0,0|1,0,1]=4 7733 B12R1.127 CN([13CH3])Cc1cc(ccc1F)F 34a_100000724026_200025704644 [0,2,0,0,0,0|1,0,1]=4 7734 B12R1.127 CN([13CH3])Cc1cc(ccc1O)Br 2230a_100011602694_200025704644 [0,2,0,0,0,0|1,0,1]=4 7735 B12R1.127 CN([13CH3])Cc1cc(ccc1O)Br 269982a_100011602694_200025704644 [0,2,0,0,0,0|1,0,1]=4 7736 B12R1.127 CN([13CH3])Cc1cc(ccc1O)Cl 2230a_100000712467_200025704644 [0,2,0,0,0,0|1,0,1]=4 7737 B12R1.127 CN([13CH3])Cc1cc(ccc1O)Cl 269982a_100000712467_200025704644 [0,2,0,0,0,0|1,0,1]=4 7738 B12R1.127 CN([13CH3])Cc1cc(ccc1O)F 2230a_114855342409_200025704644 [0,2,0,0,0,0|1,0,1]=4 7739 B12R1.127 CN([13CH3])Cc1cc(ccc1O)F 269982a_114855342409_200025704644 [0,2,0,0,0,0|1,0,1]=4 7740 B12R1.127 CN([13CH3])Cc1cc(ccc1O)F 34a_114855342409_200025704644 [0,2,0,0,0,0|1,0,1]=4 7741 B12R1.127 Cc1ccc(=O)n(c1)CC(=O)[13CH3] 1458a_100009850670_200025704644 [0,2,0,0,0,0|2,0,0]=4 7742 B12R1.127 Cc1ccc(c(c1)CC(=O)[13CH3])Br 1458a_100010004923_200025704644 [0,2,0,0,0,0|1,0,0]=3 7743 B12R1.127 Cc1ccc(c(c1)CC(=O)[13CH3])C 1458a_100000749331_200025704644 [0,2,0,0,0,0|1,0,0]=3 7744 B12R1.127 Cc1ccc(c(c1)CC(=O)[13CH3])F 1458a_100011667363_200025704644 [0,2,0,0,0,0|1,0,0]=3 7745 B12R1.127 Cc1ccc(c(c1)CN(C)C)Br 270004a_100102631434_100011551863 [0,2,0,0,0,0|1,0,1]=4 7746 B12R1.127 Cc1ccc(c(c1)CN(C)C)C 2230a_100102631434_100000184699 [0,2,0,0,0,0|1,0,1]=4 7747 B12R1.127 Cc1ccc(c(c1)CN(C)C)C 269982a_100102631434_100000184699 [0,2,0,0,0,0|1,0,1]=4 7748 B12R1.127 Cc1ccc(c(c1)CN(C)C)C 270004a_100102631434_100000211343 [0,2,0,0,0,0|1,0,1]=4 7749 B12R1.127 Cc1ccc(c(c1)CN(C)C)Cl 2230a_100102631434_100009871730 [0,2,0,0,0,0|1,0,1]=4 7750 B12R1.127 Cc1ccc(c(c1)CN(C)C)Cl 269982a_100102631434_100009871730 [0,2,0,0,0,0|1,0,1]=4 7751 B12R1.127 Cc1ccc(c(c1)CN(C)C)Cl 270004a_100102631434_100011551332 [0,2,0,0,0,0|1,0,1]=4 7752 B12R1.127 Cc1ccc(c(c1)CN(C)C)F 2230a_100102631434_100011260760 [0,2,0,0,0,0|1,0,1]=4 7753 B12R1.127 Cc1ccc(c(c1)CN(C)C)F 2230a_102515433075_200000210301 [0,2,0,0,0,0|1,0,1]=4 7754 B12R1.127 Cc1ccc(c(c1)CN(C)C)F 269982a_100102631434_100011260760 [0,2,0,0,0,0|1,0,1]=4 7755 B12R1.127 Cc1ccc(c(c1)CN(C)C)F 269982a_102515433075_200000210301 [0,2,0,0,0,0|1,0,1]=4 7756 B12R1.127 Cc1ccc(c(c1)CN(C)C)F 270004a_100102631434_100000756917 [0,2,0,0,0,0|1,0,1]=4 7757 B12R1.127 Cc1ccc(c(c1)CN(C)C)F 34a_102515433075_200000210301 [0,2,0,0,0,0|1,0,1]=4 7758 B12R1.127 Cc1ccc(c(c1)CN(C)C)I 270004a_100102631434_100010150105 [0,2,0,0,0,0|1,0,1]=4 7759 B12R1.127 Cc1ccc(c(c1)CN(C)[13CH3])F 2230a_102515433075_200025704644 [0,2,0,0,0,0|1,0,1]=4 7760 B12R1.127 Cc1ccc(c(c1)CN(C)[13CH3])F 269982a_102515433075_200025704644 [0,2,0,0,0,0|1,0,1]=4 7761 B12R1.127 Cc1ccc(c(c1)CN(C)[13CH3])F 34a_102515433075_200025704644 [0,2,0,0,0,0|1,0,1]=4 7762 B12R1.127 Cc1ccc(cc1CC(=O)[13CH3])Br 1458a_100010244045_200025704644 [0,2,0,0,0,0|1,0,0]=3 7763 B12R1.127 Cc1ccc(cc1CC(=O)[13CH3])F 1458a_100011219217_200025704644 [0,2,0,0,0,0|1,0,0]=3 7764 B12R1.127 Cc1ccc(cc1CN(C)C)Br 2230a_106744473289_200000210301 [0,2,0,0,0,0|1,0,1]=4 7765 B12R1.127 Cc1ccc(cc1CN(C)C)Br 269982a_106744473289_200000210301 [0,2,0,0,0,0|1,0,1]=4 7766 B12R1.127 Cc1ccc(cc1CN(C)C)Br 270004a_100102631434_100011361606 [0,2,0,0,0,0|1,0,1]=4 7767 B12R1.127 Cc1ccc(cc1CN(C)C)Cl 2230a_100102631434_100012186985 [0,2,0,0,0,0|1,0,1]=4 7768 B12R1.127 Cc1ccc(cc1CN(C)C)Cl 269982a_100102631434_100012186985 [0,2,0,0,0,0|1,0,1]=4 7769 B12R1.127 Cc1ccc(cc1CN(C)C)Cl 270004a_100102631434_100011551331 [0,2,0,0,0,0|1,0,1]=4 7770 B12R1.127 Cc1ccc(cc1CN(C)C)F 2230a_100102631434_100000709795 [0,2,0,0,0,0|1,0,1]=4 7771 B12R1.127 Cc1ccc(cc1CN(C)C)F 269982a_100102631434_100000709795 [0,2,0,0,0,0|1,0,1]=4 7772 B12R1.127 Cc1ccc(cc1CN(C)C)F 270004a_100102631434_100000697687 [0,2,0,0,0,0|1,0,1]=4 7773 B12R1.127 Cc1ccc(cc1CN(C)[13CH3])Br 2230a_106744473289_200025704644 [0,2,0,0,0,0|1,0,1]=4 7774 B12R1.127 Cc1ccc(cc1CN(C)[13CH3])Br 269982a_106744473289_200025704644 [0,2,0,0,0,0|1,0,1]=4 7775 B12R1.127 [13CH3]C(=O)Cc1cc(ccc1Br)Br 1458a_100010004897_200025704644 [0,2,0,0,0,0|1,0,0]=3 7776 B12R1.127 [13CH3]C(=O)Cc1cc(ccc1Br)Cl 1458a_100000690875_200025704644 [0,2,0,0,0,0|1,0,0]=3 7777 B12R1.127 [13CH3]C(=O)Cc1cc(ccc1Br)F 1458a_100000690878_200025704644 [0,2,0,0,0,0|1,0,0]=3 7778 B12R1.127 [13CH3]C(=O)Cc1cc(ccc1Cl)Br 1458a_100011600618_200025704644 [0,2,0,0,0,0|1,0,0]=3 7779 B12R1.127 [13CH3]C(=O)Cc1cc(ccc1Cl)Cl 1458a_100000748246_200025704644 [0,2,0,0,0,0|1,0,0]=3 7780 B12R1.127 [13CH3]C(=O)Cc1cc(ccc1Cl)F 1458a_100011830335_200025704644 [0,2,0,0,0,0|1,0,0]=3 7781 B12R1.127 [13CH3]C(=O)Cc1cc(ccc1F)Br 1458a_100000690877_200025704644 [0,2,0,0,0,0|1,0,0]=3 7782 B12R1.127 [13CH3]C(=O)Cc1cc(ccc1F)Cl 1458a_100011217548_200025704644 [0,2,0,0,0,0|1,0,0]=3 7783 B12R1.127 [13CH3]C(=O)Cc1cc(ccc1F)F 1458a_100000762760_200025704644 [0,2,0,0,0,0|1,0,0]=3 7784 B12R1.127 [13CH3]C(=O)Cc1cc(ccc1O)Br 1458a_100010072483_200025704644 [0,2,0,0,0,0|1,0,0]=3 7785 B12R1.127 [13CH3]C(=O)Cc1cc(ccc1O)O 1458a_100000038496_200025704644 [0,2,0,0,0,0|1,0,0]=3 7786 B12R1.127 [13CH3]C(=O)Cn1cc(ccc1=O)Br 1458a_200000738489_200025704644 [0,2,0,0,0,0|2,0,0]=4 7787 B12R1.151 CC(C)(N)Cc1ccccc1O 271570a_203496583355_100161000475 [0,2,0,0,0,0|0,0,2]=4 7788 B12R1.151 CS(=O)(=O)Cc1ccccc1O 271570a_203496583355_100009814642 [0,2,0,0,0,0|2,0,0]=4 7789 B12R1.224 CC(=Cc1cccc(c1Br)O)C 271570a_100102525489_100010187914 [0,2,0,0,0,0|0,0,2]=4 7790 B12R1.224 CC(=Cc1cccc(c1C)Br)C 271570a_100102525489_100012353703 [0,2,0,0,0,0|0,0,2]=4 7791 B12R1.224 CC(=Cc1cccc(c1C)C)C 271570a_100102525489_100011214922 [0,2,0,0,0,0|0,0,2]=4 7792 B12R1.224 CC(=Cc1cccc(c1C)Cl)C 271570a_100102525489_100000726075 [0,2,0,0,0,0|0,0,2]=4 7793 B12R1.224 CC(=Cc1cccc(c1C)F)C 271570a_100102525489_100011216893 [0,2,0,0,0,0|0,0,2]=4 7794 B12R1.224 CC(=Cc1cccc(c1C)N)C 271570a_100102525489_100000761887 [0,2,0,0,0,0|0,0,2]=4 7795 B12R1.224 CC(=Cc1cccc(c1C)O)C 271570a_100102525489_100012002258 [0,2,0,0,0,0|0,0,2]=4 7796 B12R1.224 CC(=Cc1cccc(c1Cl)Br)C 271570a_100102525489_100010142854 [0,2,0,0,0,0|0,0,2]=4 7797 B12R1.224 CC(=Cc1cccc(c1Cl)C)C 271570a_100102525489_200012352035 [0,2,0,0,0,0|0,0,2]=4 7798 B12R1.224 CC(=Cc1cccc(c1Cl)Cl)C 271570a_100102525489_100011215384 [0,2,0,0,0,0|0,0,2]=4 7799 B12R1.224 CC(=Cc1cccc(c1Cl)F)C 271570a_100102525489_200010234923 [0,2,0,0,0,0|0,0,2]=4 7800 B12R1.224 CC(=Cc1cccc(c1Cl)O)C 271570a_100102525489_100000049636 [0,2,0,0,0,0|0,0,2]=4 7801 B12R1.224 CC(=Cc1cccc(c1F)Br)C 271570a_100102525489_100000702267 [0,2,0,0,0,0|0,0,2]=4 7802 B12R1.224 CC(=Cc1cccc(c1F)C)C 271570a_100102525489_100000717567 [0,2,0,0,0,0|0,0,2]=4 7803 B12R1.224 CC(=Cc1cccc(c1F)Cl)C 271570a_100102525489_100011217346 [0,2,0,0,0,0|0,0,2]=4 7804 B12R1.224 CC(=Cc1cccc(c1F)F)C 271570a_100102525489_100000694657 [0,2,0,0,0,0|0,0,2]=4 7805 B12R1.224 CC(=Cc1cccc(c1F)N)C 271570a_100102525489_100011935091 [0,2,0,0,0,0|0,0,2]=4 7806 B12R1.224 CC(=Cc1cccc(c1F)O)C 271570a_100102525489_100009817021 [0,2,0,0,0,0|0,0,2]=4 7807 B12R1.224 CC(=Cc1cccc(c1N)Br)C 271570a_100102525489_100010146558 [0,2,0,0,0,0|0,0,2]=4 7808 B12R1.224 CC(=Cc1cccc(c1N)C)C 271570a_100102525489_100011834072 [0,2,0,0,0,0|0,0,2]=4 7809 B12R1.224 CC(=Cc1cccc(c1N)Cl)C 271570a_100102525489_100010190421 [0,2,0,0,0,0|0,0,2]=4 7810 B12R1.224 CC(=Cc1cccc(c1N)F)C 271570a_100102525489_100000042321 [0,2,0,0,0,0|0,0,2]=4 7811 B12R1.224 CC(=Cc1cccc(c1N)N)C 271570a_100102525489_100015191791 [0,2,0,0,0,0|0,0,2]=4 7812 B12R1.224 CC(=Cc1cccc(c1N)O)C 271570a_100102525489_100011934926 [0,2,0,0,0,0|0,0,2]=4 7813 B12R1.224 CC(=Cc1cccc(c1O)Br)C 271570a_100102525489_100010084509 [0,2,0,0,0,0|0,0,2]=4 7814 B12R1.224 CC(=Cc1cccc(c1O)C)C 271570a_100102525489_100009817157 [0,2,0,0,0,0|0,0,2]=4 7815 B12R1.224 CC(=Cc1cccc(c1O)Cl)C 271570a_100102525489_100010202889 [0,2,0,0,0,0|0,0,2]=4 7816 B12R1.224 CC(=Cc1cccc(c1O)F)C 271570a_100102525489_100009813666 [0,2,0,0,0,0|0,0,2]=4 7817 B12R1.224 CC(=Cc1cccc(c1O)N)C 271570a_100102525489_100011934915 [0,2,0,0,0,0|0,0,2]=4 7818 B12R1.224 CC(=Cc1cccc(c1O)O)C 271570a_100102525489_100009815950 [0,2,0,0,0,0|0,0,2]=4 7819 B12R1.224 CC(=O)Cc1cccc(c1Br)C 1458a_100000070787_200012349612 [0,2,0,0,0,0|1,0,0]=3 7820 B12R1.224 CC(=O)Cc1cccc(c1Br)C 1458a_100010147021_200000210301 [0,2,0,0,0,0|1,0,0]=3 7821 B12R1.224 CC(=O)Cc1cccc(c1Br)Cl 1458a_100000070787_100010145525 [0,2,0,0,0,0|1,0,0]=3 7822 B12R1.224 CC(=O)Cc1cccc(c1Br)Cl 1458a_100010145769_200000210301 [0,2,0,0,0,0|1,0,0]=3 7823 B12R1.224 CC(=O)Cc1cccc(c1Br)F 1458a_100000070787_100012351116 [0,2,0,0,0,0|1,0,0]=3 7824 B12R1.224 CC(=O)Cc1cccc(c1Br)F 1458a_100012356664_200000210301 [0,2,0,0,0,0|1,0,0]=3 7825 B12R1.224 CC(=O)Cc1cccc(c1Br)I 1458a_100000070787_100010254545 [0,2,0,0,0,0|1,0,0]=3 7826 B12R1.224 CC(=O)Cc1cccc(c1C)Br 1458a_100000070787_100000694682 [0,2,0,0,0,0|1,0,0]=3 7827 B12R1.224 CC(=O)Cc1cccc(c1C)C 1458a_100000070787_100011515928 [0,2,0,0,0,0|1,0,0]=3 7828 B12R1.224 CC(=O)Cc1cccc(c1C)C 1458a_100011698479_200000210301 [0,2,0,0,0,0|1,0,0]=3 7829 B12R1.224 CC(=O)Cc1cccc(c1C)Cl 1458a_100000070787_100012186920 [0,2,0,0,0,0|1,0,0]=3 7830 B12R1.224 CC(=O)Cc1cccc(c1C)F 1458a_100000035905_200000210301 [0,2,0,0,0,0|1,0,0]=3 7831 B12R1.224 CC(=O)Cc1cccc(c1C)F 1458a_100000070787_100009813626 [0,2,0,0,0,0|1,0,0]=3 7832 B12R1.224 CC(=O)Cc1cccc(c1C)I 1458a_100000070787_100010150147 [0,2,0,0,0,0|1,0,0]=3 7833 B12R1.224 CC(=O)Cc1cccc(c1Cl)Br 1458a_100000070787_100012349491 [0,2,0,0,0,0|1,0,0]=3 7834 B12R1.224 CC(=O)Cc1cccc(c1Cl)Br 1458a_100010145770_200000210301 [0,2,0,0,0,0|1,0,0]=3 7835 B12R1.224 CC(=O)Cc1cccc(c1Cl)Cl 1458a_100000070787_100000720918 [0,2,0,0,0,0|1,0,0]=3 7836 B12R1.224 CC(=O)Cc1cccc(c1Cl)Cl 1458a_100000759314_200000210301 [0,2,0,0,0,0|1,0,0]=3 7837 B12R1.224 CC(=O)Cc1cccc(c1Cl)F 1458a_100000070787_100000696688 [0,2,0,0,0,0|1,0,0]=3 7838 B12R1.224 CC(=O)Cc1cccc(c1Cl)F 1458a_100012001123_200000210301 [0,2,0,0,0,0|1,0,0]=3 7839 B12R1.224 CC(=O)Cc1cccc(c1F)Br 1458a_100000070787_100012356507 [0,2,0,0,0,0|1,0,0]=3 7840 B12R1.224 CC(=O)Cc1cccc(c1F)Br 1458a_100011935088_200000210301 [0,2,0,0,0,0|1,0,0]=3 7841 B12R1.224 CC(=O)Cc1cccc(c1F)C 1458a_100000070787_100011216058 [0,2,0,0,0,0|1,0,0]=3 7842 B12R1.224 CC(=O)Cc1cccc(c1F)Cl 1458a_100000070787_100000716733 [0,2,0,0,0,0|1,0,0]=3 7843 B12R1.224 CC(=O)Cc1cccc(c1F)Cl 1458a_100000709823_200000210301 [0,2,0,0,0,0|1,0,0]=3 7844 B12R1.224 CC(=O)Cc1cccc(c1F)F 1458a_100000070787_100000217499 [0,2,0,0,0,0|1,0,0]=3 7845 B12R1.224 CC(=O)Cc1cccc(c1F)F 1458a_100000684727_200000210301 [0,2,0,0,0,0|1,0,0]=3 7846 B12R1.224 CC(=O)Cc1cccc(c1I)F 1458a_100000070787_100010149603 [0,2,0,0,0,0|1,0,0]=3 7847 B12R1.224 CC(=O)Cc1nccc(c1C)Cl 1458a_100000070787_100020614443 [0,2,0,0,0,0|2,0,0]=4 7848 B12R1.224 CC(=O)Cn1cccc(c1=O)C 1458a_100000697016_200000210301 [0,2,0,0,0,0|2,0,0]=4 7849 B12R1.224 CC(=O)Nc1cccc(c1Br)C 11a_100000684715_100015343762 [0,2,0,0,0,0|2,0,0]=4 7850 B12R1.224 CC(=O)Nc1cccc(c1Br)C 1626a_100000684715_100015343762 [0,2,0,0,0,0|2,0,0]=4 7851 B12R1.224 CC(=O)Nc1cccc(c1Br)C 22a_100000684715_100000070787 [0,2,0,0,0,0|2,0,0]=4 7852 B12R1.224 CC(=O)Nc1cccc(c1Br)Cl 11a_100000687072_100015343762 [0,2,0,0,0,0|2,0,0]=4 7853 B12R1.224 CC(=O)Nc1cccc(c1Br)Cl 1626a_100000687072_100015343762 [0,2,0,0,0,0|2,0,0]=4 7854 B12R1.224 CC(=O)Nc1cccc(c1Br)F 11a_100011934729_100015343762 [0,2,0,0,0,0|2,0,0]=4 7855 B12R1.224 CC(=O)Nc1cccc(c1Br)F 1626a_100011934729_100015343762 [0,2,0,0,0,0|2,0,0]=4 7856 B12R1.224 CC(=O)Nc1cccc(c1Br)O 22a_100012183704_100000070787 [0,2,0,0,0,0|2,0,0]=4 7857 B12R1.224 CC(=O)Nc1cccc(c1C)Br 11a_100000750434_100015343762 [0,2,0,0,0,0|2,0,0]=4 7858 B12R1.224 CC(=O)Nc1cccc(c1C)Br 1626a_100000750434_100015343762 [0,2,0,0,0,0|2,0,0]=4 7859 B12R1.224 CC(=O)Nc1cccc(c1C)Br 22a_100000750434_100000070787 [0,2,0,0,0,0|2,0,0]=4 7860 B12R1.224 CC(=O)Nc1cccc(c1C)Br 527a_100000750434_100103153847 [0,2,0,0,0,0|2,0,0]=4 7861 B12R1.224 CC(=O)Nc1cccc(c1C)C 11a_100000210026_100015343762 [0,2,0,0,0,0|2,0,0]=4 7862 B12R1.224 CC(=O)Nc1cccc(c1C)C 1626a_100000210026_100015343762 [0,2,0,0,0,0|2,0,0]=4 7863 B12R1.224 CC(=O)Nc1cccc(c1C)C 22a_100000210026_100000070787 [0,2,0,0,0,0|2,0,0]=4 7864 B12R1.224 CC(=O)Nc1cccc(c1C)C 527a_100000210026_100103153847 [0,2,0,0,0,0|2,0,0]=4 7865 B12R1.224 CC(=O)Nc1cccc(c1C)Cl 11a_100000210441_100015343762 [0,2,0,0,0,0|2,0,0]=4 7866 B12R1.224 CC(=O)Nc1cccc(c1C)Cl 1626a_100000210441_100015343762 [0,2,0,0,0,0|2,0,0]=4 7867 B12R1.224 CC(=O)Nc1cccc(c1C)Cl 22a_100000210441_100000070787 [0,2,0,0,0,0|2,0,0]=4 7868 B12R1.224 CC(=O)Nc1cccc(c1C)Cl 527a_100000210441_100103153847 [0,2,0,0,0,0|2,0,0]=4 7869 B12R1.224 CC(=O)Nc1cccc(c1C)F 11a_100000745574_100015343762 [0,2,0,0,0,0|2,0,0]=4 7870 B12R1.224 CC(=O)Nc1cccc(c1C)F 1626a_100000745574_100015343762 [0,2,0,0,0,0|2,0,0]=4 7871 B12R1.224 CC(=O)Nc1cccc(c1C)F 22a_100000745574_100000070787 [0,2,0,0,0,0|2,0,0]=4 7872 B12R1.224 CC(=O)Nc1cccc(c1C)F 527a_100000745574_100103153847 [0,2,0,0,0,0|2,0,0]=4 7873 B12R1.224 CC(=O)Nc1cccc(c1C)I 11a_100000761887_100015343762 [0,2,0,0,0,0|2,0,0]=4 7874 B12R1.224 CC(=O)Nc1cccc(c1C)I 1626a_100000761887_100015343762 [0,2,0,0,0,0|2,0,0]=4 7875 B12R1.224 CC(=O)Nc1cccc(c1C)I 22a_100000761887_100000070787 [0,2,0,0,0,0|2,0,0]=4 7876 B12R1.224 CC(=O)Nc1cccc(c1C)I 527a_100000761887_100103153847 [0,2,0,0,0,0|2,0,0]=4 7877 B12R1.224 CC(=O)Nc1cccc(c1C)O 11a_100011216573_100015343762 [0,2,0,0,0,0|2,0,0]=4 7878 B12R1.224 CC(=O)Nc1cccc(c1C)O 22a_100011216573_100000070787 [0,2,0,0,0,0|2,0,0]=4 7879 B12R1.224 CC(=O)Nc1cccc(c1C)O 527a_100011216573_100103153847 [0,2,0,0,0,0|2,0,0]=4 7880 B12R1.224 CC(=O)Nc1cccc(c1Cl)Br 11a_100000687075_100015343762 [0,2,0,0,0,0|2,0,0]=4 7881 B12R1.224 CC(=O)Nc1cccc(c1Cl)Br 1626a_100000687075_100015343762 [0,2,0,0,0,0|2,0,0]=4 7882 B12R1.224 CC(=O)Nc1cccc(c1Cl)Br 527a_100000687075_100103153847 [0,2,0,0,0,0|2,0,0]=4 7883 B12R1.224 CC(=O)Nc1cccc(c1Cl)C 11a_100000765562_100015343762 [0,2,0,0,0,0|2,0,0]=4 7884 B12R1.224 CC(=O)Nc1cccc(c1Cl)C 1626a_100000765562_100015343762 [0,2,0,0,0,0|2,0,0]=4 7885 B12R1.224 CC(=O)Nc1cccc(c1Cl)C 22a_100000765562_100000070787 [0,2,0,0,0,0|2,0,0]=4 7886 B12R1.224 CC(=O)Nc1cccc(c1Cl)Cl 11a_100000185733_100015343762 [0,2,0,0,0,0|2,0,0]=4 7887 B12R1.224 CC(=O)Nc1cccc(c1Cl)Cl 1626a_100000185733_100015343762 [0,2,0,0,0,0|2,0,0]=4 7888 B12R1.224 CC(=O)Nc1cccc(c1Cl)F 11a_100000692321_100015343762 [0,2,0,0,0,0|2,0,0]=4 7889 B12R1.224 CC(=O)Nc1cccc(c1Cl)F 1626a_100000692321_100015343762 [0,2,0,0,0,0|2,0,0]=4 7890 B12R1.224 CC(=O)Nc1cccc(c1Cl)F 22a_100000692321_100000070787 [0,2,0,0,0,0|2,0,0]=4 7891 B12R1.224 CC(=O)Nc1cccc(c1Cl)O 22a_100012002038_100000070787 [0,2,0,0,0,0|2,0,0]=4 7892 B12R1.224 CC(=O)Nc1cccc(c1F)Br 11a_100011935091_100015343762 [0,2,0,0,0,0|2,0,0]=4 7893 B12R1.224 CC(=O)Nc1cccc(c1F)Br 1626a_100011935091_100015343762 [0,2,0,0,0,0|2,0,0]=4 7894 B12R1.224 CC(=O)Nc1cccc(c1F)Br 22a_100011935091_100000070787 [0,2,0,0,0,0|2,0,0]=4 7895 B12R1.224 CC(=O)Nc1cccc(c1F)Br 527a_100011935091_100103153847 [0,2,0,0,0,0|2,0,0]=4 7896 B12R1.224 CC(=O)Nc1cccc(c1F)C 11a_100000697159_100015343762 [0,2,0,0,0,0|2,0,0]=4 7897 B12R1.224 CC(=O)Nc1cccc(c1F)C 1626a_100000697159_100015343762 [0,2,0,0,0,0|2,0,0]=4 7898 B12R1.224 CC(=O)Nc1cccc(c1F)C 527a_100000697159_100103153847 [0,2,0,0,0,0|2,0,0]=4 7899 B12R1.224 CC(=O)Nc1cccc(c1F)Cl 11a_100000199060_100015343762 [0,2,0,0,0,0|2,0,0]=4 7900 B12R1.224 CC(=O)Nc1cccc(c1F)Cl 1626a_100000199060_100015343762 [0,2,0,0,0,0|2,0,0]=4 7901 B12R1.224 CC(=O)Nc1cccc(c1F)Cl 22a_100000199060_100000070787 [0,2,0,0,0,0|2,0,0]=4 7902 B12R1.224 CC(=O)Nc1cccc(c1F)F 11a_100000743855_100015343762 [0,2,0,0,0,0|2,0,0]=4 7903 B12R1.224 CC(=O)Nc1cccc(c1F)F 1626a_100000743855_100015343762 [0,2,0,0,0,0|2,0,0]=4 7904 B12R1.224 CC(=O)Nc1cccc(c1F)F 22a_100000743855_100000070787 [0,2,0,0,0,0|2,0,0]=4 7905 B12R1.224 CC(=O)Nc1cccc(c1I)Br 11a_100020590159_100015343762 [0,2,0,0,0,0|2,0,0]=4 7906 B12R1.224 CC(=O)Nc1cccc(c1I)Br 1626a_100020590159_100015343762 [0,2,0,0,0,0|2,0,0]=4 7907 B12R1.224 CC(=O)Nc1cccc(c1I)C 11a_100000761888_100015343762 [0,2,0,0,0,0|2,0,0]=4 7908 B12R1.224 CC(=O)Nc1cccc(c1I)C 1626a_100000761888_100015343762 [0,2,0,0,0,0|2,0,0]=4 7909 B12R1.224 CC(=O)Nc1cccc(c1I)Cl 11a_100000049713_100015343762 [0,2,0,0,0,0|2,0,0]=4 7910 B12R1.224 CC(=O)Nc1cccc(c1I)Cl 1626a_100000049713_100015343762 [0,2,0,0,0,0|2,0,0]=4 7911 B12R1.224 CC(=O)Nc1cccc(c1I)F 11a_100000690935_100015343762 [0,2,0,0,0,0|2,0,0]=4 7912 B12R1.224 CC(=O)Nc1cccc(c1I)F 1626a_100000690935_100015343762 [0,2,0,0,0,0|2,0,0]=4 7913 B12R1.224 CC(=O)Nc1cccc(c1O)Br 22a_100011934915_100000070787 [0,2,0,0,0,0|2,0,0]=4 7914 B12R1.224 CC(=O)Nc1cccc(c1O)Br 527a_100011934915_100103153847 [0,2,0,0,0,0|2,0,0]=4 7915 B12R1.224 CC(=O)Nc1cccc(c1O)C 11a_100000756359_100015343762 [0,2,0,0,0,0|2,0,0]=4 7916 B12R1.224 CC(=O)Nc1cccc(c1O)C 1626a_100000756359_100015343762 [0,2,0,0,0,0|2,0,0]=4 7917 B12R1.224 CC(=O)Nc1cccc(c1O)C 22a_100000756359_100000070787 [0,2,0,0,0,0|2,0,0]=4 7918 B12R1.224 CC(=O)Nc1cccc(c1O)C 527a_100000756359_100103153847 [0,2,0,0,0,0|2,0,0]=4 7919 B12R1.224 CC(=O)Nc1cccc(c1O)Cl 22a_100000754742_100000070787 [0,2,0,0,0,0|2,0,0]=4 7920 B12R1.224 CC(=O)Nc1cccc(c1O)Cl 527a_100000754742_100103153847 [0,2,0,0,0,0|2,0,0]=4 7921 B12R1.224 CC(=O)Nc1cccc(c1O)F 1626a_100011934987_100015343762 [0,2,0,0,0,0|2,0,0]=4 7922 B12R1.224 CC(=O)Nc1cccc(c1O)F 22a_100011934987_100000070787 [0,2,0,0,0,0|2,0,0]=4 7923 B12R1.224 CC(=O)Nc1cccc(c1O)F 527a_100011934987_100103153847 [0,2,0,0,0,0|2,0,0]=4 7924 B12R1.224 CC(=O)Nc1cccc(c1O)I 1626a_100010084371_100015343762 [0,2,0,0,0,0|2,0,0]=4 7925 B12R1.224 CC(=O)Nc1cccc(c1O)I 22a_100010084371_100000070787 [0,2,0,0,0,0|2,0,0]=4 7926 B12R1.224 CC(=O)Nc1cccc(c1O)I 527a_100010084371_100103153847 [0,2,0,0,0,0|2,0,0]=4 7927 B12R1.224 CN(C)Cc1cccc(c1Br)Br 270004a_100102631434_100010240334 [0,2,0,0,0,0|1,0,1]=4 7928 B12R1.224 CN(C)Cc1cccc(c1Br)Cl 2230a_100102631434_100010145525 [0,2,0,0,0,0|1,0,1]=4 7929 B12R1.224 CN(C)Cc1cccc(c1Br)Cl 269982a_100102631434_100010145525 [0,2,0,0,0,0|1,0,1]=4 7930 B12R1.224 CN(C)Cc1cccc(c1Br)Cl 270004a_100102631434_100010232083 [0,2,0,0,0,0|1,0,1]=4 7931 B12R1.224 CN(C)Cc1cccc(c1Br)F 2230a_100102631434_100012351116 [0,2,0,0,0,0|1,0,1]=4 7932 B12R1.224 CN(C)Cc1cccc(c1Br)F 269982a_100102631434_100012351116 [0,2,0,0,0,0|1,0,1]=4 7933 B12R1.224 CN(C)Cc1cccc(c1Br)F 270004a_100102631434_100011934749 [0,2,0,0,0,0|1,0,1]=4 7934 B12R1.224 CN(C)Cc1cccc(c1Br)I 2230a_100102631434_100010254545 [0,2,0,0,0,0|1,0,1]=4 7935 B12R1.224 CN(C)Cc1cccc(c1Br)I 269982a_100102631434_100010254545 [0,2,0,0,0,0|1,0,1]=4 7936 B12R1.224 CN(C)Cc1cccc(c1Cl)Br 2230a_100102631434_100012349491 [0,2,0,0,0,0|1,0,1]=4 7937 B12R1.224 CN(C)Cc1cccc(c1Cl)Br 269982a_100102631434_100012349491 [0,2,0,0,0,0|1,0,1]=4 7938 B12R1.224 CN(C)Cc1cccc(c1Cl)Br 270004a_100102631434_100012362481 [0,2,0,0,0,0|1,0,1]=4 7939 B12R1.224 CN(C)Cc1cccc(c1Cl)Cl 2230a_100000690605_200000210301 [0,2,0,0,0,0|1,0,1]=4 7940 B12R1.224 CN(C)Cc1cccc(c1Cl)Cl 2230a_100102631434_100000723366 [0,2,0,0,0,0|1,0,1]=4 7941 B12R1.224 CN(C)Cc1cccc(c1Cl)Cl 269982a_100000690605_200000210301 [0,2,0,0,0,0|1,0,1]=4 7942 B12R1.224 CN(C)Cc1cccc(c1Cl)Cl 269982a_100102631434_100000720918 [0,2,0,0,0,0|1,0,1]=4 7943 B12R1.224 CN(C)Cc1cccc(c1Cl)Cl 270004a_100102631434_100000210504 [0,2,0,0,0,0|1,0,1]=4 7944 B12R1.224 CN(C)Cc1cccc(c1Cl)Cl 34a_100000690605_200000210301 [0,2,0,0,0,0|1,0,1]=4 7945 B12R1.224 CN(C)Cc1cccc(c1Cl)F 2230a_100102631434_100000696688 [0,2,0,0,0,0|1,0,1]=4 7946 B12R1.224 CN(C)Cc1cccc(c1Cl)F 269982a_100102631434_100000696688 [0,2,0,0,0,0|1,0,1]=4 7947 B12R1.224 CN(C)Cc1cccc(c1Cl)F 270004a_100102631434_100011998484 [0,2,0,0,0,0|1,0,1]=4 7948 B12R1.224 CN(C)Cc1cccc(c1Cl)O 270004a_100102631434_100000050521 [0,2,0,0,0,0|1,0,1]=4 7949 B12R1.224 CN(C)Cc1cccc(c1F)Br 2230a_100102631434_100012356506 [0,2,0,0,0,0|1,0,1]=4 7950 B12R1.224 CN(C)Cc1cccc(c1F)Br 2230a_114873767014_200000210301 [0,2,0,0,0,0|1,0,1]=4 7951 B12R1.224 CN(C)Cc1cccc(c1F)Br 269982a_100102631434_100012356506 [0,2,0,0,0,0|1,0,1]=4 7952 B12R1.224 CN(C)Cc1cccc(c1F)Br 269982a_114873767014_200000210301 [0,2,0,0,0,0|1,0,1]=4 7953 B12R1.224 CN(C)Cc1cccc(c1F)Br 270004a_100102631434_100011361543 [0,2,0,0,0,0|1,0,1]=4 7954 B12R1.224 CN(C)Cc1cccc(c1F)Br 34a_114873767014_200000210301 [0,2,0,0,0,0|1,0,1]=4 7955 B12R1.224 CN(C)Cc1cccc(c1F)Cl 2230a_100102631434_100000716733 [0,2,0,0,0,0|1,0,1]=4 7956 B12R1.224 CN(C)Cc1cccc(c1F)Cl 269982a_100102631434_100000716733 [0,2,0,0,0,0|1,0,1]=4 7957 B12R1.224 CN(C)Cc1cccc(c1F)Cl 270004a_100102631434_100000766533 [0,2,0,0,0,0|1,0,1]=4 7958 B12R1.224 CN(C)Cc1cccc(c1F)F 2230a_100102631434_100000217499 [0,2,0,0,0,0|1,0,1]=4 7959 B12R1.224 CN(C)Cc1cccc(c1F)F 2230a_102515433064_200000210301 [0,2,0,0,0,0|1,0,1]=4 7960 B12R1.224 CN(C)Cc1cccc(c1F)F 269982a_100102631434_100000217499 [0,2,0,0,0,0|1,0,1]=4 7961 B12R1.224 CN(C)Cc1cccc(c1F)F 269982a_102515433064_200000210301 [0,2,0,0,0,0|1,0,1]=4 7962 B12R1.224 CN(C)Cc1cccc(c1F)F 270004a_100102631434_100000753312 [0,2,0,0,0,0|1,0,1]=4 7963 B12R1.224 CN(C)Cc1cccc(c1F)F 34a_102515433064_200000210301 [0,2,0,0,0,0|1,0,1]=4 7964 B12R1.224 CN(C)Cc1cccc(c1F)I 270004a_100102631434_100010202174 [0,2,0,0,0,0|1,0,1]=4 7965 B12R1.224 CN(C)Cc1cccc(c1I)F 2230a_100102631434_100010149603 [0,2,0,0,0,0|1,0,1]=4 7966 B12R1.224 CN(C)Cc1cccc(c1I)F 269982a_100102631434_100010149603 [0,2,0,0,0,0|1,0,1]=4 7967 B12R1.224 CN(C)Cc1cccc(c1I)F 270004a_100102631434_100010186293 [0,2,0,0,0,0|1,0,1]=4 7968 B12R1.224 CN([13CH3])Cc1cccc(c1Cl)Cl 2230a_100000690605_200025704644 [0,2,0,0,0,0|1,0,1]=4 7969 B12R1.224 CN([13CH3])Cc1cccc(c1Cl)Cl 269982a_100000690605_200025704644 [0,2,0,0,0,0|1,0,1]=4 7970 B12R1.224 CN([13CH3])Cc1cccc(c1Cl)Cl 34a_100000690605_200025704644 [0,2,0,0,0,0|1,0,1]=4 7971 B12R1.224 CN([13CH3])Cc1cccc(c1F)Br 2230a_114873767014_200025704644 [0,2,0,0,0,0|1,0,1]=4 7972 B12R1.224 CN([13CH3])Cc1cccc(c1F)Br 269982a_114873767014_200025704644 [0,2,0,0,0,0|1,0,1]=4 7973 B12R1.224 CN([13CH3])Cc1cccc(c1F)Br 34a_114873767014_200025704644 [0,2,0,0,0,0|1,0,1]=4 7974 B12R1.224 CN([13CH3])Cc1cccc(c1F)F 2230a_102515433064_200025704644 [0,2,0,0,0,0|1,0,1]=4 7975 B12R1.224 CN([13CH3])Cc1cccc(c1F)F 269982a_102515433064_200025704644 [0,2,0,0,0,0|1,0,1]=4 7976 B12R1.224 CN([13CH3])Cc1cccc(c1F)F 34a_102515433064_200025704644 [0,2,0,0,0,0|1,0,1]=4 7977 B12R1.224 Cc1c(cccc1CC(=O)[13CH3])F 1458a_100000035905_200025704644 [0,2,0,0,0,0|1,0,0]=3 7978 B12R1.224 Cc1c(cccc1CN(C)C)Br 2230a_100102631434_100000694682 [0,2,0,0,0,0|1,0,1]=4 7979 B12R1.224 Cc1c(cccc1CN(C)C)Br 269982a_100102631434_100000694682 [0,2,0,0,0,0|1,0,1]=4 7980 B12R1.224 Cc1c(cccc1CN(C)C)Br 270004a_100102631434_100012179384 [0,2,0,0,0,0|1,0,1]=4 7981 B12R1.224 Cc1c(cccc1CN(C)C)Cl 2230a_100102631434_100012186920 [0,2,0,0,0,0|1,0,1]=4 7982 B12R1.224 Cc1c(cccc1CN(C)C)Cl 269982a_100102631434_100012186920 [0,2,0,0,0,0|1,0,1]=4 7983 B12R1.224 Cc1c(cccc1CN(C)C)Cl 270004a_100102631434_100012002129 [0,2,0,0,0,0|1,0,1]=4 7984 B12R1.224 Cc1c(cccc1CN(C)C)F 2230a_100102631434_100009813626 [0,2,0,0,0,0|1,0,1]=4 7985 B12R1.224 Cc1c(cccc1CN(C)C)F 269982a_100102631434_100009813626 [0,2,0,0,0,0|1,0,1]=4 7986 B12R1.224 Cc1c(cccc1CN(C)C)F 270004a_100102631434_100000037668 [0,2,0,0,0,0|1,0,1]=4 7987 B12R1.224 Cc1c(cccc1CN(C)C)I 2230a_100102631434_100010150147 [0,2,0,0,0,0|1,0,1]=4 7988 B12R1.224 Cc1c(cccc1CN(C)C)I 269982a_100102631434_100010150147 [0,2,0,0,0,0|1,0,1]=4 7989 B12R1.224 Cc1c(cccc1CN(C)C)O 270004a_100102631434_100009868165 [0,2,0,0,0,0|1,0,1]=4 7990 B12R1.224 Cc1cccc(c1Br)CC(=O)[13CH3] 1458a_100010147021_200025704644 [0,2,0,0,0,0|1,0,0]=3 7991 B12R1.224 Cc1cccc(c1Br)CN(C)C 2230a_100102631434_200012349612 [0,2,0,0,0,0|1,0,1]=4 7992 B12R1.224 Cc1cccc(c1Br)CN(C)C 269982a_100102631434_200012349612 [0,2,0,0,0,0|1,0,1]=4 7993 B12R1.224 Cc1cccc(c1Br)CN(C)C 270004a_100102631434_100012186367 [0,2,0,0,0,0|1,0,1]=4 7994 B12R1.224 Cc1cccc(c1C)CC(=O)[13CH3] 1458a_100011698479_200025704644 [0,2,0,0,0,0|1,0,0]=3 7995 B12R1.224 Cc1cccc(c1C)CN(C)C 2230a_100000207598_200000210301 [0,2,0,0,0,0|1,0,1]=4 7996 B12R1.224 Cc1cccc(c1C)CN(C)C 2230a_100102631434_100011515928 [0,2,0,0,0,0|1,0,1]=4 7997 B12R1.224 Cc1cccc(c1C)CN(C)C 269982a_100000207598_200000210301 [0,2,0,0,0,0|1,0,1]=4 7998 B12R1.224 Cc1cccc(c1C)CN(C)C 269982a_100102631434_100011515928 [0,2,0,0,0,0|1,0,1]=4 7999 B12R1.224 Cc1cccc(c1C)CN(C)C 270004a_100102631434_100000229941 [0,2,0,0,0,0|1,0,1]=4 8000 B12R1.224 Cc1cccc(c1C)CN(C)C 34a_100000207598_200000210301 [0,2,0,0,0,0|1,0,1]=4 8001 B12R1.224 Cc1cccc(c1C)CN(C)[13CH3] 2230a_100000207598_200025704644 [0,2,0,0,0,0|1,0,1]=4 8002 B12R1.224 Cc1cccc(c1C)CN(C)[13CH3] 269982a_100000207598_200025704644 [0,2,0,0,0,0|1,0,1]=4 8003 B12R1.224 Cc1cccc(c1C)CN(C)[13CH3] 34a_100000207598_200025704644 [0,2,0,0,0,0|1,0,1]=4 8004 B12R1.224 Cc1cccc(c1Cl)CN(C)C 270004a_100102631434_100012017286 [0,2,0,0,0,0|1,0,1]=4 8005 B12R1.224 Cc1cccc(c1F)CN(C)C 2230a_100102631434_100011216058 [0,2,0,0,0,0|1,0,1]=4 8006 B12R1.224 Cc1cccc(c1F)CN(C)C 269982a_100102631434_100011216058 [0,2,0,0,0,0|1,0,1]=4 8007 B12R1.224 Cc1cccc(c1F)CN(C)C 270004a_100102631434_100011219516 [0,2,0,0,0,0|1,0,1]=4 8008 B12R1.224 Cc1cccc(c1O)CC(=O)N 271570a_203496583355_100011096275 [0,2,0,0,0,0|2,0,0]=4 8009 B12R1.224 Cc1cccn(c1=O)CC(=O)[13CH3] 1458a_100000697016_200025704644 [0,2,0,0,0,0|2,0,0]=4 8010 B12R1.224 [13CH3]C(=O)Cc1cccc(c1Br)Cl 1458a_100010145769_200025704644 [0,2,0,0,0,0|1,0,0]=3 8011 B12R1.224 [13CH3]C(=O)Cc1cccc(c1Br)F 1458a_100012356664_200025704644 [0,2,0,0,0,0|1,0,0]=3 8012 B12R1.224 [13CH3]C(=O)Cc1cccc(c1Cl)Br 1458a_100010145770_200025704644 [0,2,0,0,0,0|1,0,0]=3 8013 B12R1.224 [13CH3]C(=O)Cc1cccc(c1Cl)Cl 1458a_100000759314_200025704644 [0,2,0,0,0,0|1,0,0]=3 8014 B12R1.224 [13CH3]C(=O)Cc1cccc(c1Cl)F 1458a_100012001123_200025704644 [0,2,0,0,0,0|1,0,0]=3 8015 B12R1.224 [13CH3]C(=O)Cc1cccc(c1F)Br 1458a_100011935088_200025704644 [0,2,0,0,0,0|1,0,0]=3 8016 B12R1.224 [13CH3]C(=O)Cc1cccc(c1F)Cl 1458a_100000709823_200025704644 [0,2,0,0,0,0|1,0,0]=3 8017 B12R1.224 [13CH3]C(=O)Cc1cccc(c1F)F 1458a_100000684727_200025704644 [0,2,0,0,0,0|1,0,0]=3 8018 B12R1.1009 CC(=Cc1c(cccc1Br)Br)C 271570a_100102525489_100009994525 [0,2,0,0,0,0|0,0,2]=4 8019 B12R1.1009 CC(=Cc1c(cccc1Br)Cl)C 271570a_100102525489_100010214488 [0,2,0,0,0,0|0,0,2]=4 8020 B12R1.1009 CC(=Cc1c(cccc1Br)F)C 271570a_100102525489_100011219512 [0,2,0,0,0,0|0,0,2]=4 8021 B12R1.1009 CC(=Cc1c(cccc1Br)N)C 271570a_100102525489_100020590159 [0,2,0,0,0,0|0,0,2]=4 8022 B12R1.1009 CC(=Cc1c(cccc1Br)O)C 271570a_100102525489_100010187912 [0,2,0,0,0,0|0,0,2]=4 8023 B12R1.1009 CC(=Cc1c(cccc1C)C)C 271570a_100102525489_100000033847 [0,2,0,0,0,0|0,0,2]=4 8024 B12R1.1009 CC(=Cc1c(cccc1Cl)C)C 271570a_100102525489_100000043165 [0,2,0,0,0,0|0,0,2]=4 8025 B12R1.1009 CC(=Cc1c(cccc1Cl)Cl)C 271570a_100102525489_100000034237 [0,2,0,0,0,0|0,0,2]=4 8026 B12R1.1009 CC(=Cc1c(cccc1Cl)F)C 271570a_100102525489_100000050007 [0,2,0,0,0,0|0,0,2]=4 8027 B12R1.1009 CC(=Cc1c(cccc1Cl)N)C 271570a_100102525489_100000049713 [0,2,0,0,0,0|0,0,2]=4 8028 B12R1.1009 CC(=Cc1c(cccc1Cl)O)C 271570a_100102525489_100000050174 [0,2,0,0,0,0|0,0,2]=4 8029 B12R1.1009 CC(=Cc1c(cccc1F)C)C 271570a_100102525489_100012349962 [0,2,0,0,0,0|0,0,2]=4 8030 B12R1.1009 CC(=Cc1c(cccc1F)F)C 271570a_100102525489_100000693133 [0,2,0,0,0,0|0,0,2]=4 8031 B12R1.1009 CC(=Cc1c(cccc1F)N)C 271570a_100102525489_100011934729 [0,2,0,0,0,0|0,0,2]=4 8032 B12R1.1009 CC(=Cc1c(cccc1F)O)C 271570a_100102525489_100009820682 [0,2,0,0,0,0|0,0,2]=4 8033 B12R1.1009 CC(=Cc1c(cccc1N)C)C 271570a_100102525489_100000684715 [0,2,0,0,0,0|0,0,2]=4 8034 B12R1.1009 CC(=Cc1c(cccc1O)C)C 271570a_100102525489_100000686692 [0,2,0,0,0,0|0,0,2]=4 8035 B12R1.1009 CC(=Cc1c(cccc1O)N)C 271570a_100102525489_100012183704 [0,2,0,0,0,0|0,0,2]=4 8036 B12R1.1009 CC(=Cc1c(cccc1O)O)C 271570a_100102525489_100010205330 [0,2,0,0,0,0|0,0,2]=4 8037 B12R1.1009 CC(=O)Cc1c(cccc1Br)Br 1458a_100010209379_200000210301 [0,2,0,0,0,0|1,0,0]=3 8038 B12R1.1009 CC(=O)Cc1c(cccc1Br)C 1458a_100000070787_100010146847 [0,2,0,0,0,0|1,0,0]=3 8039 B12R1.1009 CC(=O)Cc1c(cccc1Br)C 1458a_100010147022_200000210301 [0,2,0,0,0,0|1,0,0]=3 8040 B12R1.1009 CC(=O)Cc1c(cccc1Br)Cl 1458a_100000070787_100010138402 [0,2,0,0,0,0|1,0,0]=3 8041 B12R1.1009 CC(=O)Cc1c(cccc1Br)Cl 1458a_100013084675_200000210301 [0,2,0,0,0,0|1,0,0]=3 8042 B12R1.1009 CC(=O)Cc1c(cccc1Br)F 1458a_100000070787_100000696636 [0,2,0,0,0,0|1,0,0]=3 8043 B12R1.1009 CC(=O)Cc1c(cccc1Br)F 1458a_100010172741_200000210301 [0,2,0,0,0,0|1,0,0]=3 8044 B12R1.1009 CC(=O)Cc1c(cccc1C)C 1458a_100000070787_100000758300 [0,2,0,0,0,0|1,0,0]=3 8045 B12R1.1009 CC(=O)Cc1c(cccc1C)C 1458a_100000689862_200000210301 [0,2,0,0,0,0|1,0,0]=3 8046 B12R1.1009 CC(=O)Cc1c(cccc1Cl)Cl 1458a_100000070787_100000187851 [0,2,0,0,0,0|1,0,0]=3 8047 B12R1.1009 CC(=O)Cc1c(cccc1Cl)Cl 1458a_100000211232_200000210301 [0,2,0,0,0,0|1,0,0]=3 8048 B12R1.1009 CC(=O)Cc1c(cccc1Cl)F 1458a_100000070787_100000187852 [0,2,0,0,0,0|1,0,0]=3 8049 B12R1.1009 CC(=O)Cc1c(cccc1Cl)F 1458a_100000185183_200000210301 [0,2,0,0,0,0|1,0,0]=3 8050 B12R1.1009 CC(=O)Cc1c(cccc1F)C 1458a_100000070787_100009814554 [0,2,0,0,0,0|1,0,0]=3 8051 B12R1.1009 CC(=O)Cc1c(cccc1F)F 1458a_100000070787_100000698325 [0,2,0,0,0,0|1,0,0]=3 8052 B12R1.1009 CC(=O)Cc1c(cccc1F)F 1458a_100000684726_200000210301 [0,2,0,0,0,0|1,0,0]=3 8053 B12R1.1009 CC(=O)Cc1c(cccc1I)Br 1458a_100000070787_100010146611 [0,2,0,0,0,0|1,0,0]=3 8054 B12R1.1009 CC(=O)Cc1c(cccc1I)C 1458a_100000070787_100010150146 [0,2,0,0,0,0|1,0,0]=3 8055 B12R1.1009 CC(=O)Cc1c(cccc1I)F 1458a_100000070787_100010149602 [0,2,0,0,0,0|1,0,0]=3 8056 B12R1.1009 CC(=O)Cc1c(cncc1Cl)Cl 1458a_100000070787_200009872113 [0,2,0,0,0,0|2,0,0]=4 8057 B12R1.1009 CC(=O)Nc1c(cccc1Br)Br 1626a_100000690995_100015343762 [0,2,0,0,0,0|2,0,0]=4 8058 B12R1.1009 CC(=O)Nc1c(cccc1Br)C 11a_100011834072_100015343762 [0,2,0,0,0,0|2,0,0]=4 8059 B12R1.1009 CC(=O)Nc1c(cccc1Br)C 1626a_100011834072_100015343762 [0,2,0,0,0,0|2,0,0]=4 8060 B12R1.1009 CC(=O)Nc1c(cccc1Br)Cl 11a_100102946385_100015343762 [0,2,0,0,0,0|2,0,0]=4 8061 B12R1.1009 CC(=O)Nc1c(cccc1Br)Cl 1626a_100102946385_100015343762 [0,2,0,0,0,0|2,0,0]=4 8062 B12R1.1009 CC(=O)Nc1c(cccc1Br)F 11a_100000684712_100015343762 [0,2,0,0,0,0|2,0,0]=4 8063 B12R1.1009 CC(=O)Nc1c(cccc1Br)F 1626a_100000684712_100015343762 [0,2,0,0,0,0|2,0,0]=4 8064 B12R1.1009 CC(=O)Nc1c(cccc1Br)O 527a_100011934926_100103153847 [0,2,0,0,0,0|2,0,0]=4 8065 B12R1.1009 CC(=O)Nc1c(cccc1C)C 11a_100000185769_100015343762 [0,2,0,0,0,0|2,0,0]=4 8066 B12R1.1009 CC(=O)Nc1c(cccc1C)C 1626a_100000185769_100015343762 [0,2,0,0,0,0|2,0,0]=4 8067 B12R1.1009 CC(=O)Nc1c(cccc1C)C 22a_100000185769_100000070787 [0,2,0,0,0,0|2,0,0]=4 8068 B12R1.1009 CC(=O)Nc1c(cccc1Cl)C 11a_100000756524_100015343762 [0,2,0,0,0,0|2,0,0]=4 8069 B12R1.1009 CC(=O)Nc1c(cccc1Cl)C 1626a_100000756524_100015343762 [0,2,0,0,0,0|2,0,0]=4 8070 B12R1.1009 CC(=O)Nc1c(cccc1Cl)Cl 11a_100000210028_100015343762 [0,2,0,0,0,0|2,0,0]=4 8071 B12R1.1009 CC(=O)Nc1c(cccc1Cl)Cl 1626a_100000210028_100015343762 [0,2,0,0,0,0|2,0,0]=4 8072 B12R1.1009 CC(=O)Nc1c(cccc1Cl)F 11a_100000760031_100015343762 [0,2,0,0,0,0|2,0,0]=4 8073 B12R1.1009 CC(=O)Nc1c(cccc1Cl)F 1626a_100000760031_100015343762 [0,2,0,0,0,0|2,0,0]=4 8074 B12R1.1009 CC(=O)Nc1c(cccc1Cl)O 22a_100012022510_100000070787 [0,2,0,0,0,0|2,0,0]=4 8075 B12R1.1009 CC(=O)Nc1c(cccc1Cl)O 527a_100012022510_100103153847 [0,2,0,0,0,0|2,0,0]=4 8076 B12R1.1009 CC(=O)Nc1c(cccc1F)C 11a_100000766463_100015343762 [0,2,0,0,0,0|2,0,0]=4 8077 B12R1.1009 CC(=O)Nc1c(cccc1F)C 1626a_100000766463_100015343762 [0,2,0,0,0,0|2,0,0]=4 8078 B12R1.1009 CC(=O)Nc1c(cccc1F)C 22a_100000766463_100000070787 [0,2,0,0,0,0|2,0,0]=4 8079 B12R1.1009 CC(=O)Nc1c(cccc1F)F 11a_100000210704_100015343762 [0,2,0,0,0,0|2,0,0]=4 8080 B12R1.1009 CC(=O)Nc1c(cccc1F)F 1626a_100000210704_100015343762 [0,2,0,0,0,0|2,0,0]=4 8081 B12R1.1009 CC(=O)Nc1c(cccc1F)O 22a_100020591140_100000070787 [0,2,0,0,0,0|2,0,0]=4 8082 B12R1.1009 CC(=O)Nc1c(cccc1F)O 527a_100020591140_100103153847 [0,2,0,0,0,0|2,0,0]=4 8083 B12R1.1009 CC(=O)Nc1c(cccc1I)Br 11a_100010146558_100015343762 [0,2,0,0,0,0|2,0,0]=4 8084 B12R1.1009 CC(=O)Nc1c(cccc1I)Br 1626a_100010146558_100015343762 [0,2,0,0,0,0|2,0,0]=4 8085 B12R1.1009 CC(=O)Nc1c(cccc1I)Cl 11a_100010190421_100015343762 [0,2,0,0,0,0|2,0,0]=4 8086 B12R1.1009 CC(=O)Nc1c(cccc1I)Cl 1626a_100010190421_100015343762 [0,2,0,0,0,0|2,0,0]=4 8087 B12R1.1009 CC(=O)Nc1c(cccc1I)F 11a_100000042321_100015343762 [0,2,0,0,0,0|2,0,0]=4 8088 B12R1.1009 CC(=O)Nc1c(cccc1I)F 1626a_100000042321_100015343762 [0,2,0,0,0,0|2,0,0]=4 8089 B12R1.1009 CC(=O)Nc1c(cccc1I)O 22a_200000049512_100000070787 [0,2,0,0,0,0|2,0,0]=4 8090 B12R1.1009 CC(=O)Nc1c(cccc1I)O 527a_200000049512_100103153847 [0,2,0,0,0,0|2,0,0]=4 8091 B12R1.1009 CC(=O)Nc1c(cccc1O)C 22a_100000743429_100000070787 [0,2,0,0,0,0|2,0,0]=4 8092 B12R1.1009 CC(=O)Nc1c(cccc1O)C 527a_100000743429_100103153847 [0,2,0,0,0,0|2,0,0]=4 8093 B12R1.1009 CC(=O)Nc1c(cccc1O)O 22a_100011995820_100000070787 [0,2,0,0,0,0|2,0,0]=4 8094 B12R1.1009 CC(=O)Nc1c(cccc1O)O 527a_100011995820_100103153847 [0,2,0,0,0,0|2,0,0]=4 8095 B12R1.1009 CN(C)Cc1c(cccc1Br)Br 270004a_100102631434_100010233043 [0,2,0,0,0,0|1,0,1]=4 8096 B12R1.1009 CN(C)Cc1c(cccc1Br)Cl 2230a_100102631434_100010138402 [0,2,0,0,0,0|1,0,1]=4 8097 B12R1.1009 CN(C)Cc1c(cccc1Br)Cl 269982a_100102631434_100010138402 [0,2,0,0,0,0|1,0,1]=4 8098 B12R1.1009 CN(C)Cc1c(cccc1Br)Cl 270004a_100102631434_100011249081 [0,2,0,0,0,0|1,0,1]=4 8099 B12R1.1009 CN(C)Cc1c(cccc1Br)F 2230a_100102631434_100012145669 [0,2,0,0,0,0|1,0,1]=4 8100 B12R1.1009 CN(C)Cc1c(cccc1Br)F 2230a_106744473292_200000210301 [0,2,0,0,0,0|1,0,1]=4 8101 B12R1.1009 CN(C)Cc1c(cccc1Br)F 269982a_100102631434_100012145669 [0,2,0,0,0,0|1,0,1]=4 8102 B12R1.1009 CN(C)Cc1c(cccc1Br)F 269982a_106744473292_200000210301 [0,2,0,0,0,0|1,0,1]=4 8103 B12R1.1009 CN(C)Cc1c(cccc1Br)F 270004a_100102631434_100000752695 [0,2,0,0,0,0|1,0,1]=4 8104 B12R1.1009 CN(C)Cc1c(cccc1Br)F 34a_106744473292_200000210301 [0,2,0,0,0,0|1,0,1]=4 8105 B12R1.1009 CN(C)Cc1c(cccc1Cl)Cl 2230a_100000186903_200000210301 [0,2,0,0,0,0|1,0,1]=4 8106 B12R1.1009 CN(C)Cc1c(cccc1Cl)Cl 2230a_100102631434_100000187851 [0,2,0,0,0,0|1,0,1]=4 8107 B12R1.1009 CN(C)Cc1c(cccc1Cl)Cl 269982a_100000186903_200000210301 [0,2,0,0,0,0|1,0,1]=4 8108 B12R1.1009 CN(C)Cc1c(cccc1Cl)Cl 269982a_100102631434_100000211241 [0,2,0,0,0,0|1,0,1]=4 8109 B12R1.1009 CN(C)Cc1c(cccc1Cl)Cl 270004a_100102631434_100000189306 [0,2,0,0,0,0|1,0,1]=4 8110 B12R1.1009 CN(C)Cc1c(cccc1Cl)Cl 34a_100000186903_200000210301 [0,2,0,0,0,0|1,0,1]=4 8111 B12R1.1009 CN(C)Cc1c(cccc1Cl)F 2230a_100000184537_200000210301 [0,2,0,0,0,0|1,0,1]=4 8112 B12R1.1009 CN(C)Cc1c(cccc1Cl)F 2230a_100102631434_100000187852 [0,2,0,0,0,0|1,0,1]=4 8113 B12R1.1009 CN(C)Cc1c(cccc1Cl)F 269982a_100000184537_200000210301 [0,2,0,0,0,0|1,0,1]=4 8114 B12R1.1009 CN(C)Cc1c(cccc1Cl)F 269982a_100102631434_100000187852 [0,2,0,0,0,0|1,0,1]=4 8115 B12R1.1009 CN(C)Cc1c(cccc1Cl)F 270004a_100102631434_100000210083 [0,2,0,0,0,0|1,0,1]=4 8116 B12R1.1009 CN(C)Cc1c(cccc1Cl)F 34a_100000184537_200000210301 [0,2,0,0,0,0|1,0,1]=4 8117 B12R1.1009 CN(C)Cc1c(cccc1F)F 2230a_100102631434_100000698325 [0,2,0,0,0,0|1,0,1]=4 8118 B12R1.1009 CN(C)Cc1c(cccc1F)F 269982a_100102631434_100000709179 [0,2,0,0,0,0|1,0,1]=4 8119 B12R1.1009 CN(C)Cc1c(cccc1F)F 270004a_100102631434_100000211061 [0,2,0,0,0,0|1,0,1]=4 8120 B12R1.1009 CN(C)Cc1c(cccc1I)Br 2230a_100102631434_100010146611 [0,2,0,0,0,0|1,0,1]=4 8121 B12R1.1009 CN(C)Cc1c(cccc1I)Br 269982a_100102631434_100010146611 [0,2,0,0,0,0|1,0,1]=4 8122 B12R1.1009 CN(C)Cc1c(cccc1I)Cl 270004a_100102631434_100010147682 [0,2,0,0,0,0|1,0,1]=4 8123 B12R1.1009 CN(C)Cc1c(cccc1I)F 2230a_100102631434_100010149602 [0,2,0,0,0,0|1,0,1]=4 8124 B12R1.1009 CN(C)Cc1c(cccc1I)F 269982a_100102631434_100010149602 [0,2,0,0,0,0|1,0,1]=4 8125 B12R1.1009 CN(C)Cc1c(cccc1I)F 270004a_100102631434_100010178011 [0,2,0,0,0,0|1,0,1]=4 8126 B12R1.1009 CN([13CH3])Cc1c(cccc1Br)F 2230a_106744473292_200025704644 [0,2,0,0,0,0|1,0,1]=4 8127 B12R1.1009 CN([13CH3])Cc1c(cccc1Br)F 269982a_106744473292_200025704644 [0,2,0,0,0,0|1,0,1]=4 8128 B12R1.1009 CN([13CH3])Cc1c(cccc1Br)F 34a_106744473292_200025704644 [0,2,0,0,0,0|1,0,1]=4 8129 B12R1.1009 CN([13CH3])Cc1c(cccc1Cl)Cl 2230a_100000186903_200025704644 [0,2,0,0,0,0|1,0,1]=4 8130 B12R1.1009 CN([13CH3])Cc1c(cccc1Cl)Cl 269982a_100000186903_200025704644 [0,2,0,0,0,0|1,0,1]=4 8131 B12R1.1009 CN([13CH3])Cc1c(cccc1Cl)Cl 34a_100000186903_200025704644 [0,2,0,0,0,0|1,0,1]=4 8132 B12R1.1009 CN([13CH3])Cc1c(cccc1Cl)F 2230a_100000184537_200025704644 [0,2,0,0,0,0|1,0,1]=4 8133 B12R1.1009 CN([13CH3])Cc1c(cccc1Cl)F 269982a_100000184537_200025704644 [0,2,0,0,0,0|1,0,1]=4 8134 B12R1.1009 CN([13CH3])Cc1c(cccc1Cl)F 34a_100000184537_200025704644 [0,2,0,0,0,0|1,0,1]=4 8135 B12R1.1009 Cc1cccc(c1CC(=O)[13CH3])Br 1458a_100010147022_200025704644 [0,2,0,0,0,0|1,0,0]=3 8136 B12R1.1009 Cc1cccc(c1CC(=O)[13CH3])C 1458a_100000689862_200025704644 [0,2,0,0,0,0|1,0,0]=3 8137 B12R1.1009 Cc1cccc(c1CN(C)C)Br 2230a_100102631434_100010146847 [0,2,0,0,0,0|1,0,1]=4 8138 B12R1.1009 Cc1cccc(c1CN(C)C)Br 269982a_100102631434_100010146847 [0,2,0,0,0,0|1,0,1]=4 8139 B12R1.1009 Cc1cccc(c1CN(C)C)Br 270004a_100102631434_100009881667 [0,2,0,0,0,0|1,0,1]=4 8140 B12R1.1009 Cc1cccc(c1CN(C)C)C 2230a_100102631434_100000758300 [0,2,0,0,0,0|1,0,1]=4 8141 B12R1.1009 Cc1cccc(c1CN(C)C)C 269982a_100102631434_100000758300 [0,2,0,0,0,0|1,0,1]=4 8142 B12R1.1009 Cc1cccc(c1CN(C)C)C 270004a_100102631434_100000758299 [0,2,0,0,0,0|1,0,1]=4 8143 B12R1.1009 Cc1cccc(c1CN(C)C)Cl 270004a_100102631434_100000041122 [0,2,0,0,0,0|1,0,1]=4 8144 B12R1.1009 Cc1cccc(c1CN(C)C)F 2230a_100102631434_100009814554 [0,2,0,0,0,0|1,0,1]=4 8145 B12R1.1009 Cc1cccc(c1CN(C)C)F 269982a_100102631434_100009814554 [0,2,0,0,0,0|1,0,1]=4 8146 B12R1.1009 Cc1cccc(c1CN(C)C)F 270004a_100102631434_100000069827 [0,2,0,0,0,0|1,0,1]=4 8147 B12R1.1009 Cc1cccc(c1CN(C)C)I 2230a_100102631434_100010150146 [0,2,0,0,0,0|1,0,1]=4 8148 B12R1.1009 Cc1cccc(c1CN(C)C)I 269982a_100102631434_100010150146 [0,2,0,0,0,0|1,0,1]=4 8149 B12R1.1009 [13CH3]C(=O)Cc1c(cccc1Br)Br 1458a_100010209379_200025704644 [0,2,0,0,0,0|1,0,0]=3 8150 B12R1.1009 [13CH3]C(=O)Cc1c(cccc1Br)Cl 1458a_100013084675_200025704644 [0,2,0,0,0,0|1,0,0]=3 8151 B12R1.1009 [13CH3]C(=O)Cc1c(cccc1Br)F 1458a_100010172741_200025704644 [0,2,0,0,0,0|1,0,0]=3 8152 B12R1.1009 [13CH3]C(=O)Cc1c(cccc1Cl)Cl 1458a_100000211232_200025704644 [0,2,0,0,0,0|1,0,0]=3 8153 B12R1.1009 [13CH3]C(=O)Cc1c(cccc1Cl)F 1458a_100000185183_200025704644 [0,2,0,0,0,0|1,0,0]=3 8154 B12R1.1009 [13CH3]C(=O)Cc1c(cccc1F)F 1458a_100000684726_200025704644 [0,2,0,0,0,0|1,0,0]=3 8155 B12R1.101 CC(=Cc1cc(cc(c1)Br)Br)C 271570a_100102525489_100009814770 [0,2,0,0,0,0|0,0,2]=4 8156 B12R1.101 CC(=Cc1cc(cc(c1)Br)Cl)C 271570a_100102525489_100009814755 [0,2,0,0,0,0|0,0,2]=4 8157 B12R1.101 CC(=Cc1cc(cc(c1)Br)F)C 271570a_100102525489_100009814764 [0,2,0,0,0,0|0,0,2]=4 8158 B12R1.101 CC(=Cc1cc(cc(c1)Br)N)C 271570a_100102525489_100009814763 [0,2,0,0,0,0|0,0,2]=4 8159 B12R1.101 CC(=Cc1cc(cc(c1)Br)O)C 271570a_100102525489_100010068917 [0,2,0,0,0,0|0,0,2]=4 8160 B12R1.101 CC(=Cc1cc(cc(c1)C)C)C 271570a_100102525489_100011215608 [0,2,0,0,0,0|0,0,2]=4 8161 B12R1.101 CC(=Cc1cc(cc(c1)Cl)C)C 271570a_100102525489_100010172791 [0,2,0,0,0,0|0,0,2]=4 8162 B12R1.101 CC(=Cc1cc(cc(c1)Cl)Cl)C 271570a_100102525489_100000747138 [0,2,0,0,0,0|0,0,2]=4 8163 B12R1.101 CC(=Cc1cc(cc(c1)Cl)F)C 271570a_100102525489_100013859453 [0,2,0,0,0,0|0,0,2]=4 8164 B12R1.101 CC(=Cc1cc(cc(c1)Cl)N)C 271570a_100102525489_100010147676 [0,2,0,0,0,0|0,0,2]=4 8165 B12R1.101 CC(=Cc1cc(cc(c1)Cl)O)C 271570a_100102525489_100010068924 [0,2,0,0,0,0|0,0,2]=4 8166 B12R1.101 CC(=Cc1cc(cc(c1)F)C)C 271570a_100102525489_100011356977 [0,2,0,0,0,0|0,0,2]=4 8167 B12R1.101 CC(=Cc1cc(cc(c1)F)F)C 271570a_100102525489_100011218498 [0,2,0,0,0,0|0,0,2]=4 8168 B12R1.101 CC(=Cc1cc(cc(c1)F)N)C 271570a_100102525489_100011356972 [0,2,0,0,0,0|0,0,2]=4 8169 B12R1.101 CC(=Cc1cc(cc(c1)F)O)C 271570a_100102525489_100000717995 [0,2,0,0,0,0|0,0,2]=4 8170 B12R1.101 CC(=Cc1cc(cc(c1)N)C)C 271570a_100102525489_100000695972 [0,2,0,0,0,0|0,0,2]=4 8171 B12R1.101 CC(=Cc1cc(cc(c1)N)N)C 271570a_100102525489_100011999608 [0,2,0,0,0,0|0,0,2]=4 8172 B12R1.101 CC(=Cc1cc(cc(c1)O)C)C 271570a_100102525489_100011999630 [0,2,0,0,0,0|0,0,2]=4 8173 B12R1.101 CC(=Cc1cc(cc(c1)O)O)C 271570a_100102525489_100009868816 [0,2,0,0,0,0|0,0,2]=4 8174 B12R1.101 CC(=O)Cc1cc(cc(c1)Br)Br 1458a_100000070787_100011216082 [0,2,0,0,0,0|1,0,0]=3 8175 B12R1.101 CC(=O)Cc1cc(cc(c1)Br)Br 1458a_100010186705_200000210301 [0,2,0,0,0,0|1,0,0]=3 8176 B12R1.101 CC(=O)Cc1cc(cc(c1)Br)C 1458a_100000070787_100012348363 [0,2,0,0,0,0|1,0,0]=3 8177 B12R1.101 CC(=O)Cc1cc(cc(c1)Br)F 1458a_100000070787_100000766940 [0,2,0,0,0,0|1,0,0]=3 8178 B12R1.101 CC(=O)Cc1cc(cc(c1)Br)F 1458a_100011935118_200000210301 [0,2,0,0,0,0|1,0,0]=3 8179 B12R1.101 CC(=O)Cc1cc(cc(c1)C)C 1458a_100000070787_100000181317 [0,2,0,0,0,0|1,0,0]=3 8180 B12R1.101 CC(=O)Cc1cc(cc(c1)C)C 1458a_100011202310_200000210301 [0,2,0,0,0,0|1,0,0]=3 8181 B12R1.101 CC(=O)Cc1cc(cc(c1)Cl)Cl 1458a_100000070787_100011219208 [0,2,0,0,0,0|1,0,0]=3 8182 B12R1.101 CC(=O)Cc1cc(cc(c1)Cl)Cl 1458a_100012340057_200000210301 [0,2,0,0,0,0|1,0,0]=3 8183 B12R1.101 CC(=O)Cc1cc(cc(c1)Cl)F 1458a_100000070787_100011219885 [0,2,0,0,0,0|1,0,0]=3 8184 B12R1.101 CC(=O)Cc1cc(cc(c1)Cl)F 1458a_100011217690_200000210301 [0,2,0,0,0,0|1,0,0]=3 8185 B12R1.101 CC(=O)Cc1cc(cc(c1)F)C 1458a_100000070787_100011219130 [0,2,0,0,0,0|1,0,0]=3 8186 B12R1.101 CC(=O)Cc1cc(cc(c1)F)C 1458a_100011216671_200000210301 [0,2,0,0,0,0|1,0,0]=3 8187 B12R1.101 CC(=O)Cc1cc(cc(c1)F)F 1458a_100000070787_100000697002 [0,2,0,0,0,0|1,0,0]=3 8188 B12R1.101 CC(=O)Cc1cc(cc(c1)F)F 1458a_100011220011_200000210301 [0,2,0,0,0,0|1,0,0]=3 8189 B12R1.101 CC(=O)Cc1cc(cc(c1)I)Br 1458a_100000070787_100010146614 [0,2,0,0,0,0|1,0,0]=3 8190 B12R1.101 CC(=O)Cc1cc(cc(c1)I)F 1458a_100000070787_100010149605 [0,2,0,0,0,0|1,0,0]=3 8191 B12R1.101 CC(=O)Cc1cc(cc(n1)C)C 1458a_100000070787_100012357514 [0,2,0,0,0,0|2,0,0]=4 8192 B12R1.101 CC(=O)Cc1cc(nc(c1)C)C 1458a_100000070787_200000139866 [0,2,0,0,0,0|2,0,0]=4 8193 B12R1.101 CC(=O)Cc1cc(nc(c1)Cl)Cl 1458a_100000070787_100000052781 [0,2,0,0,0,0|2,0,0]=4 8194 B12R1.101 CC(=O)Nc1cc(cc(c1)Br)Br 11a_100012047176_100015343762 [0,2,0,0,0,0|2,0,0]=4 8195 B12R1.101 CC(=O)Nc1cc(cc(c1)Br)Br 1626a_100012047176_100015343762 [0,2,0,0,0,0|2,0,0]=4 8196 B12R1.101 CC(=O)Nc1cc(cc(c1)Br)Br 22a_100012047176_100000070787 [0,2,0,0,0,0|2,0,0]=4 8197 B12R1.101 CC(=O)Nc1cc(cc(c1)Br)Br 527a_100012047176_100103153847 [0,2,0,0,0,0|2,0,0]=4 8198 B12R1.101 CC(=O)Nc1cc(cc(c1)Br)C 11a_100000695972_100015343762 [0,2,0,0,0,0|2,0,0]=4 8199 B12R1.101 CC(=O)Nc1cc(cc(c1)Br)C 1626a_100000695972_100015343762 [0,2,0,0,0,0|2,0,0]=4 8200 B12R1.101 CC(=O)Nc1cc(cc(c1)Br)C 22a_100000695972_100000070787 [0,2,0,0,0,0|2,0,0]=4 8201 B12R1.101 CC(=O)Nc1cc(cc(c1)Br)C 527a_100000695972_100103153847 [0,2,0,0,0,0|2,0,0]=4 8202 B12R1.101 CC(=O)Nc1cc(cc(c1)Br)Cl 11a_100011934539_100015343762 [0,2,0,0,0,0|2,0,0]=4 8203 B12R1.101 CC(=O)Nc1cc(cc(c1)Br)Cl 1626a_100011934539_100015343762 [0,2,0,0,0,0|2,0,0]=4 8204 B12R1.101 CC(=O)Nc1cc(cc(c1)Br)Cl 22a_100011934539_100000070787 [0,2,0,0,0,0|2,0,0]=4 8205 B12R1.101 CC(=O)Nc1cc(cc(c1)Br)F 11a_100000705686_100015343762 [0,2,0,0,0,0|2,0,0]=4 8206 B12R1.101 CC(=O)Nc1cc(cc(c1)Br)F 1626a_100000705686_100015343762 [0,2,0,0,0,0|2,0,0]=4 8207 B12R1.101 CC(=O)Nc1cc(cc(c1)Br)F 22a_100000705686_100000070787 [0,2,0,0,0,0|2,0,0]=4 8208 B12R1.101 CC(=O)Nc1cc(cc(c1)C)C 11a_100000210930_100015343762 [0,2,0,0,0,0|2,0,0]=4 8209 B12R1.101 CC(=O)Nc1cc(cc(c1)C)C 1626a_100000210930_100015343762 [0,2,0,0,0,0|2,0,0]=4 8210 B12R1.101 CC(=O)Nc1cc(cc(c1)C)C 22a_100000210930_100000070787 [0,2,0,0,0,0|2,0,0]=4 8211 B12R1.101 CC(=O)Nc1cc(cc(c1)C)C 527a_100000210930_100103153847 [0,2,0,0,0,0|2,0,0]=4 8212 B12R1.101 CC(=O)Nc1cc(cc(c1)Cl)C 11a_100012022512_100015343762 [0,2,0,0,0,0|2,0,0]=4 8213 B12R1.101 CC(=O)Nc1cc(cc(c1)Cl)C 1626a_100012022512_100015343762 [0,2,0,0,0,0|2,0,0]=4 8214 B12R1.101 CC(=O)Nc1cc(cc(c1)Cl)C 22a_100012022512_100000070787 [0,2,0,0,0,0|2,0,0]=4 8215 B12R1.101 CC(=O)Nc1cc(cc(c1)Cl)Cl 11a_100000210456_100015343762 [0,2,0,0,0,0|2,0,0]=4 8216 B12R1.101 CC(=O)Nc1cc(cc(c1)Cl)Cl 1626a_100000210456_100015343762 [0,2,0,0,0,0|2,0,0]=4 8217 B12R1.101 CC(=O)Nc1cc(cc(c1)Cl)Cl 22a_100000210456_100000070787 [0,2,0,0,0,0|2,0,0]=4 8218 B12R1.101 CC(=O)Nc1cc(cc(c1)Cl)F 11a_100000686136_100015343762 [0,2,0,0,0,0|2,0,0]=4 8219 B12R1.101 CC(=O)Nc1cc(cc(c1)Cl)F 1626a_100000686136_100015343762 [0,2,0,0,0,0|2,0,0]=4 8220 B12R1.101 CC(=O)Nc1cc(cc(c1)Cl)F 22a_100000686136_100000070787 [0,2,0,0,0,0|2,0,0]=4 8221 B12R1.101 CC(=O)Nc1cc(cc(c1)Cl)O 1626a_100000123917_100015343762 [0,2,0,0,0,0|2,0,0]=4 8222 B12R1.101 CC(=O)Nc1cc(cc(c1)Cl)O 22a_100000123917_100000070787 [0,2,0,0,0,0|2,0,0]=4 8223 B12R1.101 CC(=O)Nc1cc(cc(c1)F)C 11a_100000742734_100015343762 [0,2,0,0,0,0|2,0,0]=4 8224 B12R1.101 CC(=O)Nc1cc(cc(c1)F)C 1626a_100000742734_100015343762 [0,2,0,0,0,0|2,0,0]=4 8225 B12R1.101 CC(=O)Nc1cc(cc(c1)F)C 22a_100000742734_100000070787 [0,2,0,0,0,0|2,0,0]=4 8226 B12R1.101 CC(=O)Nc1cc(cc(c1)F)C 527a_100000742734_100103153847 [0,2,0,0,0,0|2,0,0]=4 8227 B12R1.101 CC(=O)Nc1cc(cc(c1)F)F 11a_100000233717_100015343762 [0,2,0,0,0,0|2,0,0]=4 8228 B12R1.101 CC(=O)Nc1cc(cc(c1)F)F 1626a_100000233717_100015343762 [0,2,0,0,0,0|2,0,0]=4 8229 B12R1.101 CC(=O)Nc1cc(cc(c1)F)F 22a_100000233717_100000070787 [0,2,0,0,0,0|2,0,0]=4 8230 B12R1.101 CC(=O)Nc1cc(cc(c1)I)Br 11a_100009814763_100015343762 [0,2,0,0,0,0|2,0,0]=4 8231 B12R1.101 CC(=O)Nc1cc(cc(c1)I)Br 1626a_100009814763_100015343762 [0,2,0,0,0,0|2,0,0]=4 8232 B12R1.101 CC(=O)Nc1cc(cc(c1)I)Br 22a_100009814763_100000070787 [0,2,0,0,0,0|2,0,0]=4 8233 B12R1.101 CC(=O)Nc1cc(cc(c1)I)Br 527a_100009814763_100103153847 [0,2,0,0,0,0|2,0,0]=4 8234 B12R1.101 CC(=O)Nc1cc(cc(c1)I)Cl 11a_100010147676_100015343762 [0,2,0,0,0,0|2,0,0]=4 8235 B12R1.101 CC(=O)Nc1cc(cc(c1)I)Cl 1626a_100010147676_100015343762 [0,2,0,0,0,0|2,0,0]=4 8236 B12R1.101 CC(=O)Nc1cc(cc(c1)I)Cl 22a_100010147676_100000070787 [0,2,0,0,0,0|2,0,0]=4 8237 B12R1.101 CC(=O)Nc1cc(cc(c1)I)F 11a_100011356972_100015343762 [0,2,0,0,0,0|2,0,0]=4 8238 B12R1.101 CC(=O)Nc1cc(cc(c1)I)F 1626a_100011356972_100015343762 [0,2,0,0,0,0|2,0,0]=4 8239 B12R1.101 CC(=O)Nc1cc(cc(c1)I)F 22a_100011356972_100000070787 [0,2,0,0,0,0|2,0,0]=4 8240 B12R1.101 CC(=O)Nc1cc(cc(c1)I)I 11a_200000696836_100015343762 [0,2,0,0,0,0|2,0,0]=4 8241 B12R1.101 CC(=O)Nc1cc(cc(c1)I)I 1626a_200000696836_100015343762 [0,2,0,0,0,0|2,0,0]=4 8242 B12R1.101 CC(=O)Nc1cc(cc(c1)I)I 22a_200000696836_100000070787 [0,2,0,0,0,0|2,0,0]=4 8243 B12R1.101 CC(=O)Nc1cc(cc(c1)I)I 527a_200000696836_100103153847 [0,2,0,0,0,0|2,0,0]=4 8244 B12R1.101 CC(=O)Nc1cc(cc(c1)O)C 1626a_100011995906_100015343762 [0,2,0,0,0,0|2,0,0]=4 8245 B12R1.101 CC(=O)Nc1cc(cc(c1)O)C 22a_100011995906_100000070787 [0,2,0,0,0,0|2,0,0]=4 8246 B12R1.101 CC(=O)Nc1cc(cc(c1)O)C 527a_100011995906_100103153847 [0,2,0,0,0,0|2,0,0]=4 8247 B12R1.101 CC(=O)Nc1cc(cc(c1)O)O 527a_100000043371_100103153847 [0,2,0,0,0,0|2,0,0]=4 8248 B12R1.101 CC(=O)Oc1cc(cc(c1)F)O 271570a_203496583355_200015324874 [0,2,0,0,0,0|2,0,0]=4 8249 B12R1.101 CN(C)Cc1cc(cc(c1)Br)Br 2230a_100102631434_100011216082 [0,2,0,0,0,0|1,0,1]=4 8250 B12R1.101 CN(C)Cc1cc(cc(c1)Br)Br 269982a_100102631434_100011216082 [0,2,0,0,0,0|1,0,1]=4 8251 B12R1.101 CN(C)Cc1cc(cc(c1)Br)Br 270004a_100102631434_100000719502 [0,2,0,0,0,0|1,0,1]=4 8252 B12R1.101 CN(C)Cc1cc(cc(c1)Br)Cl 270004a_100102631434_100011934515 [0,2,0,0,0,0|1,0,1]=4 8253 B12R1.101 CN(C)Cc1cc(cc(c1)Br)F 2230a_100102631434_100000766940 [0,2,0,0,0,0|1,0,1]=4 8254 B12R1.101 CN(C)Cc1cc(cc(c1)Br)F 269982a_100102631434_100000766940 [0,2,0,0,0,0|1,0,1]=4 8255 B12R1.101 CN(C)Cc1cc(cc(c1)Br)F 270004a_100102631434_100011794424 [0,2,0,0,0,0|1,0,1]=4 8256 B12R1.101 CN(C)Cc1cc(cc(c1)Br)O 270004a_100102631434_100010176088 [0,2,0,0,0,0|1,0,1]=4 8257 B12R1.101 CN(C)Cc1cc(cc(c1)Cl)Cl 2230a_100016988021_200000210301 [0,2,0,0,0,0|1,0,1]=4 8258 B12R1.101 CN(C)Cc1cc(cc(c1)Cl)Cl 2230a_100102631434_100000685807 [0,2,0,0,0,0|1,0,1]=4 8259 B12R1.101 CN(C)Cc1cc(cc(c1)Cl)Cl 269982a_100016988021_200000210301 [0,2,0,0,0,0|1,0,1]=4 8260 B12R1.101 CN(C)Cc1cc(cc(c1)Cl)Cl 269982a_100102631434_100011219208 [0,2,0,0,0,0|1,0,1]=4 8261 B12R1.101 CN(C)Cc1cc(cc(c1)Cl)Cl 270004a_100102631434_100000741761 [0,2,0,0,0,0|1,0,1]=4 8262 B12R1.101 CN(C)Cc1cc(cc(c1)Cl)Cl 34a_100016988021_200000210301 [0,2,0,0,0,0|1,0,1]=4 8263 B12R1.101 CN(C)Cc1cc(cc(c1)Cl)F 2230a_100102631434_100011219885 [0,2,0,0,0,0|1,0,1]=4 8264 B12R1.101 CN(C)Cc1cc(cc(c1)Cl)F 269982a_100102631434_100011219885 [0,2,0,0,0,0|1,0,1]=4 8265 B12R1.101 CN(C)Cc1cc(cc(c1)Cl)F 270004a_100102631434_100000703917 [0,2,0,0,0,0|1,0,1]=4 8266 B12R1.101 CN(C)Cc1cc(cc(c1)Cl)O 270004a_100102631434_100000050827 [0,2,0,0,0,0|1,0,1]=4 8267 B12R1.101 CN(C)Cc1cc(cc(c1)F)F 2230a_100000720221_200000210301 [0,2,0,0,0,0|1,0,1]=4 8268 B12R1.101 CN(C)Cc1cc(cc(c1)F)F 2230a_100102631434_100000697002 [0,2,0,0,0,0|1,0,1]=4 8269 B12R1.101 CN(C)Cc1cc(cc(c1)F)F 269982a_100000720221_200000210301 [0,2,0,0,0,0|1,0,1]=4 8270 B12R1.101 CN(C)Cc1cc(cc(c1)F)F 269982a_100102631434_100000697002 [0,2,0,0,0,0|1,0,1]=4 8271 B12R1.101 CN(C)Cc1cc(cc(c1)F)F 270004a_100102631434_100000743029 [0,2,0,0,0,0|1,0,1]=4 8272 B12R1.101 CN(C)Cc1cc(cc(c1)F)F 34a_100000720221_200000210301 [0,2,0,0,0,0|1,0,1]=4 8273 B12R1.101 CN(C)Cc1cc(cc(c1)F)O 270004a_100102631434_100000703664 [0,2,0,0,0,0|1,0,1]=4 8274 B12R1.101 CN(C)Cc1cc(cc(c1)F)O 271570a_203496583355_100012630382 [0,2,0,0,0,0|1,0,1]=4 8275 B12R1.101 CN(C)Cc1cc(cc(c1)I)Br 2230a_100102631434_100010146614 [0,2,0,0,0,0|1,0,1]=4 8276 B12R1.101 CN(C)Cc1cc(cc(c1)I)Br 269982a_100102631434_100010146614 [0,2,0,0,0,0|1,0,1]=4 8277 B12R1.101 CN(C)Cc1cc(cc(c1)I)Br 270004a_100102631434_100010185649 [0,2,0,0,0,0|1,0,1]=4 8278 B12R1.101 CN(C)Cc1cc(cc(c1)I)F 2230a_100102631434_100010149605 [0,2,0,0,0,0|1,0,1]=4 8279 B12R1.101 CN(C)Cc1cc(cc(c1)I)F 269982a_100102631434_100010149605 [0,2,0,0,0,0|1,0,1]=4 8280 B12R1.101 CN(C)Cc1cc(cc(c1)I)F 270004a_100102631434_100010185655 [0,2,0,0,0,0|1,0,1]=4 8281 B12R1.101 CN([13CH3])Cc1cc(cc(c1)Cl)Cl 2230a_100016988021_200025704644 [0,2,0,0,0,0|1,0,1]=4 8282 B12R1.101 CN([13CH3])Cc1cc(cc(c1)Cl)Cl 269982a_100016988021_200025704644 [0,2,0,0,0,0|1,0,1]=4 8283 B12R1.101 CN([13CH3])Cc1cc(cc(c1)Cl)Cl 34a_100016988021_200025704644 [0,2,0,0,0,0|1,0,1]=4 8284 B12R1.101 CN([13CH3])Cc1cc(cc(c1)F)F 2230a_100000720221_200025704644 [0,2,0,0,0,0|1,0,1]=4 8285 B12R1.101 CN([13CH3])Cc1cc(cc(c1)F)F 269982a_100000720221_200025704644 [0,2,0,0,0,0|1,0,1]=4 8286 B12R1.101 CN([13CH3])Cc1cc(cc(c1)F)F 34a_100000720221_200025704644 [0,2,0,0,0,0|1,0,1]=4 8287 B12R1.101 Cc1cc(cc(c1)CC(=O)[13CH3])C 1458a_100011202310_200025704644 [0,2,0,0,0,0|1,0,0]=3 8288 B12R1.101 Cc1cc(cc(c1)CC(=O)[13CH3])F 1458a_100011216671_200025704644 [0,2,0,0,0,0|1,0,0]=3 8289 B12R1.101 Cc1cc(cc(c1)CN(C)C)Br 2230a_100102631434_100012348363 [0,2,0,0,0,0|1,0,1]=4 8290 B12R1.101 Cc1cc(cc(c1)CN(C)C)Br 269982a_100102631434_100012348363 [0,2,0,0,0,0|1,0,1]=4 8291 B12R1.101 Cc1cc(cc(c1)CN(C)C)Br 270004a_100102631434_100000686105 [0,2,0,0,0,0|1,0,1]=4 8292 B12R1.101 Cc1cc(cc(c1)CN(C)C)C 2230a_100102631434_100000181317 [0,2,0,0,0,0|1,0,1]=4 8293 B12R1.101 Cc1cc(cc(c1)CN(C)C)C 269982a_100102631434_100000181317 [0,2,0,0,0,0|1,0,1]=4 8294 B12R1.101 Cc1cc(cc(c1)CN(C)C)C 270004a_100102631434_100000745632 [0,2,0,0,0,0|1,0,1]=4 8295 B12R1.101 Cc1cc(cc(c1)CN(C)C)Cl 270004a_100102631434_100000684525 [0,2,0,0,0,0|1,0,1]=4 8296 B12R1.101 Cc1cc(cc(c1)CN(C)C)F 2230a_100102631434_100011219130 [0,2,0,0,0,0|1,0,1]=4 8297 B12R1.101 Cc1cc(cc(c1)CN(C)C)F 269982a_100102631434_100011219130 [0,2,0,0,0,0|1,0,1]=4 8298 B12R1.101 Cc1cc(cc(c1)CN(C)C)F 270004a_100102631434_100011217087 [0,2,0,0,0,0|1,0,1]=4 8299 B12R1.101 Cc1cc(cc(c1)CN(C)C)O 270004a_100102631434_100009853434 [0,2,0,0,0,0|1,0,1]=4 8300 B12R1.101 [13CH3]C(=O)Cc1cc(cc(c1)Br)Br 1458a_100010186705_200025704644 [0,2,0,0,0,0|1,0,0]=3 8301 B12R1.101 [13CH3]C(=O)Cc1cc(cc(c1)Br)F 1458a_100011935118_200025704644 [0,2,0,0,0,0|1,0,0]=3 8302 B12R1.101 [13CH3]C(=O)Cc1cc(cc(c1)Cl)Cl 1458a_100012340057_200025704644 [0,2,0,0,0,0|1,0,0]=3 8303 B12R1.101 [13CH3]C(=O)Cc1cc(cc(c1)Cl)F 1458a_100011217690_200025704644 [0,2,0,0,0,0|1,0,0]=3 8304 B12R1.101 [13CH3]C(=O)Cc1cc(cc(c1)F)F 1458a_100011220011_200025704644 [0,2,0,0,0,0|1,0,0]=3 8305 B12R1.119 CS(=O)(=O)Cc1cccc(c1)O 271570a_203496583355_200009814643 [0,2,0,0,0,0|2,0,0]=4 8306 B12R1.438 C#Cc1cccc(c1)NC(=O)C 11a_100000735509_100015343762 [0,2,0,0,0,0|2,0,0]=4 8307 B12R1.438 C#Cc1cccc(c1)NC(=O)C 1626a_100000735509_100015343762 [0,2,0,0,0,0|2,0,0]=4 8308 B12R1.438 C#Cc1cccc(c1)NC(=O)C 22a_100000735509_100000070787 [0,2,0,0,0,0|2,0,0]=4 8309 B12R1.438 C#Cc1cccc(c1)NC(=O)C 527a_100000735509_100103153847 [0,2,0,0,0,0|2,0,0]=4 8310 B12R1.438 C=Cc1cccc(c1)CC(=O)C 271570a_100011290941_100000689217 [0,2,0,0,0,0|1,0,0]=3 8311 B12R1.438 C=Cc1cccc(c1)CC(=O)N 271570a_100011290941_100011586816 [0,2,0,0,0,0|2,0,0]=4 8312 B12R1.438 C=Cc1cccc(c1)CC(C)C 271570a_100011290941_100010883412 [0,2,0,0,0,0|0,0,2]=4 8313 B12R1.438 C=Cc1cccc(c1)CN(C)C 270004a_100102631434_100011218069 [0,2,0,0,0,0|1,0,1]=4 8314 B12R1.438 C=Cc1cccc(c1)CN(C)C 271570a_100011290941_100000174759 [0,2,0,0,0,0|1,0,1]=4 8315 B12R1.438 C=Cc1cccc(c1)NC(=O)C 11a_100011827668_100015343762 [0,2,0,0,0,0|2,0,0]=4 8316 B12R1.438 C=Cc1cccc(c1)NC(=O)C 1626a_100011827668_100015343762 [0,2,0,0,0,0|2,0,0]=4 8317 B12R1.438 C=Cc1cccc(c1)NC(=O)C 22a_100011827668_100000070787 [0,2,0,0,0,0|2,0,0]=4 8318 B12R1.438 C=Cc1cccc(c1)NC(=O)C 271570a_100011290941_100000153616 [0,2,0,0,0,0|2,0,0]=4 8319 B12R1.438 C=Cc1cccc(c1)NC(=O)C 527a_100011827668_100103153847 [0,2,0,0,0,0|2,0,0]=4 8320 B12R1.438 C=Cc1cccc(c1)OC(=O)C 271570a_100011290941_100009811612 [0,2,0,0,0,0|2,0,0]=4 8321 B12R1.438 CC(=Cc1cccc(c1)C#N)C 271570a_100102525489_100000189340 [0,2,0,0,0,0|0,0,2]=4 8322 B12R1.438 CC(=Cc1cccc(c1)C=O)C 271570a_100102525489_100000014684 [0,2,0,0,0,0|0,0,2]=4 8323 B12R1.438 CC(=Cc1cccc(c1)CF)C 271570a_100102525489_100010878472 [0,2,0,0,0,0|0,0,2]=4 8324 B12R1.438 CC(=Cc1cccc(c1)CN)C 271570a_100102525489_100000106179 [0,2,0,0,0,0|0,0,2]=4 8325 B12R1.438 CC(=Cc1cccc(c1)CO)C 271570a_100102525489_100000687537 [0,2,0,0,0,0|0,0,2]=4 8326 B12R1.438 CC(=Cc1cccc(c1)NN)C 271570a_100102525489_100000217339 [0,2,0,0,0,0|0,0,2]=4 8327 B12R1.438 CC(=O)Cc1cccc(c1)C#N 1458a_100000070787_100000233786 [0,2,0,0,0,0|1,0,0]=3 8328 B12R1.438 CC(=O)Cc1cccc(c1)C#N 1458a_100000684415_200000210301 [0,2,0,0,0,0|1,0,0]=3 8329 B12R1.438 CC(=O)Cc1cccc(c1)C=O 1458a_100000070787_100009816774 [0,2,0,0,0,0|1,0,0]=3 8330 B12R1.438 CC(=O)Cc1cccc(c1)CO 1458a_100000070787_100010188025 [0,2,0,0,0,0|1,0,0]=3 8331 B12R1.438 CC(=O)Cc1cccc(c1)S[13CH3] 62a_100000689217_200025704644 [0,2,0,0,0,0|1,0,0]=3 8332 B12R1.438 CC(=O)Cc1cccc(c1)S[13CH3] 62a_200025704644_100000689217 [0,2,0,0,0,0|1,0,0]=3 8333 B12R1.438 CC(=O)Cc1cccc(n1)C#N 1458a_100000070787_100000097530 [0,2,0,0,0,0|2,0,0]=4 8334 B12R1.438 CC(=O)Cc1cccc(n1)CO 1458a_100000070787_100009813551 [0,2,0,0,0,0|2,0,0]=4 8335 B12R1.438 CC(=O)Cc1cncc(c1)C#N 1458a_100000070787_200020634941 [0,2,0,0,0,0|2,0,0]=4 8336 B12R1.438 CC(=O)Nc1cccc(c1)C#N 11a_100000210922_100015343762 [0,2,0,0,0,0|2,0,0]=4 8337 B12R1.438 CC(=O)Nc1cccc(c1)C#N 1626a_100000210922_100015343762 [0,2,0,0,0,0|2,0,0]=4 8338 B12R1.438 CC(=O)Nc1cccc(c1)C#N 22a_100000210922_100000070787 [0,2,0,0,0,0|2,0,0]=4 8339 B12R1.438 CC(=O)Nc1cccc(c1)C#N 527a_100000210922_100103153847 [0,2,0,0,0,0|2,0,0]=4 8340 B12R1.438 CC(=O)Nc1cccc(c1)CF 11a_100000126320_100015343762 [0,2,0,0,0,0|2,0,0]=4 8341 B12R1.438 CC(=O)Nc1cccc(c1)CF 1626a_100000126320_100015343762 [0,2,0,0,0,0|2,0,0]=4 8342 B12R1.438 CC(=O)Nc1cccc(c1)CF 22a_100000126320_100000070787 [0,2,0,0,0,0|2,0,0]=4 8343 B12R1.438 CC(=O)Nc1cccc(c1)CF 527a_100000126320_100103153847 [0,2,0,0,0,0|2,0,0]=4 8344 B12R1.438 CC(=O)Nc1cccc(c1)CO 22a_100000211919_100000070787 [0,2,0,0,0,0|2,0,0]=4 8345 B12R1.438 CC(=O)Nc1cccc(c1)N[13CH3] 34a_100000749408_200025704644 [0,2,0,0,0,0|2,0,0]=4 8346 B12R1.438 CC(=O)Nc1cccc(c1)O[13CH3] 34a_100000158604_200025704644 [0,2,0,0,0,0|2,0,0]=4 8347 B12R1.438 CC(=O)Nc1cccc(c1)O[13CH3] 7a_100000158604_200025704644 [0,2,0,0,0,0|2,0,0]=4 8348 B12R1.438 CC(=O)Nc1cccc(c1)S[13CH3] 62a_200025704644_100000153616 [0,2,0,0,0,0|2,0,0]=4 8349 B12R1.438 CC(=O)Oc1cccc(c1)O[13CH3] 7a_100011218754_200025704644 [0,2,0,0,0,0|2,0,0]=4 8350 B12R1.438 CC(=O)Oc1cccc(c1)S[13CH3] 62a_200025704644_100009811612 [0,2,0,0,0,0|2,0,0]=4 8351 B12R1.438 CC(C)Cc1cccc(c1)S[13CH3] 62a_100010883412_200025704644 [0,2,0,0,0,0|0,0,2]=4 8352 B12R1.438 CC(C)Cc1cccc(c1)S[13CH3] 62a_200025704644_100010883412 [0,2,0,0,0,0|0,0,2]=4 8353 B12R1.438 CCc1cccc(c1)C=C(C)C 271570a_100102525489_100000684523 [0,2,0,0,0,0|0,0,2]=4 8354 B12R1.438 CCc1cccc(c1)CN(C)C 270004a_100102631434_100011999841 [0,2,0,0,0,0|1,0,1]=4 8355 B12R1.438 CCc1cccc(c1)NC(=O)C 11a_100000211250_100015343762 [0,2,0,0,0,0|2,0,0]=4 8356 B12R1.438 CCc1cccc(c1)NC(=O)C 1626a_100000211250_100015343762 [0,2,0,0,0,0|2,0,0]=4 8357 B12R1.438 CCc1cccc(c1)NC(=O)C 22a_100000211250_100000070787 [0,2,0,0,0,0|2,0,0]=4 8358 B12R1.438 CCc1cccc(c1)NC(=O)C 527a_100000211250_100103153847 [0,2,0,0,0,0|2,0,0]=4 8359 B12R1.438 CN(C)Cc1cccc(c1)C#N 2230a_100000168042_200000210301 [0,2,0,0,0,0|1,0,1]=4 8360 B12R1.438 CN(C)Cc1cccc(c1)C#N 2230a_100102631434_100000233786 [0,2,0,0,0,0|1,0,1]=4 8361 B12R1.438 CN(C)Cc1cccc(c1)C#N 269982a_100000168042_200000210301 [0,2,0,0,0,0|1,0,1]=4 8362 B12R1.438 CN(C)Cc1cccc(c1)C#N 269982a_100102631434_100000233786 [0,2,0,0,0,0|1,0,1]=4 8363 B12R1.438 CN(C)Cc1cccc(c1)C#N 270004a_100102631434_100000241001 [0,2,0,0,0,0|1,0,1]=4 8364 B12R1.438 CN(C)Cc1cccc(c1)C#N 34a_100000168042_200000210301 [0,2,0,0,0,0|1,0,1]=4 8365 B12R1.438 CN(C)Cc1cccc(c1)C=O 2230a_100102631434_100009816774 [0,2,0,0,0,0|1,0,1]=4 8366 B12R1.438 CN(C)Cc1cccc(c1)C=O 269982a_100102631434_100009816774 [0,2,0,0,0,0|1,0,1]=4 8367 B12R1.438 CN(C)Cc1cccc(c1)CO 2230a_100102631434_100010188025 [0,2,0,0,0,0|1,0,1]=4 8368 B12R1.438 CN(C)Cc1cccc(c1)CO 269982a_100102631434_100010188025 [0,2,0,0,0,0|1,0,1]=4 8369 B12R1.438 CN(C)Cc1cccc(c1)CO 270004a_100102631434_200000050894 [0,2,0,0,0,0|1,0,1]=4 8370 B12R1.438 CN(C)Cc1cccc(c1)S[13CH3] 62a_100000174759_200025704644 [0,2,0,0,0,0|1,0,1]=4 8371 B12R1.438 CN(C)Cc1cccc(c1)S[13CH3] 62a_200025704644_100000174759 [0,2,0,0,0,0|1,0,1]=4 8372 B12R1.438 CN([13CH3])Cc1cccc(c1)C#N 2230a_100000168042_200025704644 [0,2,0,0,0,0|1,0,1]=4 8373 B12R1.438 CN([13CH3])Cc1cccc(c1)C#N 269982a_100000168042_200025704644 [0,2,0,0,0,0|1,0,1]=4 8374 B12R1.438 CN([13CH3])Cc1cccc(c1)C#N 34a_100000168042_200025704644 [0,2,0,0,0,0|1,0,1]=4 8375 B12R1.438 CNc1cccc(c1)C=C(C)C 271570a_100102525489_100000219648 [0,2,0,0,0,0|0,0,2]=4 8376 B12R1.438 CNc1cccc(c1)CC(=O)N 2230a_200011690101_200000210301 [0,2,0,0,0,0|2,0,0]=4 8377 B12R1.438 CNc1cccc(c1)CC(=O)N 34a_200011690101_200000210301 [0,2,0,0,0,0|2,0,0]=4 8378 B12R1.438 CNc1cccc(c1)NC(=O)C 34a_100000749408_200000210301 [0,2,0,0,0,0|2,0,0]=4 8379 B12R1.438 COc1cc(ccn1)CC(=O)C 1458a_100000070787_100103152439 [0,2,0,0,0,0|2,0,0]=4 8380 B12R1.438 COc1cc(ccn1)CC(=O)C 1458a_100000718155_200000210301 [0,2,0,0,0,0|2,0,0]=4 8381 B12R1.438 COc1cc(ccn1)CC(=O)[13CH3] 1458a_100000718155_200025704644 [0,2,0,0,0,0|2,0,0]=4 8382 B12R1.438 COc1cccc(c1)C=C(C)C 271570a_100102525489_100000170001 [0,2,0,0,0,0|0,0,2]=4 8383 B12R1.438 COc1cccc(c1)CC(=O)C 1458a_100000070787_100000211672 [0,2,0,0,0,0|1,0,0]=3 8384 B12R1.438 COc1cccc(c1)CC(=O)C 1458a_100000211281_200000210301 [0,2,0,0,0,0|1,0,0]=3 8385 B12R1.438 COc1cccc(c1)CC(=O)N 34a_200000747573_200000210301 [0,2,0,0,0,0|2,0,0]=4 8386 B12R1.438 COc1cccc(c1)CC(=O)N 7a_200000747573_200000210301 [0,2,0,0,0,0|2,0,0]=4 8387 B12R1.438 COc1cccc(c1)CC(=O)[13CH3] 1458a_100000211281_200025704644 [0,2,0,0,0,0|1,0,0]=3 8388 B12R1.438 COc1cccc(c1)CN(C)C 2230a_100000184262_200000210301 [0,2,0,0,0,0|1,0,1]=4 8389 B12R1.438 COc1cccc(c1)CN(C)C 2230a_100102631434_100000211672 [0,2,0,0,0,0|1,0,1]=4 8390 B12R1.438 COc1cccc(c1)CN(C)C 269982a_100000184262_200000210301 [0,2,0,0,0,0|1,0,1]=4 8391 B12R1.438 COc1cccc(c1)CN(C)C 269982a_100102631434_100000688526 [0,2,0,0,0,0|1,0,1]=4 8392 B12R1.438 COc1cccc(c1)CN(C)C 270004a_100102631434_100000170238 [0,2,0,0,0,0|1,0,1]=4 8393 B12R1.438 COc1cccc(c1)CN(C)[13CH3] 2230a_100000184262_200025704644 [0,2,0,0,0,0|1,0,1]=4 8394 B12R1.438 COc1cccc(c1)CN(C)[13CH3] 269982a_100000184262_200025704644 [0,2,0,0,0,0|1,0,1]=4 8395 B12R1.438 COc1cccc(c1)NC(=O)C 11a_100000210024_100015343762 [0,2,0,0,0,0|2,0,0]=4 8396 B12R1.438 COc1cccc(c1)NC(=O)C 1626a_100000210024_100015343762 [0,2,0,0,0,0|2,0,0]=4 8397 B12R1.438 COc1cccc(c1)NC(=O)C 22a_100000210024_100000070787 [0,2,0,0,0,0|2,0,0]=4 8398 B12R1.438 COc1cccc(c1)NC(=O)C 34a_100000158604_200000210301 [0,2,0,0,0,0|2,0,0]=4 8399 B12R1.438 COc1cccc(c1)NC(=O)C 527a_100000210024_100103153847 [0,2,0,0,0,0|2,0,0]=4 8400 B12R1.438 COc1cccc(c1)NC(=O)C 7a_100000158604_200000210301 [0,2,0,0,0,0|2,0,0]=4 8401 B12R1.438 COc1cccc(c1)OC(=O)C 7a_100011218754_200000210301 [0,2,0,0,0,0|2,0,0]=4 8402 B12R1.438 COc1cccc(n1)CC(=O)C 1458a_100000070787_100000755263 [0,2,0,0,0,0|2,0,0]=4 8403 B12R1.438 COc1ccnc(c1)CC(=O)C 1458a_100000070787_100000752681 [0,2,0,0,0,0|2,0,0]=4 8404 B12R1.438 CSc1cccc(c1)C=C(C)C 271570a_100102525489_100011215954 [0,2,0,0,0,0|0,0,2]=4 8405 B12R1.438 CSc1cccc(c1)CC(=O)C 1458a_100000035702_200000210301 [0,2,0,0,0,0|1,0,0]=3 8406 B12R1.438 CSc1cccc(c1)CC(=O)C 62a_100000689217_200000210301 [0,2,0,0,0,0|1,0,0]=3 8407 B12R1.438 CSc1cccc(c1)CC(=O)C 62a_200000210301_100000689217 [0,2,0,0,0,0|1,0,0]=3 8408 B12R1.438 CSc1cccc(c1)CC(=O)N 62a_100011586816_200000210301 [0,2,0,0,0,0|2,0,0]=4 8409 B12R1.438 CSc1cccc(c1)CC(=O)N 62a_200000210301_100011586816 [0,2,0,0,0,0|2,0,0]=4 8410 B12R1.438 CSc1cccc(c1)CC(=O)[13CH3] 1458a_100000035702_200025704644 [0,2,0,0,0,0|1,0,0]=3 8411 B12R1.438 CSc1cccc(c1)CC(C)C 62a_100010883412_200000210301 [0,2,0,0,0,0|0,0,2]=4 8412 B12R1.438 CSc1cccc(c1)CC(C)C 62a_200000210301_100010883412 [0,2,0,0,0,0|0,0,2]=4 8413 B12R1.438 CSc1cccc(c1)CN(C)C 2230a_100011934695_200000210301 [0,2,0,0,0,0|1,0,1]=4 8414 B12R1.438 CSc1cccc(c1)CN(C)C 269982a_100011934695_200000210301 [0,2,0,0,0,0|1,0,1]=4 8415 B12R1.438 CSc1cccc(c1)CN(C)C 270004a_100102631434_100011935093 [0,2,0,0,0,0|1,0,1]=4 8416 B12R1.438 CSc1cccc(c1)CN(C)C 62a_100000174759_200000210301 [0,2,0,0,0,0|1,0,1]=4 8417 B12R1.438 CSc1cccc(c1)CN(C)C 62a_200000210301_100000174759 [0,2,0,0,0,0|1,0,1]=4 8418 B12R1.438 CSc1cccc(c1)CN(C)[13CH3] 2230a_100011934695_200025704644 [0,2,0,0,0,0|1,0,1]=4 8419 B12R1.438 CSc1cccc(c1)CN(C)[13CH3] 269982a_100011934695_200025704644 [0,2,0,0,0,0|1,0,1]=4 8420 B12R1.438 CSc1cccc(c1)NC(=O)C 11a_100000210049_100015343762 [0,2,0,0,0,0|2,0,0]=4 8421 B12R1.438 CSc1cccc(c1)NC(=O)C 1626a_100000210049_100015343762 [0,2,0,0,0,0|2,0,0]=4 8422 B12R1.438 CSc1cccc(c1)NC(=O)C 22a_100000210049_100000070787 [0,2,0,0,0,0|2,0,0]=4 8423 B12R1.438 CSc1cccc(c1)NC(=O)C 527a_100000210049_100103153847 [0,2,0,0,0,0|2,0,0]=4 8424 B12R1.438 CSc1cccc(c1)NC(=O)C 62a_200000210301_100000153616 [0,2,0,0,0,0|2,0,0]=4 8425 B12R1.438 CSc1cccc(c1)OC(=O)C 62a_200000210301_100009811612 [0,2,0,0,0,0|2,0,0]=4 8426 B12R1.438 [13CH3]C(=O)Cc1cccc(c1)C#N 1458a_100000684415_200025704644 [0,2,0,0,0,0|1,0,0]=3 8427 B12R1.438 [13CH3]Nc1cccc(c1)CC(=O)N 2230a_200011690101_200025704644 [0,2,0,0,0,0|2,0,0]=4 8428 B12R1.438 [13CH3]Nc1cccc(c1)CC(=O)N 34a_200011690101_200025704644 [0,2,0,0,0,0|2,0,0]=4 8429 B12R1.438 [13CH3]Oc1cccc(c1)CC(=O)N 34a_200000747573_200025704644 [0,2,0,0,0,0|2,0,0]=4 8430 B12R1.438 [13CH3]Oc1cccc(c1)CC(=O)N 7a_200000747573_200025704644 [0,2,0,0,0,0|2,0,0]=4 8431 B12R1.438 [13CH3]Sc1cccc(c1)CC(=O)N 62a_100011586816_200025704644 [0,2,0,0,0,0|2,0,0]=4 8432 B12R1.438 [13CH3]Sc1cccc(c1)CC(=O)N 62a_200025704644_100011586816 [0,2,0,0,0,0|2,0,0]=4 8433 B10R1.66 C=C(C)COc1ccsc1 34a_100000106738_100000748629 [0,0,1,1,0,0|2,0,0]=4 8434 B10R1.66 C=C(C)COc1ccsc1 7a_100000106738_100000748629 [0,0,1,1,0,0|2,0,0]=4 8435 B10R1.66 C=C(C)CSc1ccco1 62a_100000748629_100009814098 [0,0,1,1,0,0|2,0,0]=4 8436 B10R1.66 C=C(C)CSc1ccco1 62a_100009814098_100000211660 [0,0,1,1,0,0|2,0,0]=4 8437 B10R1.66 C=C(C)CSc1cccs1 62a_100000748629_100011215356 [0,0,1,1,0,0|2,0,0]=4 8438 B10R1.66 C=C(C)CSc1cccs1 62a_100011215356_100000211660 [0,0,1,1,0,0|2,0,0]=4 8439 B10R1.66 C=C(C)CSc1ccoc1 62a_100000748629_100011215275 [0,0,1,1,0,0|2,0,0]=4 8440 B10R1.66 C=C(C)CSc1ccoc1 62a_100011215275_100000211660 [0,0,1,1,0,0|2,0,0]=4 8441 B10R1.66 C=C(C)CSc1ccsc1 62a_100000738268_100000211660 [0,0,1,1,0,0|2,0,0]=4 8442 B10R1.66 C=C(C)CSc1ccsc1 62a_100000748629_100000738268 [0,0,1,1,0,0|2,0,0]=4 8443 B10R1.8 C=Cc1cc([nH]c(=O)c1)C 271570a_100011290941_100009861981 [0,0,1,1,0,0|2,0,0]=4 8444 B10R1.8 C=Cc1cc(cc(c1)C)C 271570a_100011290941_100011215608 [0,0,1,1,0,0|0,0,2]=4 8445 B10R1.8 C=Cc1cc(cc(c1)Cl)C 271570a_100011290941_100010172791 [0,0,1,1,0,0|1,0,1]=4 8446 B10R1.8 C=Cc1cc(cc(c1)F)C 271570a_100011290941_100011356977 [0,0,1,1,0,0|1,0,1]=4 8447 B10R1.8 C=Cc1cc(cc(c1)N)C 271570a_100011290941_100000695972 [0,0,1,1,0,0|1,0,1]=4 8448 B10R1.8 C=Cc1cc(cc(c1)O)C 271570a_100011290941_100011999630 [0,0,1,1,0,0|1,0,1]=4 8449 B10R1.8 C=Cc1cc(nc(c1)C)C 271570a_100011290941_100009816552 [0,0,1,1,0,0|1,0,1]=4 8450 B10R1.8 C=Cc1cc(nc(c1)F)C 271570a_100011290941_100010006595 [0,0,1,1,0,0|2,0,0]=4 8451 B10R1.8 C=Cc1cc(nc(c1)N)C 271570a_100011290941_100000076705 [0,0,1,1,0,0|2,0,0]=4 8452 B10R1.32 C=Cc1cc(sc1C=O)C 271570a_100011290941_100011361552 [0,0,1,1,0,0|2,0,0]=4 8453 B10R2.6 c1cc(ccn1)C2CC2 271570a_100011220607_100000035832 [1,0,0,1,0,0|1,0,1]=4 8454 B10R2.6 c1ccc(cc1)C2CC2 271570a_100011220607_100000210277 [1,0,0,1,0,0|0,0,1]=3 8455 B10R2.6 c1ccc(nc1)C2CC2 271570a_100011220607_100011216584 [1,0,0,1,0,0|1,0,1]=4 8456 B10R2.6 c1cncc(c1)C2CC2 271570a_100011220607_100000752921 [1,0,0,1,0,0|1,0,1]=4 8457 B12R2.11 CN1C[C@@H]1Cc2ccccc2 2230a_100016998360_200000210301 [0,0,0,1,0,1|1,0,1]=4 8458 B12R2.11 CN1C[C@@H]1Cc2ccccc2 269982a_100016998360_200000210301 [0,0,0,1,0,1|1,0,1]=4 8459 B12R2.11 CN1C[C@@H]1Cc2ccccc2 34a_100016998360_200000210301 [0,0,0,1,0,1|1,0,1]=4 8460 B12R2.11 [13CH3]N1C[C@@H]1Cc2ccccc2 2230a_100016998360_200025704644 [0,0,0,1,0,1|1,0,1]=4 8461 B12R2.11 [13CH3]N1C[C@@H]1Cc2ccccc2 269982a_100016998360_200025704644 [0,0,0,1,0,1|1,0,1]=4 8462 B12R2.11 [13CH3]N1C[C@@H]1Cc2ccccc2 34a_100016998360_200025704644 [0,0,0,1,0,1|1,0,1]=4 8463 B12R2.24 CN1CCc2ccccc2C1 2230a_100000188457_200000210301 [0,0,0,1,0,1|1,0,1]=4 8464 B12R2.24 CN1CCc2ccccc2C1 269982a_100000188457_200000210301 [0,0,0,1,0,1|1,0,1]=4 8465 B12R2.24 CN1CCc2ccccc2C1 34a_100000188457_200000210301 [0,0,0,1,0,1|1,0,1]=4 8466 B12R2.24 Oc1cc2ccccc2cn1 271570a_203496583355_100000047361 [0,0,0,1,0,1|1,0,1]=4 8467 B12R2.24 Oc1ccc2ccccc2c1 271570a_203496583355_100000233703 [0,0,0,1,0,1|1,0,1]=4 8468 B12R2.24 Oc1cnc2ccccc2c1 271570a_203496583355_100000737414 [0,0,0,1,0,1|1,0,1]=4 8469 B12R2.24 [13CH3]N1CCc2ccccc2C1 2230a_100000188457_200025704644 [0,0,0,1,0,1|1,0,1]=4 8470 B12R2.24 [13CH3]N1CCc2ccccc2C1 269982a_100000188457_200025704644 [0,0,0,1,0,1|1,0,1]=4 8471 B12R2.24 [13CH3]N1CCc2ccccc2C1 34a_100000188457_200025704644 [0,0,0,1,0,1|1,0,1]=4 8472 B12R2.2057 c1ccc(cc1)CNC2CC2 34a_100000212008_100015291786 [0,0,0,1,0,1|0,0,2]=4 8473 B12R2.2057 c1ccc(cc1)CNC2CC2 34a_100015324214_100000211595 [0,0,0,1,0,1|0,0,2]=4 8474 B12R2.2057 c1ccc(cc1)COC2CC2 34a_100000210790_100000211595 [0,0,0,1,0,1|0,0,2]=4 8475 B12R2.2057 c1ccc(cc1)CSC2CC2 62a_100000211182_100000211595 [0,0,0,1,0,1|0,0,2]=4 8476 B12R2.2057 c1ccc(cc1)NCC2CC2 34a_100000106764_100000742324 [0,0,0,1,0,1|0,0,2]=4 8477 B12R2.2057 c1ccc(cc1)NCC2CO2 34a_100000106764_102125554688 [0,0,0,1,0,1|1,0,1]=4 8478 B12R2.2057 c1ccc(cc1)OCC2CC2 34a_100000210340_100000742324 [0,0,0,1,0,1|0,0,2]=4 8479 B12R2.2057 c1ccc(cc1)OCC2CC2 7a_100000210340_100000742324 [0,0,0,1,0,1|0,0,2]=4 8480 B12R2.2057 c1ccc(cc1)OCC2CO2 34a_100000210340_102125554688 [0,0,0,1,0,1|1,0,1]=4 8481 B12R2.2057 c1ccc(cc1)OCC2CO2 7a_100000210340_102125554688 [0,0,0,1,0,1|1,0,1]=4 8482 B12R2.2057 c1ccc(cc1)OCC2CS2 7a_100000210340_100000031435 [0,0,0,1,0,1|1,0,1]=4 8483 B12R2.2057 c1ccc(cc1)OC[C@@H]2CO2 7a_100000210340_100000745022 [0,0,0,1,0,1|1,0,1]=4 8484 B12R2.2057 c1ccc(cc1)SCC2CC2 62a_100000719477_100000742324 [0,0,0,1,0,1|0,0,2]=4 8485 B12R2.2057 c1ccc(cc1)SCC2CC2 62a_100000756562_100000041952 [0,0,0,1,0,1|0,0,2]=4 8486 B12R2.2057 c1ccc(cc1)SCC2CO2 62a_100000719477_102125554688 [0,0,0,1,0,1|1,0,1]=4 8487 B12R2.2057 c1ccc(cc1)SCC2CO2 62a_102125554688_100000041952 [0,0,0,1,0,1|1,0,1]=4 8488 B12R2.2057 c1ccc(cc1)SCC2CS2 62a_100000031435_100000041952 [0,0,0,1,0,1|1,0,1]=4 8489 B12R2.2057 c1ccc(cc1)SCC2CS2 62a_100000719477_100000031435 [0,0,0,1,0,1|1,0,1]=4 8490 B12R2.2057 c1ccc(cc1)SC[C@@H]2CO2 62a_100000719477_100000745022 [0,0,0,1,0,1|1,0,1]=4 8491 B12R2.2057 c1ccc(cc1)SC[C@@H]2CO2 62a_100000745022_100000041952 [0,0,0,1,0,1|1,0,1]=4 8492 B12R2.3190 CC(=O)C1Cc2c1cccc2 1458a_200000238571_200000210301 [0,0,0,1,0,1|1,0,0]=3 8493 B12R2.3190 CN(C)C1Cc2c1cccc2 269982a_100102631434_100009813401 [0,0,0,1,0,1|1,0,1]=4 8494 B12R2.3190 [13CH3]C(=O)C1Cc2c1cccc2 1458a_200000238571_200025704644 [0,0,0,1,0,1|1,0,0]=3 8495 B12R2.79 NC1CC1c2ccc(cc2)O 271570a_203496583355_100000755575 [0,1,0,1,0,0|1,0,1]=4 8496 B12R2.606 CN1Cc2ccc(cc2C1)Br 2230a_100000702344_200000210301 [0,1,0,1,0,0|1,0,1]=4 8497 B12R2.606 CN1Cc2ccc(cc2C1)Br 269982a_100000702344_200000210301 [0,1,0,1,0,0|1,0,1]=4 8498 B12R2.606 CN1Cc2ccc(cc2C1)Br 34a_100000702344_200000210301 [0,1,0,1,0,0|1,0,1]=4 8499 B12R2.606 CN1Cc2ccc(cc2C1)Cl 2230a_100015205306_200000210301 [0,1,0,1,0,0|1,0,1]=4 8500 B12R2.606 CN1Cc2ccc(cc2C1)Cl 269982a_100015205306_200000210301 [0,1,0,1,0,0|1,0,1]=4 8501 B12R2.606 CN1Cc2ccc(cc2C1)Cl 34a_100015205306_200000210301 [0,1,0,1,0,0|1,0,1]=4 8502 B12R2.606 CN1Cc2ccc(cc2C1)F 2230a_100000766377_200000210301 [0,1,0,1,0,0|1,0,1]=4 8503 B12R2.606 CN1Cc2ccc(cc2C1)F 269982a_100000766377_200000210301 [0,1,0,1,0,0|1,0,1]=4 8504 B12R2.606 CN1Cc2ccc(cc2C1)F 34a_100000766377_200000210301 [0,1,0,1,0,0|1,0,1]=4 8505 B12R2.606 CN1Cc2ccc(cc2C1)O 2230a_100015195982_200000210301 [0,1,0,1,0,0|1,0,1]=4 8506 B12R2.606 CN1Cc2ccc(cc2C1)O 269982a_100015195982_200000210301 [0,1,0,1,0,0|1,0,1]=4 8507 B12R2.606 CN1Cc2ccc(cc2C1)O 34a_100015195982_200000210301 [0,1,0,1,0,0|1,0,1]=4 8508 B12R2.606 Cc1cc2cc(ccc2[nH]1)O 271570a_203496583355_100011214893 [0,1,0,1,0,0|1,0,0]=3 8509 B12R2.606 Cc1cc2cc(ccc2s1)O 271570a_203496583355_100000695401 [0,1,0,1,0,0|1,0,0]=3 8510 B12R2.606 Cc1cc2cc(cnc2[nH]1)O 271570a_203496583355_100010202332 [0,1,0,1,0,0|2,0,0]=4 8511 B12R2.606 Cc1cc2ccc(cc2[nH]1)O 271570a_203496583355_100010196937 [0,1,0,1,0,0|1,0,0]=3 8512 B12R2.606 Cc1cc2ncc(cc2[nH]1)O 271570a_203496583355_100010168555 [0,1,0,1,0,0|2,0,0]=4 8513 B12R2.606 Cc1cn2cc(ccc2n1)O 271570a_203496583355_100000194050 [0,1,0,1,0,0|2,0,0]=4 8514 B12R2.606 Cc1cn2ccc(cc2n1)O 271570a_203496583355_100000724326 [0,1,0,1,0,0|2,0,0]=4 8515 B12R2.606 Cc1nc2cc(ccc2[nH]1)O 271570a_203496583355_100011264012 [0,1,0,1,0,0|2,0,0]=4 8516 B12R2.606 Cc1nc2cc(ccc2o1)O 271570a_203496583355_100009816932 [0,1,0,1,0,0|2,0,0]=4 8517 B12R2.606 Cc1nc2cc(ccc2s1)O 271570a_203496583355_100009813953 [0,1,0,1,0,0|2,0,0]=4 8518 B12R2.606 Cc1nc2ccc(cc2o1)O 271570a_203496583355_100010171164 [0,1,0,1,0,0|2,0,0]=4 8519 B12R2.606 Cc1nc2ccc(cc2s1)O 271570a_203496583355_100009813144 [0,1,0,1,0,0|2,0,0]=4 8520 B12R2.606 Cn1cc2cc(ccc2n1)O 271570a_203496583355_100009817163 [0,1,0,1,0,0|2,0,0]=4 8521 B12R2.606 Cn1cc2ccc(cc2n1)O 271570a_203496583355_100009817169 [0,1,0,1,0,0|2,0,0]=4 8522 B12R2.606 NC1Cc2ccc(cc2C1)O 271570a_203496583355_100015193702 [0,1,0,1,0,0|1,0,1]=4 8523 B12R2.606 O=C1Cc2cc(ccc2N1)O 271570a_203496583355_100000754858 [0,1,0,1,0,0|2,0,0]=4 8524 B12R2.606 O=C1Cc2ccc(cc2C1)O 271570a_203496583355_100010185598 [0,1,0,1,0,0|1,0,0]=3 8525 B12R2.606 O=C1Cc2ccc(cc2N1)O 271570a_203496583355_100000760487 [0,1,0,1,0,0|2,0,0]=4 8526 B12R2.606 Oc1cc2cc(ccc2[nH]1)Br 271570a_203496583355_100011012855 [0,1,0,1,0,0|2,0,0]=4 8527 B12R2.606 Oc1cc2cc(ccc2s1)Br 271570a_203496583355_200010198765 [0,1,0,1,0,0|2,0,0]=4 8528 B12R2.606 Oc1ccc2c(c1)CC(C2)O 271570a_203496583355_100010161096 [0,1,0,1,0,0|1,0,1]=4 8529 B12R2.606 [13CH3]N1Cc2ccc(cc2C1)Br 2230a_100000702344_200025704644 [0,1,0,1,0,0|1,0,1]=4 8530 B12R2.606 [13CH3]N1Cc2ccc(cc2C1)Br 269982a_100000702344_200025704644 [0,1,0,1,0,0|1,0,1]=4 8531 B12R2.606 [13CH3]N1Cc2ccc(cc2C1)Br 34a_100000702344_200025704644 [0,1,0,1,0,0|1,0,1]=4 8532 B12R2.606 [13CH3]N1Cc2ccc(cc2C1)Cl 2230a_100015205306_200025704644 [0,1,0,1,0,0|1,0,1]=4 8533 B12R2.606 [13CH3]N1Cc2ccc(cc2C1)Cl 269982a_100015205306_200025704644 [0,1,0,1,0,0|1,0,1]=4 8534 B12R2.606 [13CH3]N1Cc2ccc(cc2C1)Cl 34a_100015205306_200025704644 [0,1,0,1,0,0|1,0,1]=4 8535 B12R2.606 [13CH3]N1Cc2ccc(cc2C1)F 2230a_100000766377_200025704644 [0,1,0,1,0,0|1,0,1]=4 8536 B12R2.606 [13CH3]N1Cc2ccc(cc2C1)F 269982a_100000766377_200025704644 [0,1,0,1,0,0|1,0,1]=4 8537 B12R2.606 [13CH3]N1Cc2ccc(cc2C1)F 34a_100000766377_200025704644 [0,1,0,1,0,0|1,0,1]=4 8538 B12R2.606 [13CH3]N1Cc2ccc(cc2C1)O 2230a_100015195982_200025704644 [0,1,0,1,0,0|1,0,1]=4 8539 B12R2.606 [13CH3]N1Cc2ccc(cc2C1)O 269982a_100015195982_200025704644 [0,1,0,1,0,0|1,0,1]=4 8540 B12R2.606 [13CH3]N1Cc2ccc(cc2C1)O 34a_100015195982_200025704644 [0,1,0,1,0,0|1,0,1]=4 8541 B12R2.18 Cc1c(sc2c1cccc2)O 271570a_203496583355_200010198769 [0,1,0,1,0,0|2,0,0]=4 8542 B12R2.18 Cc1nc2ccccn2c1O 271570a_203496583355_100009816614 [0,1,0,1,0,0|2,0,0]=4 8543 B12R2.18 Cc1oc2ccccc2c1O 271570a_203496583355_200010236113 [0,1,0,1,0,0|1,0,0]=3 8544 B12R2.18 Cc1sc2ccccc2c1O 271570a_203496583355_100010002616 [0,1,0,1,0,0|1,0,0]=3 8545 B12R2.18 Cn1c(nc2c1cccc2)O 271570a_203496583355_200000239431 [0,1,0,1,0,0|2,0,0]=4 8546 B12R2.18 Cn1nc2ccccc2c1O 271570a_203496583355_100010163699 [0,1,0,1,0,0|2,0,0]=4 8547 B12R2.23 CN1CCC1c2ccccc2 2230a_100000739605_200000210301 [0,1,0,1,0,0|1,0,1]=4 8548 B12R2.23 CN1CCC1c2ccccc2 269982a_100000739605_200000210301 [0,1,0,1,0,0|1,0,1]=4 8549 B12R2.23 [13CH3]N1CCC1c2ccccc2 2230a_100000739605_200025704644 [0,1,0,1,0,0|1,0,1]=4 8550 B12R2.23 [13CH3]N1CCC1c2ccccc2 269982a_100000739605_200025704644 [0,1,0,1,0,0|1,0,1]=4 8551 B12R2.27 CN[C@H]1C[C@@H]1c2ccccc2 2230a_100020588832_200000210301 [0,1,0,1,0,0|0,0,2]=4 8552 B12R2.27 CN[C@H]1C[C@@H]1c2ccccc2 34a_100020588832_200000210301 [0,1,0,1,0,0|0,0,2]=4 8553 B12R2.27 [13CH3]N[C@H]1C[C@@H]1c2ccccc2 2230a_100020588832_200025704644 [0,1,0,1,0,0|0,0,2]=4 8554 B12R2.27 [13CH3]N[C@H]1C[C@@H]1c2ccccc2 34a_100020588832_200025704644 [0,1,0,1,0,0|0,0,2]=4 8555 B12R2.32 C=Cc1cc2ccccc2[nH]1 271570a_100011290941_100010232065 [0,1,0,1,0,0|1,0,1]=4 8556 B12R2.32 C=Cc1cc2ccccc2o1 271570a_100011290941_100010159458 [0,1,0,1,0,0|1,0,1]=4 8557 B12R2.32 C=Cc1cc2ccccc2s1 271570a_100011290941_100009816949 [0,1,0,1,0,0|1,0,1]=4 8558 B12R2.32 C=Cc1nc2ccccc2[nH]1 271570a_100011290941_100009814255 [0,1,0,1,0,0|2,0,0]=4 8559 B12R2.32 C=Cc1nc2ccccc2s1 271570a_100011290941_100000751744 [0,1,0,1,0,0|2,0,0]=4 8560 B12R2.32 CCN1Cc2ccccc2C1 2230a_100000752595_100000210202 [0,1,0,1,0,0|1,0,1]=4 8561 B12R2.32 CCN1Cc2ccccc2C1 269982a_100000752595_100000204670 [0,1,0,1,0,0|1,0,1]=4 8562 B12R2.32 CCN1Cc2ccccc2C1 34a_100000752595_100000210202 [0,1,0,1,0,0|1,0,1]=4 8563 B12R2.32 CNC1Cc2ccccc2C1 2230a_100000753258_200000210301 [0,1,0,1,0,0|0,0,2]=4 8564 B12R2.32 CNC1Cc2ccccc2C1 34a_100000753258_200000210301 [0,1,0,1,0,0|0,0,2]=4 8565 B12R2.32 CNC1Cc2ccccc2C1 34a_100102657272_100000753484 [0,1,0,1,0,0|0,0,2]=4 8566 B12R2.32 CNC1Cc2ccccc2C1 7a_106832991635_100000753484 [0,1,0,1,0,0|0,0,2]=4 8567 B12R2.32 CNc1nc2ccccc2[nH]1 27a_100102657272_100009814255 [0,1,0,1,0,0|2,0,0]=4 8568 B12R2.32 CNc1nc2ccccc2s1 27a_100102657272_100000751744 [0,1,0,1,0,0|2,0,0]=4 8569 B12R2.32 COC1Cc2ccccc2C1 34a_100011215286_200000210301 [0,1,0,1,0,0|0,0,2]=4 8570 B12R2.32 COC1Cc2ccccc2C1 34a_100138415774_100000753484 [0,1,0,1,0,0|0,0,2]=4 8571 B12R2.32 CSC1Cc2ccccc2C1 62a_200000210301_100000753484 [0,1,0,1,0,0|0,0,2]=4 8572 B12R2.32 CSc1cc2ccccc2[nH]1 62a_200000210301_100010232065 [0,1,0,1,0,0|1,0,0]=3 8573 B12R2.32 CSc1cc2ccccc2o1 62a_200000210301_100010159458 [0,1,0,1,0,0|1,0,0]=3 8574 B12R2.32 CSc1cc2ccccc2s1 62a_200000210301_100009816949 [0,1,0,1,0,0|1,0,0]=3 8575 B12R2.32 CSc1cc2cccnc2[nH]1 62a_200000210301_100010079843 [0,1,0,1,0,0|2,0,0]=4 8576 B12R2.32 CSc1cn2ccccc2n1 62a_200000210301_100009819586 [0,1,0,1,0,0|2,0,0]=4 8577 B12R2.32 CSc1nc2ccccc2[nH]1 62a_200000210301_100009814255 [0,1,0,1,0,0|2,0,0]=4 8578 B12R2.32 CSc1nc2ccccc2s1 62a_200000210301_100000751744 [0,1,0,1,0,0|2,0,0]=4 8579 B12R2.32 FCN1Cc2ccccc2C1 269982a_100000752595_100015361967 [0,1,0,1,0,0|1,0,1]=4 8580 B12R2.32 FCN1Cc2ccccc2C1 34a_100000752595_100015361967 [0,1,0,1,0,0|1,0,1]=4 8581 B12R2.32 [13CH3]NC1Cc2ccccc2C1 2230a_100000753258_200025704644 [0,1,0,1,0,0|0,0,2]=4 8582 B12R2.32 [13CH3]NC1Cc2ccccc2C1 34a_100000753258_200025704644 [0,1,0,1,0,0|0,0,2]=4 8583 B12R2.32 [13CH3]OC1Cc2ccccc2C1 34a_100011215286_200025704644 [0,1,0,1,0,0|0,0,2]=4 8584 B12R2.32 [13CH3]SC1Cc2ccccc2C1 62a_200025704644_100000753484 [0,1,0,1,0,0|0,0,2]=4 8585 B12R2.32 [13CH3]Sc1cc2ccccc2[nH]1 62a_200025704644_100010232065 [0,1,0,1,0,0|1,0,0]=3 8586 B12R2.32 [13CH3]Sc1cc2ccccc2o1 62a_200025704644_100010159458 [0,1,0,1,0,0|1,0,0]=3 8587 B12R2.32 [13CH3]Sc1cc2ccccc2s1 62a_200025704644_100009816949 [0,1,0,1,0,0|1,0,0]=3 8588 B12R2.32 [13CH3]Sc1cc2cccnc2[nH]1 62a_200025704644_100010079843 [0,1,0,1,0,0|2,0,0]=4 8589 B12R2.32 [13CH3]Sc1cn2ccccc2n1 62a_200025704644_100009819586 [0,1,0,1,0,0|2,0,0]=4 8590 B12R2.32 [13CH3]Sc1nc2ccccc2[nH]1 62a_200025704644_100009814255 [0,1,0,1,0,0|2,0,0]=4 8591 B12R2.32 [13CH3]Sc1nc2ccccc2s1 62a_200025704644_100000751744 [0,1,0,1,0,0|2,0,0]=4 8592 B12R2.2058 c1ccc(cc1)CN2CCC2 269982a_100000754969_100000211182 [0,1,0,1,0,0|1,0,1]=4 8593 B12R2.202 CC1=Cc2cccc(c2C1)O 271570a_203496583355_100010271545 [0,1,0,1,0,0|0,0,0]=2 8594 B12R2.202 CN1Cc2cccc(c2C1)Br 2230a_100000703859_200000210301 [0,1,0,1,0,0|1,0,1]=4 8595 B12R2.202 CN1Cc2cccc(c2C1)Br 269982a_100000703859_200000210301 [0,1,0,1,0,0|1,0,1]=4 8596 B12R2.202 CN1Cc2cccc(c2C1)Br 34a_100000703859_200000210301 [0,1,0,1,0,0|1,0,1]=4 8597 B12R2.202 CN1Cc2cccc(c2C1)Cl 2230a_100000731892_200000210301 [0,1,0,1,0,0|1,0,1]=4 8598 B12R2.202 CN1Cc2cccc(c2C1)Cl 269982a_100000731892_200000210301 [0,1,0,1,0,0|1,0,1]=4 8599 B12R2.202 CN1Cc2cccc(c2C1)Cl 34a_100000731892_200000210301 [0,1,0,1,0,0|1,0,1]=4 8600 B12R2.202 CN1Cc2cccc(c2C1)F 269982a_100000051403_200000210301 [0,1,0,1,0,0|1,0,1]=4 8601 B12R2.202 CN1Cc2cccc(c2C1)F 34a_100000051403_200000210301 [0,1,0,1,0,0|1,0,1]=4 8602 B12R2.202 CN1Cc2cccc(c2C1)O 269982a_100015191671_200000210301 [0,1,0,1,0,0|1,0,1]=4 8603 B12R2.202 CN1Cc2cccc(c2C1)O 34a_100015191671_200000210301 [0,1,0,1,0,0|1,0,1]=4 8604 B12R2.202 Cc1cc2c(cccc2[nH]1)O 271570a_203496583355_100010143266 [0,1,0,1,0,0|1,0,0]=3 8605 B12R2.202 Cc1cc2c(ccnc2[nH]1)O 271570a_203496583355_100010202352 [0,1,0,1,0,0|2,0,0]=4 8606 B12R2.202 Cc1cccc2c1CN(C2)C 2230a_100020635169_200000210301 [0,1,0,1,0,0|1,0,1]=4 8607 B12R2.202 Cc1cccc2c1CN(C2)C 269982a_100020635169_200000210301 [0,1,0,1,0,0|1,0,1]=4 8608 B12R2.202 Cc1cccc2c1CN(C2)C 34a_100020635169_200000210301 [0,1,0,1,0,0|1,0,1]=4 8609 B12R2.202 Cc1cccc2c1CN(C2)[13CH3] 2230a_100020635169_200025704644 [0,1,0,1,0,0|1,0,1]=4 8610 B12R2.202 Cc1cccc2c1CN(C2)[13CH3] 269982a_100020635169_200025704644 [0,1,0,1,0,0|1,0,1]=4 8611 B12R2.202 Cc1cccc2c1CN(C2)[13CH3] 34a_100020635169_200025704644 [0,1,0,1,0,0|1,0,1]=4 8612 B12R2.202 Cc1cn2c(cccc2n1)O 271570a_203496583355_100009817088 [0,1,0,1,0,0|2,0,0]=4 8613 B12R2.202 Cc1nc2c(cccc2[nH]1)O 271570a_203496583355_100012360556 [0,1,0,1,0,0|2,0,0]=4 8614 B12R2.202 Cc1nc2c(cccc2o1)O 271570a_203496583355_100010883239 [0,1,0,1,0,0|2,0,0]=4 8615 B12R2.202 Cc1nc2c(cccc2s1)O 271570a_203496583355_100010236672 [0,1,0,1,0,0|2,0,0]=4 8616 B12R2.202 Cc1nc2cccc(c2o1)O 271570a_203496583355_100010168998 [0,1,0,1,0,0|2,0,0]=4 8617 B12R2.202 Cc1nc2cccc(c2s1)O 271570a_203496583355_100010236699 [0,1,0,1,0,0|2,0,0]=4 8618 B12R2.202 Cn1cc2c(cccc2n1)O 271570a_203496583355_100009817162 [0,1,0,1,0,0|2,0,0]=4 8619 B12R2.202 Cn1cc2cccc(c2n1)O 271570a_203496583355_100009817170 [0,1,0,1,0,0|2,0,0]=4 8620 B12R2.202 Nc1cc2cccc(c2s1)O 271570a_203496583355_100010090802 [0,1,0,1,0,0|2,0,0]=4 8621 B12R2.202 O=C1Cc2c(cccc2N1)O 271570a_203496583355_100009816812 [0,1,0,1,0,0|2,0,0]=4 8622 B12R2.202 O=C1Cc2cccc(c2C1)O 271570a_203496583355_100010205903 [0,1,0,1,0,0|1,0,0]=3 8623 B12R2.202 O=C1Cc2cccc(c2N1)O 271570a_203496583355_100000767046 [0,1,0,1,0,0|2,0,0]=4 8624 B12R2.202 Oc1cc2cccc(c2[nH]1)Br 271570a_203496583355_100135389745 [0,1,0,1,0,0|2,0,0]=4 8625 B12R2.202 Oc1cccc2c1CC(C2)O 271570a_203496583355_100010752598 [0,1,0,1,0,0|1,0,1]=4 8626 B12R2.202 [13CH3]N1Cc2cccc(c2C1)Br 2230a_100000703859_200025704644 [0,1,0,1,0,0|1,0,1]=4 8627 B12R2.202 [13CH3]N1Cc2cccc(c2C1)Br 269982a_100000703859_200025704644 [0,1,0,1,0,0|1,0,1]=4 8628 B12R2.202 [13CH3]N1Cc2cccc(c2C1)Br 34a_100000703859_200025704644 [0,1,0,1,0,0|1,0,1]=4 8629 B12R2.202 [13CH3]N1Cc2cccc(c2C1)Cl 2230a_100000731892_200025704644 [0,1,0,1,0,0|1,0,1]=4 8630 B12R2.202 [13CH3]N1Cc2cccc(c2C1)Cl 269982a_100000731892_200025704644 [0,1,0,1,0,0|1,0,1]=4 8631 B12R2.202 [13CH3]N1Cc2cccc(c2C1)Cl 34a_100000731892_200025704644 [0,1,0,1,0,0|1,0,1]=4 8632 B12R2.202 [13CH3]N1Cc2cccc(c2C1)F 269982a_100000051403_200025704644 [0,1,0,1,0,0|1,0,1]=4 8633 B12R2.202 [13CH3]N1Cc2cccc(c2C1)F 34a_100000051403_200025704644 [0,1,0,1,0,0|1,0,1]=4 8634 B12R2.202 [13CH3]N1Cc2cccc(c2C1)O 269982a_100015191671_200025704644 [0,1,0,1,0,0|1,0,1]=4 8635 B12R2.202 [13CH3]N1Cc2cccc(c2C1)O 34a_100015191671_200025704644 [0,1,0,1,0,0|1,0,1]=4 8636 B8R1.8 CC=Cc1ccco1 271570a_100016259895_100009814098 [1,0,0,0,1,0|1,0,1]=4 8637 B8R1.8 CC=Cc1cccs1 271570a_100016259895_100011215356 [1,0,0,0,1,0|1,0,1]=4 8638 B8R1.8 CC=Cc1ccoc1 271570a_100016259895_100011215275 [1,0,0,0,1,0|1,0,1]=4 8639 B8R1.8 CC=Cc1ccsc1 271570a_100016259895_100000738268 [1,0,0,0,1,0|1,0,1]=4 8640 B8R1.8 CNCc1ccco1 207a_100102657272_100000186105 [1,0,0,0,1,0|2,0,0]=4 8641 B8R1.8 CNCc1ccco1 2230a_100000185738_200000210301 [1,0,0,0,1,0|2,0,0]=4 8642 B8R1.8 CNCc1ccco1 270004a_106832991635_100000186105 [1,0,0,0,1,0|2,0,0]=4 8643 B8R1.8 CNCc1ccco1 34a_100000185738_200000210301 [1,0,0,0,1,0|2,0,0]=4 8644 B8R1.8 CNCc1cccs1 207a_100102657272_100000209959 [1,0,0,0,1,0|2,0,0]=4 8645 B8R1.8 CNCc1cccs1 2230a_100000211653_200000210301 [1,0,0,0,1,0|2,0,0]=4 8646 B8R1.8 CNCc1cccs1 270004a_106832991635_100000209959 [1,0,0,0,1,0|2,0,0]=4 8647 B8R1.8 CNCc1ccoc1 207a_100102657272_100011215517 [1,0,0,0,1,0|2,0,0]=4 8648 B8R1.8 CNCc1ccoc1 2230a_100015206860_200000210301 [1,0,0,0,1,0|2,0,0]=4 8649 B8R1.8 CNCc1ccoc1 270004a_106832991635_100011215517 [1,0,0,0,1,0|2,0,0]=4 8650 B8R1.8 CNCc1ccoc1 34a_100015206860_200000210301 [1,0,0,0,1,0|2,0,0]=4 8651 B8R1.8 CNCc1ccsc1 207a_100102657272_100000188534 [1,0,0,0,1,0|2,0,0]=4 8652 B8R1.8 CNCc1ccsc1 2230a_100000186416_200000210301 [1,0,0,0,1,0|2,0,0]=4 8653 B8R1.8 CNCc1ccsc1 2230a_106832991635_100011261437 [1,0,0,0,1,0|2,0,0]=4 8654 B8R1.8 CNCc1ccsc1 270004a_106832991635_100000188534 [1,0,0,0,1,0|2,0,0]=4 8655 B8R1.8 CNCc1ccsc1 34a_100000186416_200000210301 [1,0,0,0,1,0|2,0,0]=4 8656 B8R1.8 CNCc1ccsc1 34a_100102657272_100011261437 [1,0,0,0,1,0|2,0,0]=4 8657 B8R1.8 CNCc1ccsc1 7a_106832991635_100011261437 [1,0,0,0,1,0|2,0,0]=4 8658 B8R1.8 COCc1ccco1 34a_100000210059_200000210301 [1,0,0,0,1,0|2,0,0]=4 8659 B8R1.8 COCc1cccs1 34a_100000211240_200000210301 [1,0,0,0,1,0|2,0,0]=4 8660 B8R1.8 COCc1ccoc1 34a_100011215357_200000210301 [1,0,0,0,1,0|2,0,0]=4 8661 B8R1.8 COCc1ccsc1 34a_100011215551_200000210301 [1,0,0,0,1,0|2,0,0]=4 8662 B8R1.8 COCc1ccsc1 34a_100138415774_100011261437 [1,0,0,0,1,0|2,0,0]=4 8663 B8R1.8 CSCc1ccsc1 62a_100011261437_200000210301 [1,0,0,0,1,0|2,0,0]=4 8664 B8R1.8 CSCc1ccsc1 62a_200000210301_100011233845 [1,0,0,0,1,0|2,0,0]=4 8665 B8R1.8 [13CH3]NCc1ccco1 2230a_100000185738_200025704644 [1,0,0,0,1,0|2,0,0]=4 8666 B8R1.8 [13CH3]NCc1ccco1 34a_100000185738_200025704644 [1,0,0,0,1,0|2,0,0]=4 8667 B8R1.8 [13CH3]NCc1cccs1 2230a_100000211653_200025704644 [1,0,0,0,1,0|2,0,0]=4 8668 B8R1.8 [13CH3]NCc1ccoc1 2230a_100015206860_200025704644 [1,0,0,0,1,0|2,0,0]=4 8669 B8R1.8 [13CH3]NCc1ccoc1 34a_100015206860_200025704644 [1,0,0,0,1,0|2,0,0]=4 8670 B8R1.8 [13CH3]NCc1ccsc1 2230a_100000186416_200025704644 [1,0,0,0,1,0|2,0,0]=4 8671 B8R1.8 [13CH3]NCc1ccsc1 34a_100000186416_200025704644 [1,0,0,0,1,0|2,0,0]=4 8672 B8R1.8 [13CH3]OCc1ccco1 34a_100000210059_200025704644 [1,0,0,0,1,0|2,0,0]=4 8673 B8R1.8 [13CH3]OCc1cccs1 34a_100000211240_200025704644 [1,0,0,0,1,0|2,0,0]=4 8674 B8R1.8 [13CH3]OCc1ccoc1 34a_100011215357_200025704644 [1,0,0,0,1,0|2,0,0]=4 8675 B8R1.8 [13CH3]OCc1ccsc1 34a_100011215551_200025704644 [1,0,0,0,1,0|2,0,0]=4 8676 B8R1.8 [13CH3]SCc1ccsc1 62a_100011261437_200025704644 [1,0,0,0,1,0|2,0,0]=4 8677 B8R1.8 [13CH3]SCc1ccsc1 62a_200025704644_100011233845 [1,0,0,0,1,0|2,0,0]=4 8678 B8R1.7 C=C(C)c1c[nH]cn1 271570a_100000694244_100000756875 [0,0,0,0,2,0|2,0,0]=4 8679 B8R1.7 C=C(C)c1cc[nH]n1 271570a_100000694244_100000062575 [0,0,0,0,2,0|2,0,0]=4 8680 B8R1.7 C=C(C)c1ccco1 271570a_100000694244_100009814098 [0,0,0,0,2,0|1,0,0]=3 8681 B8R1.7 C=C(C)c1cccs1 271570a_100000694244_100011215356 [0,0,0,0,2,0|1,0,0]=3 8682 B8R1.7 C=C(C)c1ccoc1 271570a_100000694244_100011215275 [0,0,0,0,2,0|1,0,0]=3 8683 B8R1.7 C=C(C)c1ccsc1 271570a_100000694244_100000738268 [0,0,0,0,2,0|1,0,0]=3 8684 B8R1.7 C=C(C)c1ccsn1 271570a_100000694244_100009818082 [0,0,0,0,2,0|2,0,0]=4 8685 B8R1.7 C=C(C)c1cn[nH]c1 271570a_100000694244_100000238712 [0,0,0,0,2,0|2,0,0]=4 8686 B8R1.7 C=C(C)c1cnco1 271570a_100000694244_100020591547 [0,0,0,0,2,0|2,0,0]=4 8687 B8R1.7 C=C(C)c1cncs1 271570a_100000694244_100011934649 [0,0,0,0,2,0|2,0,0]=4 8688 B8R1.7 C=C(C)c1cnoc1 271570a_100000694244_100009815712 [0,0,0,0,2,0|2,0,0]=4 8689 B8R1.7 C=C(C)c1cnsc1 271570a_100000694244_100009815736 [0,0,0,0,2,0|2,0,0]=4 8690 B8R1.7 C=C(C)c1cscn1 271570a_100000694244_100000751502 [0,0,0,0,2,0|2,0,0]=4 8691 B8R1.7 C=C(C)c1ncc[nH]1 271570a_100000694244_100025796157 [0,0,0,0,2,0|2,0,0]=4 8692 B8R1.7 C=C(C)c1ncco1 271570a_100000694244_100011787736 [0,0,0,0,2,0|2,0,0]=4 8693 B8R1.7 C=C(C)c1nccs1 271570a_100000694244_100000211983 [0,0,0,0,2,0|2,0,0]=4 8694 B10R0.27 C=CCC(C=C)OCC(=C)C 34a_100000038011_100000748629 [0,0,1,0,0,1|0,0,2]=4 8695 B10R0.27 C=CCC(C=C)OCC(=C)C 7a_100000038011_100000748629 [0,0,1,0,0,1|0,0,2]=4 8696 B12R1.252 C=C(C)C=NNc1ccccc1 4a_100015195140_100000210575 [0,0,0,0,0,2|0,0,1]=3 8697 B12R1.252 C=C(C)C=NNc1ccccn1 4a_100000183288_100000210575 [0,0,0,0,0,2|1,0,1]=4 8698 B12R1.252 C=C(C)C=NNc1cccnc1 4a_100000728903_100000210575 [0,0,0,0,0,2|1,0,1]=4 8699 B12R1.252 C=C(C)C=NNc1ccncc1 4a_100000698918_100000210575 [0,0,0,0,0,2|1,0,1]=4 8700 B12R1.252 C=C(C)CCNc1ccccc1 34a_100000106764_100000730704 [0,0,0,0,0,2|0,0,0]=2 8701 B12R1.252 C=C(C)CCOc1ccccc1 34a_100000210340_100000730704 [0,0,0,0,0,2|0,0,0]=2 8702 B12R1.252 C=C(C)CCOc1ccccc1 7a_100000210340_100000730704 [0,0,0,0,0,2|0,0,0]=2 8703 B12R1.252 C=C(C)CCOc1cccnc1 34a_100000210849_100000730704 [0,0,0,0,0,2|1,0,0]=3 8704 B12R1.252 C=C(C)CCOc1cccnc1 7a_100000210849_100000730704 [0,0,0,0,0,2|1,0,0]=3 8705 B12R1.252 C=C(C)CCOc1ccncc1 34a_100000212176_100000730704 [0,0,0,0,0,2|1,0,0]=3 8706 B12R1.252 C=C(C)CCOc1ccnnc1 34a_100015204005_100000730704 [0,0,0,0,0,2|2,0,0]=4 8707 B12R1.252 C=C(C)CCOc1cncnc1 7a_100000754086_100000730704 [0,0,0,0,0,2|2,0,0]=4 8708 B12R1.252 C=C(C)CCSc1ccccc1 62a_100000719477_100000730704 [0,0,0,0,0,2|0,0,0]=2 8709 B12R1.252 C=C(C)CCSc1ccccc1 62a_100000730704_100000041952 [0,0,0,0,0,2|0,0,0]=2 8710 B12R1.252 C=C(C)CCSc1ccccn1 62a_100000730704_100011216584 [0,0,0,0,0,2|1,0,0]=3 8711 B12R1.252 C=C(C)CCSc1ccccn1 62a_100011216584_100000730704 [0,0,0,0,0,2|1,0,0]=3 8712 B12R1.252 C=C(C)CCSc1cccnc1 62a_100000210063_100000730704 [0,0,0,0,0,2|1,0,0]=3 8713 B12R1.252 C=C(C)CCSc1cccnc1 62a_100000730704_100000210063 [0,0,0,0,0,2|1,0,0]=3 8714 B12R1.252 C=C(C)CCSc1cccnn1 62a_100000730704_100016991348 [0,0,0,0,0,2|2,0,0]=4 8715 B12R1.252 C=C(C)CCSc1cccnn1 62a_100016991348_100000730704 [0,0,0,0,0,2|2,0,0]=4 8716 B12R1.252 C=C(C)CCSc1ccncc1 62a_100000728582_100000730704 [0,0,0,0,0,2|1,0,0]=3 8717 B12R1.252 C=C(C)CCSc1ccncc1 62a_100000730704_100000728582 [0,0,0,0,0,2|1,0,0]=3 8718 B12R1.252 C=C(C)CCSc1ccncn1 62a_100000703185_100000730704 [0,0,0,0,0,2|2,0,0]=4 8719 B12R1.252 C=C(C)CCSc1ccncn1 62a_100000730704_100000703185 [0,0,0,0,0,2|2,0,0]=4 8720 B12R1.252 C=C(C)CCSc1ccnnc1 62a_100000730704_100000732662 [0,0,0,0,0,2|2,0,0]=4 8721 B12R1.252 C=C(C)CCSc1ccnnc1 62a_100000732662_100000730704 [0,0,0,0,0,2|2,0,0]=4 8722 B12R1.252 C=C(C)CCSc1cnccn1 62a_100000211759_100000730704 [0,0,0,0,0,2|2,0,0]=4 8723 B12R1.252 C=C(C)CCSc1cnccn1 62a_100000730704_100000211759 [0,0,0,0,0,2|2,0,0]=4 8724 B12R1.252 C=C(C)CCSc1cncnc1 62a_100000730704_100011206942 [0,0,0,0,0,2|2,0,0]=4 8725 B12R1.252 C=C(C)CCSc1cncnc1 62a_100011206942_100000730704 [0,0,0,0,0,2|2,0,0]=4 8726 B12R1.252 C=C(C)CCSc1ncccn1 62a_100000211032_100000730704 [0,0,0,0,0,2|2,0,0]=4 8727 B12R1.252 C=C(C)CCSc1ncccn1 62a_100000730704_100000211032 [0,0,0,0,0,2|2,0,0]=4 8728 B12R1.252 C=C(C)CNCc1ccccc1 2230a_100015324214_100000748629 [0,0,0,0,0,2|0,0,0]=2 8729 B12R1.252 C=C(C)CNCc1ccccc1 34a_100015324214_100000748629 [0,0,0,0,0,2|0,0,0]=2 8730 B12R1.252 C=C(C)CNCc1cccnn1 2230a_100159270163_100000748629 [0,0,0,0,0,2|2,0,0]=4 8731 B12R1.252 C=C(C)CNCc1cncnc1 2230a_100011243677_100000748629 [0,0,0,0,0,2|2,0,0]=4 8732 B12R1.252 C=C(C)COCc1ccccc1 34a_100000210245_100015291786 [0,0,0,0,0,2|0,0,0]=2 8733 B12R1.252 C=C(C)COCc1ccccc1 34a_100000210790_100000748629 [0,0,0,0,0,2|0,0,0]=2 8734 B12R1.252 C=C(C)COCc1ccccc1 7a_100000210790_100000748629 [0,0,0,0,0,2|0,0,0]=2 8735 B12R1.252 C=C(C)COCc1ccccn1 34a_100000210245_100000721315 [0,0,0,0,0,2|1,0,0]=3 8736 B12R1.252 C=C(C)COCc1cccnc1 34a_100000210245_100000733263 [0,0,0,0,0,2|1,0,0]=3 8737 B12R1.252 C=C(C)COCc1cccnn1 34a_100000210245_100016990269 [0,0,0,0,0,2|2,0,0]=4 8738 B12R1.252 C=C(C)COCc1cnccn1 34a_100000210245_100016995436 [0,0,0,0,0,2|2,0,0]=4 8739 B12R1.252 C=C(C)COCc1cncnc1 34a_100000210245_100015196519 [0,0,0,0,0,2|2,0,0]=4 8740 B12R1.252 C=C(C)COCc1ncccn1 34a_100000210245_100000703007 [0,0,0,0,0,2|2,0,0]=4 8741 B12R1.252 C=C(C)CSCc1ccccc1 62a_100000211182_100000211660 [0,0,0,0,0,2|0,0,0]=2 8742 B12R1.252 C=C(C)CSCc1ccccc1 62a_100000748629_100015291786 [0,0,0,0,0,2|0,0,0]=2 8743 B12R1.252 C=C(C)CSCc1ccccn1 62a_100000721315_100000211660 [0,0,0,0,0,2|1,0,0]=3 8744 B12R1.252 C=C(C)CSCc1ccccn1 62a_100000748629_100000721315 [0,0,0,0,0,2|1,0,0]=3 8745 B12R1.252 C=C(C)CSCc1cccnc1 62a_100000741622_100000211660 [0,0,0,0,0,2|1,0,0]=3 8746 B12R1.252 C=C(C)CSCc1cccnc1 62a_100000748629_100000741622 [0,0,0,0,0,2|1,0,0]=3 8747 B12R1.252 C=C(C)CSCc1cccnn1 62a_100000748629_100016990269 [0,0,0,0,0,2|2,0,0]=4 8748 B12R1.252 C=C(C)CSCc1cccnn1 62a_100016990269_100000211660 [0,0,0,0,0,2|2,0,0]=4 8749 B12R1.252 C=C(C)CSCc1ccncc1 62a_100000748629_100015193705 [0,0,0,0,0,2|1,0,0]=3 8750 B12R1.252 C=C(C)CSCc1ccncc1 62a_100015193705_100000211660 [0,0,0,0,0,2|1,0,0]=3 8751 B12R1.252 C=C(C)CSCc1cnccn1 62a_100000748629_100016995436 [0,0,0,0,0,2|2,0,0]=4 8752 B12R1.252 C=C(C)CSCc1cnccn1 62a_100016995436_100000211660 [0,0,0,0,0,2|2,0,0]=4 8753 B12R1.252 C=C(C)CSCc1cncnc1 62a_100000748629_100015196519 [0,0,0,0,0,2|2,0,0]=4 8754 B12R1.252 C=C(C)CSCc1cncnc1 62a_100015196519_100000211660 [0,0,0,0,0,2|2,0,0]=4 8755 B12R1.252 C=C(C)CSCc1ncccn1 62a_100000703007_100000211660 [0,0,0,0,0,2|2,0,0]=4 8756 B12R1.252 C=C(C)CSCc1ncccn1 62a_100000748629_100000703007 [0,0,0,0,0,2|2,0,0]=4 8757 B12R1.252 C=C(F)CNCc1ccccc1 2230a_100015324214_100009893438 [0,0,0,0,0,2|1,0,0]=3 8758 B12R1.252 C=C(F)CNCc1ccccc1 34a_100015324214_100009893438 [0,0,0,0,0,2|1,0,0]=3 8759 B12R1.252 C=C(F)COCc1ccccc1 34a_100000210790_100009893438 [0,0,0,0,0,2|1,0,0]=3 8760 B12R1.252 C=C(F)COCc1ccccc1 34a_200010262243_100015291786 [0,0,0,0,0,2|1,0,0]=3 8761 B12R1.252 C=C(F)COCc1ccccc1 7a_100000210790_100000042424 [0,0,0,0,0,2|1,0,0]=3 8762 B12R1.252 C=C(F)COCc1ccccn1 34a_200010262243_100000721315 [0,0,0,0,0,2|2,0,0]=4 8763 B12R1.252 C=C(F)COCc1cccnc1 34a_200010262243_100000733263 [0,0,0,0,0,2|2,0,0]=4 8764 B12R1.252 C=C(F)CSCc1ccccc1 62a_100000042424_100015291786 [0,0,0,0,0,2|1,0,0]=3 8765 B12R1.252 C=C(F)CSCc1ccccc1 62a_100000211182_100000042424 [0,0,0,0,0,2|1,0,0]=3 8766 B12R1.252 C=C(F)CSCc1ccccn1 62a_100000042424_100000721315 [0,0,0,0,0,2|2,0,0]=4 8767 B12R1.252 C=C(F)CSCc1ccccn1 62a_100000721315_100000042424 [0,0,0,0,0,2|2,0,0]=4 8768 B12R1.252 C=C(F)CSCc1cccnc1 62a_100000042424_100000741622 [0,0,0,0,0,2|2,0,0]=4 8769 B12R1.252 C=C(F)CSCc1cccnc1 62a_100000741622_100000042424 [0,0,0,0,0,2|2,0,0]=4 8770 B12R1.252 C=C(F)CSCc1ccncc1 62a_100000042424_100015193705 [0,0,0,0,0,2|2,0,0]=4 8771 B12R1.252 C=C(F)CSCc1ccncc1 62a_100015193705_100000042424 [0,0,0,0,0,2|2,0,0]=4 8772 B12R1.252 CC(=CCNc1ccccc1)C 34a_100000106764_100000761012 [0,0,0,0,0,2|0,0,1]=3 8773 B12R1.252 CC(=CCOc1ccccc1)C 34a_100000210340_100000761012 [0,0,0,0,0,2|0,0,1]=3 8774 B12R1.252 CC(=CCOc1ccccc1)C 7a_100000210340_100000761012 [0,0,0,0,0,2|0,0,1]=3 8775 B12R1.252 CC(=CCOc1cccnc1)C 34a_100000210849_100000761012 [0,0,0,0,0,2|1,0,1]=4 8776 B12R1.252 CC(=CCOc1cccnc1)C 7a_100000210849_100000761012 [0,0,0,0,0,2|1,0,1]=4 8777 B12R1.252 CC(=CCOc1ccncc1)C 34a_100000212176_100000761012 [0,0,0,0,0,2|1,0,1]=4 8778 B12R1.252 CC(=CCSc1ccccc1)C 62a_100000719477_100000761012 [0,0,0,0,0,2|0,0,1]=3 8779 B12R1.252 CC(=CCSc1ccccc1)C 62a_100000761012_100000041952 [0,0,0,0,0,2|0,0,1]=3 8780 B12R1.252 CC(=CCSc1ccccn1)C 62a_100000761012_100011216584 [0,0,0,0,0,2|1,0,1]=4 8781 B12R1.252 CC(=CCSc1ccccn1)C 62a_100011216584_100000761012 [0,0,0,0,0,2|1,0,1]=4 8782 B12R1.252 CC(=CCSc1cccnc1)C 62a_100000210063_100000761012 [0,0,0,0,0,2|1,0,1]=4 8783 B12R1.252 CC(=CCSc1cccnc1)C 62a_100000761012_100000210063 [0,0,0,0,0,2|1,0,1]=4 8784 B12R1.252 CC(=CCSc1ccncc1)C 62a_100000728582_100000761012 [0,0,0,0,0,2|1,0,1]=4 8785 B12R1.252 CC(=CCSc1ccncc1)C 62a_100000761012_100000728582 [0,0,0,0,0,2|1,0,1]=4 8786 B12R1.252 CC(=O)C/C=C/c1ccccc1 1458a_100000070787_100016265936 [0,0,0,0,0,2|1,0,0]=3 8787 B12R1.252 CC(=O)C/C=C/c1ccccc1 1458a_100011219626_200000210301 [0,0,0,0,0,2|1,0,0]=3 8788 B12R1.252 CC(=O)C=CSc1ccccc1 1458a_100016262050_200000210301 [0,0,0,0,0,2|1,0,1]=4 8789 B12R1.252 CC(=O)CC#Cc1ccccc1 1458a_100000070787_100011352542 [0,0,0,0,0,2|1,0,0]=3 8790 B12R1.252 CC(=O)CCCc1ccccc1 1458a_100000070787_100000211621 [0,0,0,0,0,2|1,0,0]=3 8791 B12R1.252 CC(=O)CCCc1ccccc1 1458a_100011207963_200000210301 [0,0,0,0,0,2|1,0,0]=3 8792 B12R1.252 CC(=O)CCCc1ccccn1 1458a_100000752327_200000210301 [0,0,0,0,0,2|2,0,0]=4 8793 B12R1.252 CC(=O)CCCc1ccncc1 1458a_100020654287_200000210301 [0,0,0,0,0,2|2,0,0]=4 8794 B12R1.252 CC(=O)CCOc1ccccc1 1458a_100000070787_100000184471 [0,0,0,0,0,2|1,0,0]=3 8795 B12R1.252 CC(=O)CCOc1ccccc1 1458a_100000182761_200000210301 [0,0,0,0,0,2|1,0,0]=3 8796 B12R1.252 CC(=O)CCOc1ccccc1 7a_100000210340_100000053229 [0,0,0,0,0,2|1,0,0]=3 8797 B12R1.252 CC(=O)CCOc1cccnc1 7a_100000210849_100000053229 [0,0,0,0,0,2|2,0,0]=4 8798 B12R1.252 CC(=O)CCSc1ccccc1 1458a_100000070787_100000246102 [0,0,0,0,0,2|1,0,0]=3 8799 B12R1.252 CC(=O)CCSc1ccccc1 1458a_100000182436_200000210301 [0,0,0,0,0,2|1,0,0]=3 8800 B12R1.252 CC(=O)CCSc1ccccc1 62a_100000053229_100000041952 [0,0,0,0,0,2|1,0,0]=3 8801 B12R1.252 CC(=O)CCSc1ccccc1 62a_100000719477_100000053229 [0,0,0,0,0,2|1,0,0]=3 8802 B12R1.252 CC(=O)CCSc1ccccn1 62a_100000053229_100011216584 [0,0,0,0,0,2|2,0,0]=4 8803 B12R1.252 CC(=O)CCSc1ccccn1 62a_100011216584_100000053229 [0,0,0,0,0,2|2,0,0]=4 8804 B12R1.252 CC(=O)CCSc1cccnc1 62a_100000053229_100000210063 [0,0,0,0,0,2|2,0,0]=4 8805 B12R1.252 CC(=O)CCSc1cccnc1 62a_100000210063_100000053229 [0,0,0,0,0,2|2,0,0]=4 8806 B12R1.252 CC(=O)CCSc1ccncc1 62a_100000053229_100000728582 [0,0,0,0,0,2|2,0,0]=4 8807 B12R1.252 CC(=O)CCSc1ccncc1 62a_100000728582_100000053229 [0,0,0,0,0,2|2,0,0]=4 8808 B12R1.252 CC(=O)COCc1ccccc1 1458a_100000230186_200000210301 [0,0,0,0,0,2|1,0,0]=3 8809 B12R1.252 CC(=O)COCc1ccccc1 34a_100000211253_100015291786 [0,0,0,0,0,2|1,0,0]=3 8810 B12R1.252 CC(=O)COCc1ccccn1 34a_100000211253_100000721315 [0,0,0,0,0,2|2,0,0]=4 8811 B12R1.252 CC(=O)COCc1cccnc1 34a_100000211253_100000733263 [0,0,0,0,0,2|2,0,0]=4 8812 B12R1.252 CC(=O)CSCc1ccccc1 1458a_100000070787_200011217039 [0,0,0,0,0,2|1,0,0]=3 8813 B12R1.252 CC(=O)CSCc1ccccc1 1458a_100000150264_200000210301 [0,0,0,0,0,2|1,0,0]=3 8814 B12R1.252 CC(=O)CSCc1ccccn1 1458a_100000742634_200000210301 [0,0,0,0,0,2|2,0,0]=4 8815 B12R1.252 CC(=O)NCCc1ccccc1 11a_100000106460_100015343762 [0,0,0,0,0,2|1,0,0]=3 8816 B12R1.252 CC(=O)NCCc1ccccc1 1626a_100000106460_100015343762 [0,0,0,0,0,2|1,0,0]=3 8817 B12R1.252 CC(=O)NCCc1ccccc1 240690a_100000106460_100015343762 [0,0,0,0,0,2|1,0,0]=3 8818 B12R1.252 CC(=O)NCCc1ccccc1 527a_100000106460_100103153847 [0,0,0,0,0,2|1,0,0]=3 8819 B12R1.252 CC(=O)NCCc1ccccn1 11a_100000211156_100015343762 [0,0,0,0,0,2|2,0,0]=4 8820 B12R1.252 CC(=O)NCCc1ccccn1 1626a_100000211156_100015343762 [0,0,0,0,0,2|2,0,0]=4 8821 B12R1.252 CC(=O)NCCc1ccccn1 240690a_100000211156_100015343762 [0,0,0,0,0,2|2,0,0]=4 8822 B12R1.252 CC(=O)NCCc1ccccn1 527a_100000211156_100103153847 [0,0,0,0,0,2|2,0,0]=4 8823 B12R1.252 CC(=O)NCCc1cccnc1 11a_100000736294_100015343762 [0,0,0,0,0,2|2,0,0]=4 8824 B12R1.252 CC(=O)NCCc1cccnc1 1626a_100000736294_100015343762 [0,0,0,0,0,2|2,0,0]=4 8825 B12R1.252 CC(=O)NCCc1cccnc1 240690a_100000736294_100015343762 [0,0,0,0,0,2|2,0,0]=4 8826 B12R1.252 CC(=O)NCCc1cccnc1 527a_100000736294_100103153847 [0,0,0,0,0,2|2,0,0]=4 8827 B12R1.252 CC(=O)NCCc1ccncc1 11a_100000742849_100015343762 [0,0,0,0,0,2|2,0,0]=4 8828 B12R1.252 CC(=O)NCCc1ccncc1 1626a_100000742849_100015343762 [0,0,0,0,0,2|2,0,0]=4 8829 B12R1.252 CC(=O)NCCc1ccncc1 240690a_100000742849_100015343762 [0,0,0,0,0,2|2,0,0]=4 8830 B12R1.252 CC(=O)NCCc1ccncc1 527a_100000742849_100103153847 [0,0,0,0,0,2|2,0,0]=4 8831 B12R1.252 CC(=O)NN=Cc1ccccc1 4a_100000189765_100015611070 [0,0,0,0,0,2|1,0,1]=4 8832 B12R1.252 CC(=O)NNCc1ccccc1 22a_100000007032_100000070787 [0,0,0,0,0,2|1,0,0]=3 8833 B12R1.252 CC(=O)NNCc1ccccn1 22a_100000736832_100000070787 [0,0,0,0,0,2|2,0,0]=4 8834 B12R1.252 CC(=O)NNCc1cccnc1 22a_100000738295_100000070787 [0,0,0,0,0,2|2,0,0]=4 8835 B12R1.252 CC(=O)NNCc1ccncc1 22a_100000736929_100000070787 [0,0,0,0,0,2|2,0,0]=4 8836 B12R1.252 CC(=O)OCNc1ccccc1 34a_100000106764_100009813279 [0,0,0,0,0,2|1,0,0]=3 8837 B12R1.252 CC(=O)OCOc1ccccc1 34a_100000210340_100009813279 [0,0,0,0,0,2|1,0,0]=3 8838 B12R1.252 CC(=O)OCOc1cccnc1 34a_100000210849_100009813279 [0,0,0,0,0,2|2,0,0]=4 8839 B12R1.252 CC(=O)OCOc1ccncc1 34a_100000212176_100009813279 [0,0,0,0,0,2|2,0,0]=4 8840 B12R1.252 CC(=O)OCSc1ccccc1 62a_100000076356_100000041952 [0,0,0,0,0,2|1,0,0]=3 8841 B12R1.252 CC(=O)OCSc1ccccc1 62a_100000719477_100000076356 [0,0,0,0,0,2|1,0,0]=3 8842 B12R1.252 CC(=O)OCSc1ccccn1 62a_100000076356_100011216584 [0,0,0,0,0,2|2,0,0]=4 8843 B12R1.252 CC(=O)OCSc1ccccn1 62a_100011216584_100000076356 [0,0,0,0,0,2|2,0,0]=4 8844 B12R1.252 CC(=O)OCSc1cccnc1 62a_100000076356_100000210063 [0,0,0,0,0,2|2,0,0]=4 8845 B12R1.252 CC(=O)OCSc1cccnc1 62a_100000210063_100000076356 [0,0,0,0,0,2|2,0,0]=4 8846 B12R1.252 CC(=O)OCSc1ccncc1 62a_100000076356_100000728582 [0,0,0,0,0,2|2,0,0]=4 8847 B12R1.252 CC(=O)OCSc1ccncc1 62a_100000728582_100000076356 [0,0,0,0,0,2|2,0,0]=4 8848 B12R1.252 CC(Br)COCc1ccccc1 34a_100012180447_100015291786 [0,0,0,0,0,2|1,0,1]=4 8849 B12R1.252 CC(C)CC=Cc1ccccc1 271570a_100016259101_100000210277 [0,0,0,0,0,2|0,0,2]=4 8850 B12R1.252 CC(C)CCNc1ccccc1 34a_100000106764_100000210312 [0,0,0,0,0,2|0,0,2]=4 8851 B12R1.252 CC(C)CCOc1ccccc1 34a_100000210340_100000210312 [0,0,0,0,0,2|0,0,2]=4 8852 B12R1.252 CC(C)CCOc1ccccc1 7a_100000210340_100000210626 [0,0,0,0,0,2|0,0,2]=4 8853 B12R1.252 CC(C)CCSc1ccccc1 62a_100000210312_100000041952 [0,0,0,0,0,2|0,0,2]=4 8854 B12R1.252 CC(C)CCSc1ccccc1 62a_100000719477_100000210312 [0,0,0,0,0,2|0,0,2]=4 8855 B12R1.252 CC(C)CNCc1ccccc1 207a_100000210953_100015611070 [0,0,0,0,0,2|0,0,2]=4 8856 B12R1.252 CC(C)CNCc1ccccc1 2230a_100000210953_100015291786 [0,0,0,0,0,2|0,0,2]=4 8857 B12R1.252 CC(C)CNCc1ccccc1 2230a_100015324214_100000210760 [0,0,0,0,0,2|0,0,2]=4 8858 B12R1.252 CC(C)CNCc1ccccc1 270004a_100000210953_100015611070 [0,0,0,0,0,2|0,0,2]=4 8859 B12R1.252 CC(C)CNCc1ccccc1 270004a_100015324214_100000210432 [0,0,0,0,0,2|0,0,2]=4 8860 B12R1.252 CC(C)CNCc1ccccc1 34a_100000210953_100015291786 [0,0,0,0,0,2|0,0,2]=4 8861 B12R1.252 CC(C)CNCc1ccccc1 34a_100015324214_100000210624 [0,0,0,0,0,2|0,0,2]=4 8862 B12R1.252 CC(C)COCc1ccccc1 34a_100000210257_100015291786 [0,0,0,0,0,2|0,0,2]=4 8863 B12R1.252 CC(C)COCc1ccccc1 34a_100000210790_100000210624 [0,0,0,0,0,2|0,0,2]=4 8864 B12R1.252 CC(C)COCc1ccccc1 7a_100000210790_100000210760 [0,0,0,0,0,2|0,0,2]=4 8865 B12R1.252 CC(C)CSCc1ccccc1 62a_100000210624_100015291786 [0,0,0,0,0,2|0,0,2]=4 8866 B12R1.252 CC(C)CSCc1ccccc1 62a_100000211182_100000210760 [0,0,0,0,0,2|0,0,2]=4 8867 B12R1.252 CC(C)NCCc1ccccc1 2230a_100000106460_100000210206 [0,0,0,0,0,2|0,0,2]=4 8868 B12R1.252 CC(C)NCCc1ccccc1 2230a_100138425928_100000765856 [0,0,0,0,0,2|0,0,2]=4 8869 B12R1.252 CC(C)NCCc1ccccc1 34a_100000106460_100000210206 [0,0,0,0,0,2|0,0,2]=4 8870 B12R1.252 CC(C)NCCc1ccccc1 34a_100138425928_100000765856 [0,0,0,0,0,2|0,0,2]=4 8871 B12R1.252 CC(C)NCSc1ccccc1 2230a_100138425928_100011218342 [0,0,0,0,0,2|0,0,2]=4 8872 B12R1.252 CC(C)OCCc1ccccc1 34a_100000210268_100000210206 [0,0,0,0,0,2|0,0,2]=4 8873 B12R1.252 CC(C)OCCc1ccccc1 34a_100000212225_100000765856 [0,0,0,0,0,2|0,0,2]=4 8874 B12R1.252 CC(C)OCCc1ccccc1 7a_100000210268_100000210206 [0,0,0,0,0,2|0,0,2]=4 8875 B12R1.252 CC(C)OCNc1ccccc1 34a_100000106764_100000709892 [0,0,0,0,0,2|0,0,2]=4 8876 B12R1.252 CC(C)OCOc1ccccc1 34a_100000210340_100000709892 [0,0,0,0,0,2|0,0,2]=4 8877 B12R1.252 CC(C)OCSc1ccccc1 62a_100000709892_100000041952 [0,0,0,0,0,2|0,0,2]=4 8878 B12R1.252 CC(C)OCSc1ccccc1 62a_100000719477_100000709892 [0,0,0,0,0,2|0,0,2]=4 8879 B12R1.252 CC(C)SCCc1ccccc1 62a_100000210206_100011218657 [0,0,0,0,0,2|0,0,2]=4 8880 B12R1.252 CC(C)SCCc1ccccc1 62a_100000765856_100000210206 [0,0,0,0,0,2|0,0,2]=4 8881 B12R1.252 CC(C)SCSc1ccccc1 62a_100000210206_100011218342 [0,0,0,0,0,2|0,0,2]=4 8882 B12R1.252 CC(C)SCSc1ccccc1 62a_100011218342_100000210206 [0,0,0,0,0,2|0,0,2]=4 8883 B12R1.252 CC(F)COCc1ccccc1 34a_100015925927_100015291786 [0,0,0,0,0,2|1,0,1]=4 8884 B12R1.252 CC(O)CCNc1ccccc1 34a_100000106764_100012276601 [0,0,0,0,0,2|1,0,1]=4 8885 B12R1.252 CC(O)CCOc1ccccc1 34a_100000210340_100012276601 [0,0,0,0,0,2|1,0,1]=4 8886 B12R1.252 CC(O)CCOc1ccccc1 7a_100000210340_100012276601 [0,0,0,0,0,2|1,0,1]=4 8887 B12R1.252 CC(O)CCSc1ccccc1 62a_100000719477_100012276601 [0,0,0,0,0,2|1,0,1]=4 8888 B12R1.252 CC(O)CCSc1ccccc1 62a_100012276601_100000041952 [0,0,0,0,0,2|1,0,1]=4 8889 B12R1.252 CC(O)CNCc1ccccc1 207a_100000210904_100015611070 [0,0,0,0,0,2|1,0,1]=4 8890 B12R1.252 CC(O)CNCc1ccccc1 2230a_100000210904_100015291786 [0,0,0,0,0,2|1,0,1]=4 8891 B12R1.252 CC(O)CNCc1ccccc1 2230a_100015324214_100011218427 [0,0,0,0,0,2|1,0,1]=4 8892 B12R1.252 CC(O)CNCc1ccccc1 270004a_100000210904_100015611070 [0,0,0,0,0,2|1,0,1]=4 8893 B12R1.252 CC(O)CNCc1ccccc1 34a_100000210904_100015291786 [0,0,0,0,0,2|1,0,1]=4 8894 B12R1.252 CC(O)CNCc1ccccc1 34a_100015324214_100011218427 [0,0,0,0,0,2|1,0,1]=4 8895 B12R1.252 CC(O)COCc1ccccc1 34a_100000210790_100011218427 [0,0,0,0,0,2|1,0,1]=4 8896 B12R1.252 CC(O)COCc1ccccc1 7a_100000210790_100011218427 [0,0,0,0,0,2|1,0,1]=4 8897 B12R1.252 CC(O)CSCc1ccccc1 62a_100000211182_100011218427 [0,0,0,0,0,2|1,0,1]=4 8898 B12R1.252 CC(O)CSCc1ccccc1 62a_100011218427_100015291786 [0,0,0,0,0,2|1,0,1]=4 8899 B12R1.252 CN(C)C/C=C/c1ccccc1 2230a_100102631434_100016265936 [0,0,0,0,0,2|1,0,1]=4 8900 B12R1.252 CN(C)C/C=C/c1ccccc1 269982a_100102631434_100016265936 [0,0,0,0,0,2|1,0,1]=4 8901 B12R1.252 CN(C)CC#Cc1ccccc1 2230a_100102631434_100011352542 [0,0,0,0,0,2|1,0,1]=4 8902 B12R1.252 CN(C)CC#Cc1ccccc1 269982a_100102631434_100011352542 [0,0,0,0,0,2|1,0,1]=4 8903 B12R1.252 CN(C)CC=Cc1ccccc1 270004a_100102631434_100000210105 [0,0,0,0,0,2|1,0,1]=4 8904 B12R1.252 CN(C)CCCc1ccccc1 2230a_100000693637_200000210301 [0,0,0,0,0,2|1,0,1]=4 8905 B12R1.252 CN(C)CCCc1ccccc1 2230a_100102631434_100000211621 [0,0,0,0,0,2|1,0,1]=4 8906 B12R1.252 CN(C)CCCc1ccccc1 269982a_100000693637_200000210301 [0,0,0,0,0,2|1,0,1]=4 8907 B12R1.252 CN(C)CCCc1ccccc1 269982a_100102631434_100000211621 [0,0,0,0,0,2|1,0,1]=4 8908 B12R1.252 CN(C)CCOc1ccccc1 2230a_100000184383_200000210301 [0,0,0,0,0,2|1,0,1]=4 8909 B12R1.252 CN(C)CCOc1ccccc1 2230a_100102631434_100000184471 [0,0,0,0,0,2|1,0,1]=4 8910 B12R1.252 CN(C)CCOc1ccccc1 269982a_100000184383_200000210301 [0,0,0,0,0,2|1,0,1]=4 8911 B12R1.252 CN(C)CCOc1ccccc1 269982a_100102631434_100000184471 [0,0,0,0,0,2|1,0,1]=4 8912 B12R1.252 CN(C)CCOc1ccccc1 270004a_100102631434_100000758736 [0,0,0,0,0,2|1,0,1]=4 8913 B12R1.252 CN(C)CCOc1ccccc1 7a_100000210340_100000755713 [0,0,0,0,0,2|1,0,1]=4 8914 B12R1.252 CN(C)CCSc1ccccc1 2230a_100102631434_100000246102 [0,0,0,0,0,2|1,0,1]=4 8915 B12R1.252 CN(C)CCSc1ccccc1 269982a_100102631434_100000246102 [0,0,0,0,0,2|1,0,1]=4 8916 B12R1.252 CN(C)CCSc1ccccc1 62a_100000719477_100000755713 [0,0,0,0,0,2|1,0,1]=4 8917 B12R1.252 CN(C)COCc1ccccc1 2230a_100102631434_100000763385 [0,0,0,0,0,2|1,0,1]=4 8918 B12R1.252 CN(C)CSCc1ccccc1 2230a_100102631434_200011217039 [0,0,0,0,0,2|1,0,1]=4 8919 B12R1.252 CN(C)CSCc1ccccc1 269982a_100102631434_200011217039 [0,0,0,0,0,2|1,0,1]=4 8920 B12R1.252 CN([13CH3])CCCc1ccccc1 2230a_100000693637_200025704644 [0,0,0,0,0,2|1,0,1]=4 8921 B12R1.252 CN([13CH3])CCCc1ccccc1 269982a_100000693637_200025704644 [0,0,0,0,0,2|1,0,1]=4 8922 B12R1.252 CN([13CH3])CCOc1ccccc1 2230a_100000184383_200025704644 [0,0,0,0,0,2|1,0,1]=4 8923 B12R1.252 CN([13CH3])CCOc1ccccc1 269982a_100000184383_200025704644 [0,0,0,0,0,2|1,0,1]=4 8924 B12R1.252 C[C@@H](Cl)COCc1ccccc1 34a_100016084084_100015291786 [0,0,0,0,0,2|1,0,1]=4 8925 B12R1.252 C[C@@H](N)COCc1ccccc1 34a_100000737577_100015291786 [0,0,0,0,0,2|1,0,1]=4 8926 B12R1.252 C[C@@H](O)CNCc1ccccc1 2230a_100015324214_100009817552 [0,0,0,0,0,2|1,0,1]=4 8927 B12R1.252 C[C@@H](O)CNCc1ccccc1 34a_100015324214_100009817552 [0,0,0,0,0,2|1,0,1]=4 8928 B12R1.252 C[C@@H](O)COCc1ccccc1 34a_100000210790_100009817552 [0,0,0,0,0,2|1,0,1]=4 8929 B12R1.252 C[C@@H](O)COCc1ccccc1 7a_100000210790_100009817552 [0,0,0,0,0,2|1,0,1]=4 8930 B12R1.252 C[C@@H](O)CSCc1ccccc1 62a_100000211182_100009817552 [0,0,0,0,0,2|1,0,1]=4 8931 B12R1.252 C[C@@H](O)CSCc1ccccc1 62a_100009817552_100015291786 [0,0,0,0,0,2|1,0,1]=4 8932 B12R1.252 NC(=O)CCNc1ccccc1 34a_100000106764_100000731001 [0,0,0,0,0,2|2,0,0]=4 8933 B12R1.252 NC(=O)CCOc1ccccc1 34a_100000210340_100000731001 [0,0,0,0,0,2|2,0,0]=4 8934 B12R1.252 NC(=O)CCOc1ccccc1 7a_100000210340_100000744528 [0,0,0,0,0,2|2,0,0]=4 8935 B12R1.252 NC(=O)CCSc1ccccc1 62a_100000719477_100000744528 [0,0,0,0,0,2|2,0,0]=4 8936 B12R1.252 NC(=O)CCSc1ccccc1 62a_100000744528_100000041952 [0,0,0,0,0,2|2,0,0]=4 8937 B12R1.252 NC(=O)CNCc1ccccc1 2230a_100000711301_100015291786 [0,0,0,0,0,2|2,0,0]=4 8938 B12R1.252 NC(=O)CNCc1ccccc1 2230a_100015324214_100000747473 [0,0,0,0,0,2|2,0,0]=4 8939 B12R1.252 NC(=O)CNCc1ccccc1 34a_100015324214_100000187820 [0,0,0,0,0,2|2,0,0]=4 8940 B12R1.252 NC(=O)COCc1ccccc1 34a_100000210790_100000187820 [0,0,0,0,0,2|2,0,0]=4 8941 B12R1.252 NC(=O)COCc1ccccc1 7a_100000210790_100000187820 [0,0,0,0,0,2|2,0,0]=4 8942 B12R1.252 NC(=O)CSCc1ccccc1 62a_100000211182_100000747473 [0,0,0,0,0,2|2,0,0]=4 8943 B12R1.252 NC(=O)CSCc1ccccc1 62a_100000747473_100015291786 [0,0,0,0,0,2|2,0,0]=4 8944 B12R1.252 O=C(O)CNCc1ccccc1 269956a_100016091260_100015291786 [0,0,0,0,0,2|2,0,0]=4 8945 B12R1.252 O=C([O-])CNCc1ccccc1 34a_100015324214_100020667443 [0,0,0,0,0,2|2,0,0]=4 8946 B12R1.252 O=C([O-])COCc1ccccc1 34a_100000210790_100020667443 [0,0,0,0,0,2|2,0,0]=4 8947 B12R1.252 O=C([O-])CSCc1ccccc1 62a_100000211182_100020667443 [0,0,0,0,0,2|2,0,0]=4 8948 B12R1.252 O=C([O-])CSCc1ccccc1 62a_100020667443_100015291786 [0,0,0,0,0,2|2,0,0]=4 8949 B12R1.252 [13CH3]C(=O)C/C=C/c1ccccc1 1458a_100011219626_200025704644 [0,0,0,0,0,2|1,0,0]=3 8950 B12R1.252 [13CH3]C(=O)C=CSc1ccccc1 1458a_100016262050_200025704644 [0,0,0,0,0,2|1,0,1]=4 8951 B12R1.252 [13CH3]C(=O)CCCc1ccccc1 1458a_100011207963_200025704644 [0,0,0,0,0,2|1,0,0]=3 8952 B12R1.252 [13CH3]C(=O)CCCc1ccccn1 1458a_100000752327_200025704644 [0,0,0,0,0,2|2,0,0]=4 8953 B12R1.252 [13CH3]C(=O)CCCc1ccncc1 1458a_100020654287_200025704644 [0,0,0,0,0,2|2,0,0]=4 8954 B12R1.252 [13CH3]C(=O)CCOc1ccccc1 1458a_100000182761_200025704644 [0,0,0,0,0,2|1,0,0]=3 8955 B12R1.252 [13CH3]C(=O)CCSc1ccccc1 1458a_100000182436_200025704644 [0,0,0,0,0,2|1,0,0]=3 8956 B12R1.252 [13CH3]C(=O)COCc1ccccc1 1458a_100000230186_200025704644 [0,0,0,0,0,2|1,0,0]=3 8957 B12R1.252 [13CH3]C(=O)CSCc1ccccc1 1458a_100000150264_200025704644 [0,0,0,0,0,2|1,0,0]=3 8958 B12R1.252 [13CH3]C(=O)CSCc1ccccn1 1458a_100000742634_200025704644 [0,0,0,0,0,2|2,0,0]=4 8959 B7R0.3 C=CC=CC(=O)CC 1458a_100016291481_100000210202 [2,0,1,0,0,0|1,0,0]=4 8960 B7R0.2 C=CC(=O)CC(=C)C 1458a_100000185746_100000748629 [2,0,1,0,0,0|1,0,0]=4 8961 B7R1.3 Oc1ccccc1 271570a_203496583355_100000210277 [3,0,0,0,0,0|1,0,0]=4 8962 B9R0.5 C=CCC(=O)C=C/C=C/C 1458a_100000185730_100000210623 [1,1,1,0,0,0|0,0,1]=4 8963 B9R0.18 C=CC=CC(=O)CCC=C 1458a_100016291481_100000754431 [1,1,1,0,0,0|0,0,1]=4 8964 B9R0.18 C=CC=CC(=O)NCC=C 1626a_100020586998_100016291481 [1,1,1,0,0,0|1,0,0]=4 8965 B9R1.1 C=Cc1cc[n+](cc1)[O-] 271570a_100011290941_100000039755 [2,1,0,0,0,0|1,0,0]=4 8966 B9R1.1 C=Cc1ccc(=O)[nH]c1 271570a_100011290941_100000212171 [2,1,0,0,0,0|1,0,0]=4 8967 B9R1.1 C=Cc1ccc(cc1)Br 271570a_100011290941_100000752885 [2,1,0,0,0,0|0,0,0]=3 8968 B9R1.1 C=Cc1ccc(cc1)C 271570a_100011290941_100000186775 [2,1,0,0,0,0|0,0,0]=3 8969 B9R1.1 C=Cc1ccc(cc1)Cl 271570a_100011290941_100000755918 [2,1,0,0,0,0|0,0,0]=3 8970 B9R1.1 C=Cc1ccc(cc1)F 271570a_100011290941_100000211213 [2,1,0,0,0,0|0,0,0]=3 8971 B9R1.1 C=Cc1ccc(cc1)N 271570a_100011290941_100000185761 [2,1,0,0,0,0|0,0,0]=3 8972 B9R1.1 C=Cc1ccc(cc1)O 271570a_100011290941_100000185759 [2,1,0,0,0,0|0,0,0]=3 8973 B9R1.1 C=Cc1ccc(cn1)Br 271570a_100011290941_100000686858 [2,1,0,0,0,0|1,0,0]=4 8974 B9R1.1 C=Cc1ccc(cn1)C 271570a_100011290941_100000754016 [2,1,0,0,0,0|1,0,0]=4 8975 B9R1.1 C=Cc1ccc(cn1)Cl 271570a_100011290941_100011356976 [2,1,0,0,0,0|1,0,0]=4 8976 B9R1.1 C=Cc1ccc(cn1)F 271570a_100011290941_100000744514 [2,1,0,0,0,0|1,0,0]=4 8977 B9R1.1 C=Cc1ccc(cn1)N 271570a_100011290941_100000744251 [2,1,0,0,0,0|1,0,0]=4 8978 B9R1.1 C=Cc1ccc(cn1)O 271570a_100011290941_100000685995 [2,1,0,0,0,0|1,0,0]=4 8979 B9R1.1 C=Cc1ccc(nc1)Br 271570a_100011290941_100009814638 [2,1,0,0,0,0|1,0,0]=4 8980 B9R1.1 C=Cc1ccc(nc1)C 271570a_100011290941_100000751577 [2,1,0,0,0,0|1,0,0]=4 8981 B9R1.1 C=Cc1ccc(nc1)Cl 271570a_100011290941_100000034144 [2,1,0,0,0,0|1,0,0]=4 8982 B9R1.1 C=Cc1ccc(nc1)F 271570a_100011290941_100000748661 [2,1,0,0,0,0|1,0,0]=4 8983 B9R1.1 C=Cc1ccc(nc1)N 271570a_100011290941_100000187370 [2,1,0,0,0,0|1,0,0]=4 8984 B9R1.1 CCc1ccc(cc1)O 271570a_203496583355_100011215824 [2,1,0,0,0,0|0,0,0]=3 8985 B9R1.1 CCc1ccc(cn1)O 271570a_203496583355_100009820025 [2,1,0,0,0,0|1,0,0]=4 8986 B9R1.1 CCc1ccc(nc1)O 271570a_203496583355_100009843584 [2,1,0,0,0,0|1,0,0]=4 8987 B9R1.1 CNc1ccc(cc1)Br 2230a_100000210018_200000210301 [2,1,0,0,0,0|1,0,0]=4 8988 B9R1.1 CNc1ccc(cc1)Br 34a_100000210018_200000210301 [2,1,0,0,0,0|1,0,0]=4 8989 B9R1.1 CNc1ccc(cc1)C 34a_100000124888_200000210301 [2,1,0,0,0,0|1,0,0]=4 8990 B9R1.1 CNc1ccc(cc1)Cl 2230a_100000210052_200000210301 [2,1,0,0,0,0|1,0,0]=4 8991 B9R1.1 CNc1ccc(cc1)Cl 34a_100000210052_200000210301 [2,1,0,0,0,0|1,0,0]=4 8992 B9R1.1 CNc1ccc(cc1)F 34a_100000185862_200000210301 [2,1,0,0,0,0|1,0,0]=4 8993 B9R1.1 CNc1ccc(cc1)I 34a_100000185761_200000210301 [2,1,0,0,0,0|1,0,0]=4 8994 B9R1.1 CNc1ccc(cc1)O 271570a_203496583355_100000219623 [2,1,0,0,0,0|1,0,0]=4 8995 B9R1.1 CNc1ccc(cc1)O 34a_100000185829_200000210301 [2,1,0,0,0,0|1,0,0]=4 8996 B9R1.1 COc1ccc(cc1)Br 34a_100000185759_200000210301 [2,1,0,0,0,0|1,0,0]=4 8997 B9R1.1 COc1ccc(cc1)Br 7a_100000185759_200000210301 [2,1,0,0,0,0|1,0,0]=4 8998 B9R1.1 COc1ccc(cc1)C 34a_100000210336_200000210301 [2,1,0,0,0,0|1,0,0]=4 8999 B9R1.1 COc1ccc(cc1)C 7a_100000210336_200000210301 [2,1,0,0,0,0|1,0,0]=4 9000 B9R1.1 COc1ccc(cc1)Cl 34a_100000210216_200000210301 [2,1,0,0,0,0|1,0,0]=4 9001 B9R1.1 COc1ccc(cc1)Cl 7a_100000210216_200000210301 [2,1,0,0,0,0|1,0,0]=4 9002 B9R1.1 COc1ccc(cc1)F 34a_100000210339_200000210301 [2,1,0,0,0,0|1,0,0]=4 9003 B9R1.1 COc1ccc(cc1)I 34a_100000212066_200000210301 [2,1,0,0,0,0|1,0,0]=4 9004 B9R1.1 COc1ccc(cc1)I 7a_100000212066_200000210301 [2,1,0,0,0,0|1,0,0]=4 9005 B9R1.1 COc1ccc(cc1)N 34a_100000185829_200000210301 [2,1,0,0,0,0|1,0,0]=4 9006 B9R1.1 COc1ccc(cc1)O 271570a_203496583355_100000171711 [2,1,0,0,0,0|1,0,0]=4 9007 B9R1.1 CSc1ccc(cc1)Br 62a_100000752885_200000210301 [2,1,0,0,0,0|1,0,0]=4 9008 B9R1.1 CSc1ccc(cc1)Br 62a_200000210301_100000752885 [2,1,0,0,0,0|1,0,0]=4 9009 B9R1.1 CSc1ccc(cc1)C 62a_100000186775_200000210301 [2,1,0,0,0,0|1,0,0]=4 9010 B9R1.1 CSc1ccc(cc1)C 62a_200000210301_100000186775 [2,1,0,0,0,0|1,0,0]=4 9011 B9R1.1 CSc1ccc(cc1)Cl 62a_100000755918_200000210301 [2,1,0,0,0,0|1,0,0]=4 9012 B9R1.1 CSc1ccc(cc1)Cl 62a_200000210301_100000755918 [2,1,0,0,0,0|1,0,0]=4 9013 B9R1.1 CSc1ccc(cc1)F 62a_100000211213_200000210301 [2,1,0,0,0,0|1,0,0]=4 9014 B9R1.1 CSc1ccc(cc1)F 62a_200000210301_100000211213 [2,1,0,0,0,0|1,0,0]=4 9015 B9R1.1 CSc1ccc(cc1)N 62a_100000185761_200000210301 [2,1,0,0,0,0|1,0,0]=4 9016 B9R1.1 CSc1ccc(cc1)N 62a_200000210301_100000185761 [2,1,0,0,0,0|1,0,0]=4 9017 B9R1.1 CSc1ccc(cc1)O 271570a_203496583355_100011263217 [2,1,0,0,0,0|1,0,0]=4 9018 B9R1.1 CSc1ccc(cc1)O 62a_200000210301_100000185759 [2,1,0,0,0,0|1,0,0]=4 9019 B9R1.1 Cc1ccc(cc1)N[13CH3] 34a_100000124888_200025704644 [2,1,0,0,0,0|1,0,0]=4 9020 B9R1.1 Cc1ccc(cc1)O[13CH3] 34a_100000210336_200025704644 [2,1,0,0,0,0|1,0,0]=4 9021 B9R1.1 Cc1ccc(cc1)O[13CH3] 7a_100000210336_200025704644 [2,1,0,0,0,0|1,0,0]=4 9022 B9R1.1 Cc1ccc(cc1)S[13CH3] 62a_100000186775_200025704644 [2,1,0,0,0,0|1,0,0]=4 9023 B9R1.1 Cc1ccc(cc1)S[13CH3] 62a_200025704644_100000186775 [2,1,0,0,0,0|1,0,0]=4 9024 B9R1.1 NCc1ccc(cc1)O 271570a_203496583355_100016989417 [2,1,0,0,0,0|1,0,0]=4 9025 B9R1.1 O=Cc1ccc(cc1)O 271570a_203496583355_100000186029 [2,1,0,0,0,0|1,0,0]=4 9026 B9R1.1 OCc1ccc(cc1)O 271570a_203496583355_100000690907 [2,1,0,0,0,0|1,0,0]=4 9027 B9R1.1 Oc1ccc(cc1)CF 271570a_203496583355_100010268989 [2,1,0,0,0,0|1,0,0]=4 9028 B9R1.1 [13CH3]Nc1ccc(cc1)Br 2230a_100000210018_200025704644 [2,1,0,0,0,0|1,0,0]=4 9029 B9R1.1 [13CH3]Nc1ccc(cc1)Br 34a_100000210018_200025704644 [2,1,0,0,0,0|1,0,0]=4 9030 B9R1.1 [13CH3]Nc1ccc(cc1)Cl 2230a_100000210052_200025704644 [2,1,0,0,0,0|1,0,0]=4 9031 B9R1.1 [13CH3]Nc1ccc(cc1)Cl 34a_100000210052_200025704644 [2,1,0,0,0,0|1,0,0]=4 9032 B9R1.1 [13CH3]Nc1ccc(cc1)F 34a_100000185862_200025704644 [2,1,0,0,0,0|1,0,0]=4 9033 B9R1.1 [13CH3]Nc1ccc(cc1)I 34a_100000185761_200025704644 [2,1,0,0,0,0|1,0,0]=4 9034 B9R1.1 [13CH3]Nc1ccc(cc1)O 34a_100000185829_200025704644 [2,1,0,0,0,0|1,0,0]=4 9035 B9R1.1 [13CH3]Oc1ccc(cc1)Br 34a_100000185759_200025704644 [2,1,0,0,0,0|1,0,0]=4 9036 B9R1.1 [13CH3]Oc1ccc(cc1)Br 7a_100000185759_200025704644 [2,1,0,0,0,0|1,0,0]=4 9037 B9R1.1 [13CH3]Oc1ccc(cc1)Cl 34a_100000210216_200025704644 [2,1,0,0,0,0|1,0,0]=4 9038 B9R1.1 [13CH3]Oc1ccc(cc1)Cl 7a_100000210216_200025704644 [2,1,0,0,0,0|1,0,0]=4 9039 B9R1.1 [13CH3]Oc1ccc(cc1)F 34a_100000210339_200025704644 [2,1,0,0,0,0|1,0,0]=4 9040 B9R1.1 [13CH3]Oc1ccc(cc1)I 34a_100000212066_200025704644 [2,1,0,0,0,0|1,0,0]=4 9041 B9R1.1 [13CH3]Oc1ccc(cc1)I 7a_100000212066_200025704644 [2,1,0,0,0,0|1,0,0]=4 9042 B9R1.1 [13CH3]Oc1ccc(cc1)N 34a_100000185829_200025704644 [2,1,0,0,0,0|1,0,0]=4 9043 B9R1.1 [13CH3]Sc1ccc(cc1)Br 62a_100000752885_200025704644 [2,1,0,0,0,0|1,0,0]=4 9044 B9R1.1 [13CH3]Sc1ccc(cc1)Br 62a_200025704644_100000752885 [2,1,0,0,0,0|1,0,0]=4 9045 B9R1.1 [13CH3]Sc1ccc(cc1)Cl 62a_100000755918_200025704644 [2,1,0,0,0,0|1,0,0]=4 9046 B9R1.1 [13CH3]Sc1ccc(cc1)Cl 62a_200025704644_100000755918 [2,1,0,0,0,0|1,0,0]=4 9047 B9R1.1 [13CH3]Sc1ccc(cc1)F 62a_100000211213_200025704644 [2,1,0,0,0,0|1,0,0]=4 9048 B9R1.1 [13CH3]Sc1ccc(cc1)F 62a_200025704644_100000211213 [2,1,0,0,0,0|1,0,0]=4 9049 B9R1.1 [13CH3]Sc1ccc(cc1)N 62a_100000185761_200025704644 [2,1,0,0,0,0|1,0,0]=4 9050 B9R1.1 [13CH3]Sc1ccc(cc1)N 62a_200025704644_100000185761 [2,1,0,0,0,0|1,0,0]=4 9051 B9R1.1 [13CH3]Sc1ccc(cc1)O 62a_200025704644_100000185759 [2,1,0,0,0,0|1,0,0]=4 9052 B9R1.2 C=Cc1cc(ccn1)C 271570a_100011290941_100000750283 [2,1,0,0,0,0|1,0,0]=4 9053 B9R1.2 C=Cc1cc(ccn1)Cl 271570a_100011290941_100010167805 [2,1,0,0,0,0|1,0,0]=4 9054 B9R1.2 C=Cc1cc(ccn1)F 271570a_100011290941_100009817058 [2,1,0,0,0,0|1,0,0]=4 9055 B9R1.2 C=Cc1cc(ccn1)N 271570a_100011290941_100009814236 [2,1,0,0,0,0|1,0,0]=4 9056 B9R1.2 C=Cc1cc(ccn1)O 271570a_100011290941_100000762945 [2,1,0,0,0,0|1,0,0]=4 9057 B9R1.2 C=Cc1cc[nH]c(=O)c1 271570a_100011290941_100009816521 [2,1,0,0,0,0|1,0,0]=4 9058 B9R1.2 C=Cc1ccc[n+](c1)C 271570a_100011290941_100009996589 [2,1,0,0,0,0|1,0,0]=4 9059 B9R1.2 C=Cc1ccc[n+](c1)[O-] 271570a_100011290941_100009815978 [2,1,0,0,0,0|1,0,0]=4 9060 B9R1.2 C=Cc1cccc(=O)[nH]1 271570a_100011290941_100000761760 [2,1,0,0,0,0|1,0,0]=4 9061 B9R1.2 C=Cc1cccc(c1)Br 271570a_100011290941_100000691529 [2,1,0,0,0,0|0,0,0]=3 9062 B9R1.2 C=Cc1cccc(c1)C 271570a_100011290941_100011215228 [2,1,0,0,0,0|0,0,0]=3 9063 B9R1.2 C=Cc1cccc(c1)Cl 271570a_100011290941_100000699651 [2,1,0,0,0,0|0,0,0]=3 9064 B9R1.2 C=Cc1cccc(c1)F 271570a_100011290941_100000685547 [2,1,0,0,0,0|0,0,0]=3 9065 B9R1.2 C=Cc1cccc(c1)N 271570a_100011290941_100000210019 [2,1,0,0,0,0|0,0,0]=3 9066 B9R1.2 C=Cc1cccc(c1)O 271570a_100011290941_100000211634 [2,1,0,0,0,0|0,0,0]=3 9067 B9R1.2 C=Cc1cccc(c1)[S] 271570a_100011290941_114929384022 [2,1,0,0,0,0|0,0,0]=3 9068 B9R1.2 C=Cc1cccc(n1)Br 271570a_100011290941_100000684672 [2,1,0,0,0,0|1,0,0]=4 9069 B9R1.2 C=Cc1cccc(n1)C 271570a_100011290941_100000742759 [2,1,0,0,0,0|1,0,0]=4 9070 B9R1.2 C=Cc1cccc(n1)F 271570a_100011290941_100009815982 [2,1,0,0,0,0|1,0,0]=4 9071 B9R1.2 C=Cc1cccc(n1)N 271570a_100011290941_100000740741 [2,1,0,0,0,0|1,0,0]=4 9072 B9R1.2 C=Cc1ccnc(c1)Br 271570a_100011290941_100009814637 [2,1,0,0,0,0|1,0,0]=4 9073 B9R1.2 C=Cc1ccnc(c1)C 271570a_100011290941_100000758586 [2,1,0,0,0,0|1,0,0]=4 9074 B9R1.2 C=Cc1ccnc(c1)Cl 271570a_100011290941_100000035001 [2,1,0,0,0,0|1,0,0]=4 9075 B9R1.2 C=Cc1ccnc(c1)F 271570a_100011290941_100009816116 [2,1,0,0,0,0|1,0,0]=4 9076 B9R1.2 C=Cc1ccnc(c1)N 271570a_100011290941_100000744379 [2,1,0,0,0,0|1,0,0]=4 9077 B9R1.2 C=Cc1cncc(c1)Br 271570a_100011290941_100000728054 [2,1,0,0,0,0|1,0,0]=4 9078 B9R1.2 C=Cc1cncc(c1)C 271570a_100011290941_100000760492 [2,1,0,0,0,0|1,0,0]=4 9079 B9R1.2 C=Cc1cncc(c1)Cl 271570a_100011290941_100000049639 [2,1,0,0,0,0|1,0,0]=4 9080 B9R1.2 C=Cc1cncc(c1)F 271570a_100011290941_100000744099 [2,1,0,0,0,0|1,0,0]=4 9081 B9R1.2 C=Cc1cncc(c1)N 271570a_100011290941_100000687067 [2,1,0,0,0,0|1,0,0]=4 9082 B9R1.2 C=Cc1cncc(c1)O 271570a_100011290941_100000754920 [2,1,0,0,0,0|1,0,0]=4 9083 B9R1.2 CCc1cc(ccn1)O 271570a_203496583355_100009820011 [2,1,0,0,0,0|1,0,0]=4 9084 B9R1.2 CCc1cccc(c1)O 271570a_203496583355_100000684523 [2,1,0,0,0,0|0,0,0]=3 9085 B9R1.2 CCc1cccc(n1)O 271570a_203496583355_100009856026 [2,1,0,0,0,0|1,0,0]=4 9086 B9R1.2 CCc1ccnc(c1)O 271570a_203496583355_100009817561 [2,1,0,0,0,0|1,0,0]=4 9087 B9R1.2 CCc1cncc(c1)O 271570a_203496583355_200009819073 [2,1,0,0,0,0|1,0,0]=4 9088 B9R1.2 CNc1cccc(c1)Br 34a_100000210019_200000210301 [2,1,0,0,0,0|1,0,0]=4 9089 B9R1.2 CNc1cccc(c1)C 2230a_100000188690_200000210301 [2,1,0,0,0,0|1,0,0]=4 9090 B9R1.2 CNc1cccc(c1)C 34a_100000188690_200000210301 [2,1,0,0,0,0|1,0,0]=4 9091 B9R1.2 CNc1cccc(c1)Cl 34a_100000185859_200000210301 [2,1,0,0,0,0|1,0,0]=4 9092 B9R1.2 CNc1cccc(c1)F 34a_100000210047_200000210301 [2,1,0,0,0,0|1,0,0]=4 9093 B9R1.2 CNc1cccc(c1)I 34a_100000211102_200000210301 [2,1,0,0,0,0|1,0,0]=4 9094 B9R1.2 CNc1cccc(c1)O 271570a_203496583355_100000219648 [2,1,0,0,0,0|1,0,0]=4 9095 B9R1.2 CNc1cccc(c1)O 34a_100000210217_200000210301 [2,1,0,0,0,0|1,0,0]=4 9096 B9R1.2 COc1cccc(c1)Br 34a_100000210342_200000210301 [2,1,0,0,0,0|1,0,0]=4 9097 B9R1.2 COc1cccc(c1)Br 7a_100000210342_200000210301 [2,1,0,0,0,0|1,0,0]=4 9098 B9R1.2 COc1cccc(c1)C 34a_100000210337_200000210301 [2,1,0,0,0,0|1,0,0]=4 9099 B9R1.2 COc1cccc(c1)C 7a_100000210337_200000210301 [2,1,0,0,0,0|1,0,0]=4 9100 B9R1.2 COc1cccc(c1)Cl 34a_100000210295_200000210301 [2,1,0,0,0,0|1,0,0]=4 9101 B9R1.2 COc1cccc(c1)Cl 7a_100000210295_200000210301 [2,1,0,0,0,0|1,0,0]=4 9102 B9R1.2 COc1cccc(c1)F 34a_100000210426_200000210301 [2,1,0,0,0,0|1,0,0]=4 9103 B9R1.2 COc1cccc(c1)F 7a_100000210426_200000210301 [2,1,0,0,0,0|1,0,0]=4 9104 B9R1.2 COc1cccc(c1)I 34a_100000211634_200000210301 [2,1,0,0,0,0|1,0,0]=4 9105 B9R1.2 COc1cccc(c1)I 7a_100000211634_200000210301 [2,1,0,0,0,0|1,0,0]=4 9106 B9R1.2 COc1cccc(c1)N 34a_100000210217_200000210301 [2,1,0,0,0,0|1,0,0]=4 9107 B9R1.2 COc1cccc(c1)O 271570a_203496583355_100000170001 [2,1,0,0,0,0|1,0,0]=4 9108 B9R1.2 CSc1cccc(c1)Br 62a_100000691529_200000210301 [2,1,0,0,0,0|1,0,0]=4 9109 B9R1.2 CSc1cccc(c1)Br 62a_200000210301_100000691529 [2,1,0,0,0,0|1,0,0]=4 9110 B9R1.2 CSc1cccc(c1)C 62a_100011215228_200000210301 [2,1,0,0,0,0|1,0,0]=4 9111 B9R1.2 CSc1cccc(c1)C 62a_200000210301_100011215228 [2,1,0,0,0,0|1,0,0]=4 9112 B9R1.2 CSc1cccc(c1)Cl 62a_100000699651_200000210301 [2,1,0,0,0,0|1,0,0]=4 9113 B9R1.2 CSc1cccc(c1)Cl 62a_200000210301_100000699651 [2,1,0,0,0,0|1,0,0]=4 9114 B9R1.2 CSc1cccc(c1)F 62a_100000685547_200000210301 [2,1,0,0,0,0|1,0,0]=4 9115 B9R1.2 CSc1cccc(c1)F 62a_200000210301_100000685547 [2,1,0,0,0,0|1,0,0]=4 9116 B9R1.2 CSc1cccc(c1)N 62a_100000210019_200000210301 [2,1,0,0,0,0|1,0,0]=4 9117 B9R1.2 CSc1cccc(c1)N 62a_200000210301_100000210019 [2,1,0,0,0,0|1,0,0]=4 9118 B9R1.2 CSc1cccc(c1)O 271570a_203496583355_100011215954 [2,1,0,0,0,0|1,0,0]=4 9119 B9R1.2 CSc1cccc(c1)O 62a_200000210301_100000211634 [2,1,0,0,0,0|1,0,0]=4 9120 B9R1.2 CSc1cccc(c1)[S] 62a_114929384022_200000210301 [2,1,0,0,0,0|1,0,0]=4 9121 B9R1.2 CSc1cccc(c1)[S] 62a_200000210301_114929384022 [2,1,0,0,0,0|1,0,0]=4 9122 B9R1.2 Cc1cccc(c1)N[13CH3] 2230a_100000188690_200025704644 [2,1,0,0,0,0|1,0,0]=4 9123 B9R1.2 Cc1cccc(c1)N[13CH3] 34a_100000188690_200025704644 [2,1,0,0,0,0|1,0,0]=4 9124 B9R1.2 Cc1cccc(c1)O[13CH3] 34a_100000210337_200025704644 [2,1,0,0,0,0|1,0,0]=4 9125 B9R1.2 Cc1cccc(c1)O[13CH3] 7a_100000210337_200025704644 [2,1,0,0,0,0|1,0,0]=4 9126 B9R1.2 Cc1cccc(c1)S[13CH3] 62a_100011215228_200025704644 [2,1,0,0,0,0|1,0,0]=4 9127 B9R1.2 Cc1cccc(c1)S[13CH3] 62a_200025704644_100011215228 [2,1,0,0,0,0|1,0,0]=4 9128 B9R1.2 NCc1cccc(c1)O 271570a_203496583355_100000106179 [2,1,0,0,0,0|1,0,0]=4 9129 B9R1.2 O=Cc1cccc(c1)O 271570a_203496583355_100000014684 [2,1,0,0,0,0|1,0,0]=4 9130 B9R1.2 OCc1cccc(c1)O 271570a_203496583355_100000687537 [2,1,0,0,0,0|1,0,0]=4 9131 B9R1.2 Oc1cccc(c1)CF 271570a_203496583355_100010878472 [2,1,0,0,0,0|1,0,0]=4 9132 B9R1.2 [13CH3]Nc1cccc(c1)Br 34a_100000210019_200025704644 [2,1,0,0,0,0|1,0,0]=4 9133 B9R1.2 [13CH3]Nc1cccc(c1)Cl 34a_100000185859_200025704644 [2,1,0,0,0,0|1,0,0]=4 9134 B9R1.2 [13CH3]Nc1cccc(c1)F 34a_100000210047_200025704644 [2,1,0,0,0,0|1,0,0]=4 9135 B9R1.2 [13CH3]Nc1cccc(c1)I 34a_100000211102_200025704644 [2,1,0,0,0,0|1,0,0]=4 9136 B9R1.2 [13CH3]Nc1cccc(c1)O 34a_100000210217_200025704644 [2,1,0,0,0,0|1,0,0]=4 9137 B9R1.2 [13CH3]Oc1cccc(c1)Br 34a_100000210342_200025704644 [2,1,0,0,0,0|1,0,0]=4 9138 B9R1.2 [13CH3]Oc1cccc(c1)Br 7a_100000210342_200025704644 [2,1,0,0,0,0|1,0,0]=4 9139 B9R1.2 [13CH3]Oc1cccc(c1)Cl 34a_100000210295_200025704644 [2,1,0,0,0,0|1,0,0]=4 9140 B9R1.2 [13CH3]Oc1cccc(c1)Cl 7a_100000210295_200025704644 [2,1,0,0,0,0|1,0,0]=4 9141 B9R1.2 [13CH3]Oc1cccc(c1)F 34a_100000210426_200025704644 [2,1,0,0,0,0|1,0,0]=4 9142 B9R1.2 [13CH3]Oc1cccc(c1)F 7a_100000210426_200025704644 [2,1,0,0,0,0|1,0,0]=4 9143 B9R1.2 [13CH3]Oc1cccc(c1)I 34a_100000211634_200025704644 [2,1,0,0,0,0|1,0,0]=4 9144 B9R1.2 [13CH3]Oc1cccc(c1)I 7a_100000211634_200025704644 [2,1,0,0,0,0|1,0,0]=4 9145 B9R1.2 [13CH3]Oc1cccc(c1)N 34a_100000210217_200025704644 [2,1,0,0,0,0|1,0,0]=4 9146 B9R1.2 [13CH3]Sc1cccc(c1)Br 62a_100000691529_200025704644 [2,1,0,0,0,0|1,0,0]=4 9147 B9R1.2 [13CH3]Sc1cccc(c1)Br 62a_200025704644_100000691529 [2,1,0,0,0,0|1,0,0]=4 9148 B9R1.2 [13CH3]Sc1cccc(c1)Cl 62a_100000699651_200025704644 [2,1,0,0,0,0|1,0,0]=4 9149 B9R1.2 [13CH3]Sc1cccc(c1)Cl 62a_200025704644_100000699651 [2,1,0,0,0,0|1,0,0]=4 9150 B9R1.2 [13CH3]Sc1cccc(c1)F 62a_100000685547_200025704644 [2,1,0,0,0,0|1,0,0]=4 9151 B9R1.2 [13CH3]Sc1cccc(c1)F 62a_200025704644_100000685547 [2,1,0,0,0,0|1,0,0]=4 9152 B9R1.2 [13CH3]Sc1cccc(c1)N 62a_100000210019_200025704644 [2,1,0,0,0,0|1,0,0]=4 9153 B9R1.2 [13CH3]Sc1cccc(c1)N 62a_200025704644_100000210019 [2,1,0,0,0,0|1,0,0]=4 9154 B9R1.2 [13CH3]Sc1cccc(c1)O 62a_200025704644_100000211634 [2,1,0,0,0,0|1,0,0]=4 9155 B9R1.2 [13CH3]Sc1cccc(c1)[S] 62a_114929384022_200025704644 [2,1,0,0,0,0|1,0,0]=4 9156 B9R1.2 [13CH3]Sc1cccc(c1)[S] 62a_200025704644_114929384022 [2,1,0,0,0,0|1,0,0]=4 9157 B9R1.15 C=Cc1c[nH]ccc1=O 271570a_100011290941_100009998708 [2,1,0,0,0,0|1,0,0]=4 9158 B9R1.15 C=Cc1c[nH]ccc1=S 271570a_100011290941_200012280681 [2,1,0,0,0,0|1,0,0]=4 9159 B9R1.15 C=Cc1ccc[nH]c1=O 271570a_100011290941_100000050042 [2,1,0,0,0,0|1,0,0]=4 9160 B9R1.15 C=Cc1cccc[n+]1C 271570a_100011290941_100000212160 [2,1,0,0,0,0|1,0,0]=4 9161 B9R1.15 C=Cc1cccc[n+]1[O-] 271570a_100011290941_200000042595 [2,1,0,0,0,0|1,0,0]=4 9162 B9R1.15 C=Cc1ccccc1Br 271570a_100011290941_100000695589 [2,1,0,0,0,0|0,0,0]=3 9163 B9R1.15 C=Cc1ccccc1C 271570a_100011290941_100000210755 [2,1,0,0,0,0|0,0,0]=3 9164 B9R1.15 C=Cc1ccccc1Cl 271570a_100011290941_100000764095 [2,1,0,0,0,0|0,0,0]=3 9165 B9R1.15 C=Cc1ccccc1F 271570a_100011290941_100011215700 [2,1,0,0,0,0|0,0,0]=3 9166 B9R1.15 C=Cc1ccccc1N 271570a_100011290941_100000210017 [2,1,0,0,0,0|0,0,0]=3 9167 B9R1.15 C=Cc1ccccc1O 271570a_100011290941_100000739446 [2,1,0,0,0,0|0,0,0]=3 9168 B9R1.15 C=Cc1cccnc1Br 271570a_100011290941_100010202626 [2,1,0,0,0,0|1,0,0]=4 9169 B9R1.15 C=Cc1cccnc1C 271570a_100011290941_100000751574 [2,1,0,0,0,0|1,0,0]=4 9170 B9R1.15 C=Cc1cccnc1Cl 271570a_100011290941_100000036424 [2,1,0,0,0,0|1,0,0]=4 9171 B9R1.15 C=Cc1cccnc1F 271570a_100011290941_100009816115 [2,1,0,0,0,0|1,0,0]=4 9172 B9R1.15 C=Cc1cccnc1N 271570a_100011290941_100000045569 [2,1,0,0,0,0|1,0,0]=4 9173 B9R1.15 C=Cc1ccncc1Br 271570a_100011290941_100000726257 [2,1,0,0,0,0|1,0,0]=4 9174 B9R1.15 C=Cc1ccncc1C 271570a_100011290941_100015191297 [2,1,0,0,0,0|1,0,0]=4 9175 B9R1.15 C=Cc1ccncc1Cl 271570a_100011290941_100000708259 [2,1,0,0,0,0|1,0,0]=4 9176 B9R1.15 C=Cc1ccncc1F 271570a_100011290941_100000047030 [2,1,0,0,0,0|1,0,0]=4 9177 B9R1.15 C=Cc1ccncc1N 271570a_100011290941_100009815883 [2,1,0,0,0,0|1,0,0]=4 9178 B9R1.15 C=Cc1ccncc1O 271570a_100011290941_100009817591 [2,1,0,0,0,0|1,0,0]=4 9179 B9R1.15 C=Cc1cnccc1Br 271570a_100011290941_100010138639 [2,1,0,0,0,0|1,0,0]=4 9180 B9R1.15 C=Cc1cnccc1C 271570a_100011290941_100000761580 [2,1,0,0,0,0|1,0,0]=4 9181 B9R1.15 C=Cc1cnccc1Cl 271570a_100011290941_100009995489 [2,1,0,0,0,0|1,0,0]=4 9182 B9R1.15 C=Cc1cnccc1F 271570a_100011290941_100009820683 [2,1,0,0,0,0|1,0,0]=4 9183 B9R1.15 C=Cc1cnccc1N 271570a_100011290941_100000047001 [2,1,0,0,0,0|1,0,0]=4 9184 B9R1.15 C=Cc1ncccc1Br 271570a_100011290941_100000696092 [2,1,0,0,0,0|1,0,0]=4 9185 B9R1.15 C=Cc1ncccc1C 271570a_100011290941_100000751373 [2,1,0,0,0,0|1,0,0]=4 9186 B9R1.15 C=Cc1ncccc1Cl 271570a_100011290941_100011356963 [2,1,0,0,0,0|1,0,0]=4 9187 B9R1.15 C=Cc1ncccc1F 271570a_100011290941_100000685392 [2,1,0,0,0,0|1,0,0]=4 9188 B9R1.15 C=Cc1ncccc1N 271570a_100011290941_100000688686 [2,1,0,0,0,0|1,0,0]=4 9189 B9R1.15 C=Cc1ncccc1O 271570a_100011290941_100000034122 [2,1,0,0,0,0|1,0,0]=4 9190 B9R1.15 CCc1ccccc1O 271570a_203496583355_100011215823 [2,1,0,0,0,0|0,0,0]=3 9191 B9R1.15 CCc1ccncc1O 271570a_203496583355_100009819861 [2,1,0,0,0,0|1,0,0]=4 9192 B9R1.15 CCc1cnccc1O 271570a_203496583355_100025704421 [2,1,0,0,0,0|1,0,0]=4 9193 B9R1.15 CCc1ncccc1O 271570a_203496583355_100009877225 [2,1,0,0,0,0|1,0,0]=4 9194 B9R1.15 CNc1ccccc1Br 34a_100000210017_200000210301 [2,1,0,0,0,0|1,0,0]=4 9195 B9R1.15 CNc1ccccc1C 34a_100015192222_200000210301 [2,1,0,0,0,0|1,0,0]=4 9196 B9R1.15 CNc1ccccc1Cl 34a_100000185783_200000210301 [2,1,0,0,0,0|1,0,0]=4 9197 B9R1.15 CNc1ccccc1F 34a_100000210422_200000210301 [2,1,0,0,0,0|1,0,0]=4 9198 B9R1.15 CNc1ccccc1I 34a_100000210053_200000210301 [2,1,0,0,0,0|1,0,0]=4 9199 B9R1.15 CNc1ccccc1O 271570a_203496583355_100020606079 [2,1,0,0,0,0|1,0,0]=4 9200 B9R1.15 CNc1ccccc1O 34a_100000185747_200000210301 [2,1,0,0,0,0|1,0,0]=4 9201 B9R1.15 COc1ccccc1Br 34a_100000181306_200000210301 [2,1,0,0,0,0|1,0,0]=4 9202 B9R1.15 COc1ccccc1Br 7a_100000181306_200000210301 [2,1,0,0,0,0|1,0,0]=4 9203 B9R1.15 COc1ccccc1C 34a_100000210338_200000210301 [2,1,0,0,0,0|1,0,0]=4 9204 B9R1.15 COc1ccccc1C 7a_100000210338_200000210301 [2,1,0,0,0,0|1,0,0]=4 9205 B9R1.15 COc1ccccc1Cl 34a_100000210172_200000210301 [2,1,0,0,0,0|1,0,0]=4 9206 B9R1.15 COc1ccccc1Cl 7a_100000210172_200000210301 [2,1,0,0,0,0|1,0,0]=4 9207 B9R1.15 COc1ccccc1F 34a_100000210171_200000210301 [2,1,0,0,0,0|1,0,0]=4 9208 B9R1.15 COc1ccccc1F 7a_100000210171_200000210301 [2,1,0,0,0,0|1,0,0]=4 9209 B9R1.15 COc1ccccc1I 34a_100000739446_200000210301 [2,1,0,0,0,0|1,0,0]=4 9210 B9R1.15 COc1ccccc1I 7a_100000739446_200000210301 [2,1,0,0,0,0|1,0,0]=4 9211 B9R1.15 COc1ccccc1N 34a_100000185747_200000210301 [2,1,0,0,0,0|1,0,0]=4 9212 B9R1.15 COc1ccccc1N 7a_100000185747_200000210301 [2,1,0,0,0,0|1,0,0]=4 9213 B9R1.15 COc1ccccc1O 271570a_203496583355_100000174000 [2,1,0,0,0,0|1,0,0]=4 9214 B9R1.15 CSc1ccccc1Br 62a_100000695589_200000210301 [2,1,0,0,0,0|1,0,0]=4 9215 B9R1.15 CSc1ccccc1Br 62a_200000210301_100000695589 [2,1,0,0,0,0|1,0,0]=4 9216 B9R1.15 CSc1ccccc1C 62a_100000210755_200000210301 [2,1,0,0,0,0|1,0,0]=4 9217 B9R1.15 CSc1ccccc1C 62a_200000210301_100000210755 [2,1,0,0,0,0|1,0,0]=4 9218 B9R1.15 CSc1ccccc1Cl 62a_100000764095_200000210301 [2,1,0,0,0,0|1,0,0]=4 9219 B9R1.15 CSc1ccccc1Cl 62a_200000210301_100000764095 [2,1,0,0,0,0|1,0,0]=4 9220 B9R1.15 CSc1ccccc1F 62a_100011215700_200000210301 [2,1,0,0,0,0|1,0,0]=4 9221 B9R1.15 CSc1ccccc1F 62a_200000210301_100011215700 [2,1,0,0,0,0|1,0,0]=4 9222 B9R1.15 CSc1ccccc1N 62a_100000210017_200000210301 [2,1,0,0,0,0|1,0,0]=4 9223 B9R1.15 CSc1ccccc1N 62a_200000210301_100000210017 [2,1,0,0,0,0|1,0,0]=4 9224 B9R1.15 CSc1ccccc1O 271570a_203496583355_100011217816 [2,1,0,0,0,0|1,0,0]=4 9225 B9R1.15 CSc1ccccc1O 62a_100000739446_200000210301 [2,1,0,0,0,0|1,0,0]=4 9226 B9R1.15 CSc1ccccc1O 62a_200000210301_100000739446 [2,1,0,0,0,0|1,0,0]=4 9227 B9R1.15 Cc1ccccc1N[13CH3] 34a_100015192222_200025704644 [2,1,0,0,0,0|1,0,0]=4 9228 B9R1.15 Cc1ccccc1O[13CH3] 34a_100000210338_200025704644 [2,1,0,0,0,0|1,0,0]=4 9229 B9R1.15 Cc1ccccc1O[13CH3] 7a_100000210338_200025704644 [2,1,0,0,0,0|1,0,0]=4 9230 B9R1.15 Cc1ccccc1S[13CH3] 62a_100000210755_200025704644 [2,1,0,0,0,0|1,0,0]=4 9231 B9R1.15 Cc1ccccc1S[13CH3] 62a_200025704644_100000210755 [2,1,0,0,0,0|1,0,0]=4 9232 B9R1.15 NCc1ccccc1O 271570a_203496583355_100000689332 [2,1,0,0,0,0|1,0,0]=4 9233 B9R1.15 O=Cc1ccccc1O 271570a_203496583355_100000211189 [2,1,0,0,0,0|1,0,0]=4 9234 B9R1.15 OCc1ccccc1O 271570a_203496583355_100000187465 [2,1,0,0,0,0|1,0,0]=4 9235 B9R1.15 [13CH3]Nc1ccccc1Br 34a_100000210017_200025704644 [2,1,0,0,0,0|1,0,0]=4 9236 B9R1.15 [13CH3]Nc1ccccc1Cl 34a_100000185783_200025704644 [2,1,0,0,0,0|1,0,0]=4 9237 B9R1.15 [13CH3]Nc1ccccc1F 34a_100000210422_200025704644 [2,1,0,0,0,0|1,0,0]=4 9238 B9R1.15 [13CH3]Nc1ccccc1I 34a_100000210053_200025704644 [2,1,0,0,0,0|1,0,0]=4 9239 B9R1.15 [13CH3]Nc1ccccc1O 34a_100000185747_200025704644 [2,1,0,0,0,0|1,0,0]=4 9240 B9R1.15 [13CH3]Oc1ccccc1Br 34a_100000181306_200025704644 [2,1,0,0,0,0|1,0,0]=4 9241 B9R1.15 [13CH3]Oc1ccccc1Br 7a_100000181306_200025704644 [2,1,0,0,0,0|1,0,0]=4 9242 B9R1.15 [13CH3]Oc1ccccc1Cl 34a_100000210172_200025704644 [2,1,0,0,0,0|1,0,0]=4 9243 B9R1.15 [13CH3]Oc1ccccc1Cl 7a_100000210172_200025704644 [2,1,0,0,0,0|1,0,0]=4 9244 B9R1.15 [13CH3]Oc1ccccc1F 34a_100000210171_200025704644 [2,1,0,0,0,0|1,0,0]=4 9245 B9R1.15 [13CH3]Oc1ccccc1F 7a_100000210171_200025704644 [2,1,0,0,0,0|1,0,0]=4 9246 B9R1.15 [13CH3]Oc1ccccc1I 34a_100000739446_200025704644 [2,1,0,0,0,0|1,0,0]=4 9247 B9R1.15 [13CH3]Oc1ccccc1I 7a_100000739446_200025704644 [2,1,0,0,0,0|1,0,0]=4 9248 B9R1.15 [13CH3]Oc1ccccc1N 34a_100000185747_200025704644 [2,1,0,0,0,0|1,0,0]=4 9249 B9R1.15 [13CH3]Oc1ccccc1N 7a_100000185747_200025704644 [2,1,0,0,0,0|1,0,0]=4 9250 B9R1.15 [13CH3]Sc1ccccc1Br 62a_100000695589_200025704644 [2,1,0,0,0,0|1,0,0]=4 9251 B9R1.15 [13CH3]Sc1ccccc1Br 62a_200025704644_100000695589 [2,1,0,0,0,0|1,0,0]=4 9252 B9R1.15 [13CH3]Sc1ccccc1Cl 62a_100000764095_200025704644 [2,1,0,0,0,0|1,0,0]=4 9253 B9R1.15 [13CH3]Sc1ccccc1Cl 62a_200025704644_100000764095 [2,1,0,0,0,0|1,0,0]=4 9254 B9R1.15 [13CH3]Sc1ccccc1F 62a_100011215700_200025704644 [2,1,0,0,0,0|1,0,0]=4 9255 B9R1.15 [13CH3]Sc1ccccc1F 62a_200025704644_100011215700 [2,1,0,0,0,0|1,0,0]=4 9256 B9R1.15 [13CH3]Sc1ccccc1N 62a_100000210017_200025704644 [2,1,0,0,0,0|1,0,0]=4 9257 B9R1.15 [13CH3]Sc1ccccc1N 62a_200025704644_100000210017 [2,1,0,0,0,0|1,0,0]=4 9258 B9R1.15 [13CH3]Sc1ccccc1O 62a_100000739446_200025704644 [2,1,0,0,0,0|1,0,0]=4 9259 B9R1.15 [13CH3]Sc1ccccc1O 62a_200025704644_100000739446 [2,1,0,0,0,0|1,0,0]=4 9260 B9R1.12 C=CCOc1ccsc1 34a_100000106738_100015514636 [1,1,0,0,1,0|1,0,0]=4 9261 B9R1.12 C=CCOc1ccsc1 7a_100000106738_100015514636 [1,1,0,0,1,0|1,0,0]=4 9262 B9R1.12 C=CCSc1ccco1 62a_100000210623_100009814098 [1,1,0,0,1,0|1,0,0]=4 9263 B9R1.12 C=CCSc1ccco1 62a_100009814098_100000210623 [1,1,0,0,1,0|1,0,0]=4 9264 B9R1.12 C=CCSc1cccs1 62a_100000210623_100011215356 [1,1,0,0,1,0|1,0,0]=4 9265 B9R1.12 C=CCSc1cccs1 62a_100011215356_100000210623 [1,1,0,0,1,0|1,0,0]=4 9266 B9R1.12 C=CCSc1ccoc1 62a_100000210623_100011215275 [1,1,0,0,1,0|1,0,0]=4 9267 B9R1.12 C=CCSc1ccoc1 62a_100011215275_100000210623 [1,1,0,0,1,0|1,0,0]=4 9268 B9R1.12 C=CCSc1ccsc1 62a_100000210623_100000738268 [1,1,0,0,1,0|1,0,0]=4 9269 B9R1.12 C=CCSc1ccsc1 62a_100000738268_100000210623 [1,1,0,0,1,0|1,0,0]=4 9270 B9R1.35 C=C(C)c1cc(cs1)C 271570a_100000694244_100009876951 [0,1,0,0,2,0|1,0,0]=4 9271 B9R1.35 C=C(C)c1ccc(s1)Br 271570a_100000694244_100010197418 [0,1,0,0,2,0|1,0,0]=4 9272 B9R1.35 C=C(C)c1ccc(s1)C 271570a_100000694244_100000761539 [0,1,0,0,2,0|1,0,0]=4 9273 B9R1.35 C=C(C)c1csc(c1)C 271570a_100000694244_100000759034 [0,1,0,0,2,0|1,0,0]=4 9274 B9R1.41 C=C(C)c1ccsc1C 271570a_100000694244_100000684487 [0,1,0,0,2,0|1,0,0]=4 9275 B9R1.41 C=C(C)c1cscc1Br 271570a_100000694244_100010143727 [0,1,0,0,2,0|1,0,0]=4 9276 B9R1.41 C=C(C)c1cscc1C 271570a_100000694244_100000759966 [0,1,0,0,2,0|1,0,0]=4 9277 B9R1.41 C=C(C)c1sccc1Br 271570a_100000694244_100012361411 [0,1,0,0,2,0|1,0,0]=4 9278 B9R1.41 C=C(C)c1sccc1C 271570a_100000694244_100000742657 [0,1,0,0,2,0|1,0,0]=4 9279 B11R0.147 C=CC=CC(=O)NNCC(=C)C 22a_100000729518_100016291481 [0,2,1,0,0,0|1,0,0]=4 9280 B11R0.46 C=C(C)CCC(=O)C=C/C=C/C 1458a_100000185730_100000730704 [0,2,1,0,0,0|0,0,1]=4 9281 B11R0.46 C=C(C)CNC(=O)C=C/C=C/C 11a_100000765925_100000185730 [0,2,1,0,0,0|0,0,1]=4 9282 B11R0.46 C=C(C)CNC(=O)C=C/C=C/C 1626a_100000765925_100000185730 [0,2,1,0,0,0|0,0,1]=4 9283 B11R0.46 C=C(C)CNC(=O)C=C/C=C/C 240690a_100000765925_100000185730 [0,2,1,0,0,0|0,0,1]=4 9284 B11R0.68 C=CC=CC(=O)N(C)CC(=C)C 1626a_100000225649_100016291481 [0,2,1,0,0,0|1,0,0]=4 9285 B11R0.107 C=C(C)CC(=O)C=CC(=CC)C 1458a_100000692105_100000748629 [0,2,1,0,0,0|0,0,1]=4 9286 B11R1.1 C=CCNc1ccc(cc1)Br 2230a_100000210018_100000210623 [1,2,0,0,0,0|0,0,0]=3 9287 B11R1.1 C=CCNc1ccc(cc1)Br 34a_100000210018_100015514636 [1,2,0,0,0,0|0,0,0]=3 9288 B11R1.1 C=CCNc1ccc(cc1)C 34a_100000124888_100015514636 [1,2,0,0,0,0|0,0,0]=3 9289 B11R1.1 C=CCNc1ccc(cc1)Cl 2230a_100000210052_100000210623 [1,2,0,0,0,0|0,0,0]=3 9290 B11R1.1 C=CCNc1ccc(cc1)Cl 34a_100000210052_100015514636 [1,2,0,0,0,0|0,0,0]=3 9291 B11R1.1 C=CCNc1ccc(cc1)F 34a_100000185862_100015514636 [1,2,0,0,0,0|0,0,0]=3 9292 B11R1.1 C=CCNc1ccc(cc1)I 34a_100000185761_100015514636 [1,2,0,0,0,0|0,0,0]=3 9293 B11R1.1 C=CCNc1ccc(cc1)O 34a_100000185829_100015514636 [1,2,0,0,0,0|0,0,0]=3 9294 B11R1.1 C=CCNc1ccc(cn1)Br 27a_100020586998_100000686858 [1,2,0,0,0,0|1,0,0]=4 9295 B11R1.1 C=CCOc1ccc(=O)[nH]c1 34a_100000075641_100015514636 [1,2,0,0,0,0|1,0,0]=4 9296 B11R1.1 C=CCOc1ccc(cc1)Br 34a_100000185759_100015514636 [1,2,0,0,0,0|0,0,0]=3 9297 B11R1.1 C=CCOc1ccc(cc1)Br 7a_100000185759_100015514636 [1,2,0,0,0,0|0,0,0]=3 9298 B11R1.1 C=CCOc1ccc(cc1)C 34a_100000210336_100015514636 [1,2,0,0,0,0|0,0,0]=3 9299 B11R1.1 C=CCOc1ccc(cc1)C 7a_100000210336_100015514636 [1,2,0,0,0,0|0,0,0]=3 9300 B11R1.1 C=CCOc1ccc(cc1)Cl 34a_100000210216_100015514636 [1,2,0,0,0,0|0,0,0]=3 9301 B11R1.1 C=CCOc1ccc(cc1)Cl 7a_100000210216_100015514636 [1,2,0,0,0,0|0,0,0]=3 9302 B11R1.1 C=CCOc1ccc(cc1)F 34a_100000210339_100015514636 [1,2,0,0,0,0|0,0,0]=3 9303 B11R1.1 C=CCOc1ccc(cc1)I 34a_100000212066_100015514636 [1,2,0,0,0,0|0,0,0]=3 9304 B11R1.1 C=CCOc1ccc(cc1)I 7a_100000212066_100015514636 [1,2,0,0,0,0|0,0,0]=3 9305 B11R1.1 C=CCOc1ccc(cc1)N 34a_100000185829_100015514636 [1,2,0,0,0,0|0,0,0]=3 9306 B11R1.1 C=CCOc1ccc(cc1)O 271570a_203496583355_100000172055 [1,2,0,0,0,0|0,0,0]=3 9307 B11R1.1 C=CCOc1ccc(cn1)C 34a_100000759353_100015514636 [1,2,0,0,0,0|1,0,0]=4 9308 B11R1.1 C=CCOc1ccc(cn1)Cl 34a_100011215309_100015514636 [1,2,0,0,0,0|1,0,0]=4 9309 B11R1.1 C=CCOc1ccc(cn1)F 34a_100000742473_100015514636 [1,2,0,0,0,0|1,0,0]=4 9310 B11R1.1 C=CCOc1ccc(cn1)N 34a_100000729260_100015514636 [1,2,0,0,0,0|1,0,0]=4 9311 B11R1.1 C=CCOc1ccc(nc1)Br 34a_100000685995_100015514636 [1,2,0,0,0,0|1,0,0]=4 9312 B11R1.1 C=CCOc1ccc(nc1)Br 7a_100000685995_100015514636 [1,2,0,0,0,0|1,0,0]=4 9313 B11R1.1 C=CCOc1ccc(nc1)C 34a_100000745506_100015514636 [1,2,0,0,0,0|1,0,0]=4 9314 B11R1.1 C=CCOc1ccc(nc1)C 7a_100000745506_100015514636 [1,2,0,0,0,0|1,0,0]=4 9315 B11R1.1 C=CCOc1ccc(nc1)Cl 34a_100000744096_100015514636 [1,2,0,0,0,0|1,0,0]=4 9316 B11R1.1 C=CCOc1ccc(nc1)Cl 7a_100000744096_100015514636 [1,2,0,0,0,0|1,0,0]=4 9317 B11R1.1 C=CCOc1ccc(nc1)F 34a_100000688820_100015514636 [1,2,0,0,0,0|1,0,0]=4 9318 B11R1.1 C=CCOc1ccc(nc1)F 7a_100000688820_100015514636 [1,2,0,0,0,0|1,0,0]=4 9319 B11R1.1 C=CCOc1ccc(nc1)I 34a_100000687607_100015514636 [1,2,0,0,0,0|1,0,0]=4 9320 B11R1.1 C=CCOc1ccc(nc1)I 7a_100000687607_100015514636 [1,2,0,0,0,0|1,0,0]=4 9321 B11R1.1 C=CCOc1ccc(nc1)N 34a_100015188713_100015514636 [1,2,0,0,0,0|1,0,0]=4 9322 B11R1.1 C=CCOc1ccc(nc1)N 7a_100015188713_100015514636 [1,2,0,0,0,0|1,0,0]=4 9323 B11R1.1 C=CCSc1cc[n+](cc1)[O-] 62a_100000210623_100000039755 [1,2,0,0,0,0|1,0,0]=4 9324 B11R1.1 C=CCSc1ccc(=O)[nH]c1 62a_100000210623_100000212171 [1,2,0,0,0,0|1,0,0]=4 9325 B11R1.1 C=CCSc1ccc(=O)[nH]c1 62a_100000212171_100000210623 [1,2,0,0,0,0|1,0,0]=4 9326 B11R1.1 C=CCSc1ccc(cc1)Br 62a_100000210623_100000752885 [1,2,0,0,0,0|0,0,0]=3 9327 B11R1.1 C=CCSc1ccc(cc1)Br 62a_100000752885_100000210623 [1,2,0,0,0,0|0,0,0]=3 9328 B11R1.1 C=CCSc1ccc(cc1)C 62a_100000186775_100000210623 [1,2,0,0,0,0|0,0,0]=3 9329 B11R1.1 C=CCSc1ccc(cc1)C 62a_100000210623_100000186775 [1,2,0,0,0,0|0,0,0]=3 9330 B11R1.1 C=CCSc1ccc(cc1)Cl 62a_100000210623_100000755918 [1,2,0,0,0,0|0,0,0]=3 9331 B11R1.1 C=CCSc1ccc(cc1)Cl 62a_100000755918_100000210623 [1,2,0,0,0,0|0,0,0]=3 9332 B11R1.1 C=CCSc1ccc(cc1)F 62a_100000210623_100000211213 [1,2,0,0,0,0|0,0,0]=3 9333 B11R1.1 C=CCSc1ccc(cc1)F 62a_100000211213_100000210623 [1,2,0,0,0,0|0,0,0]=3 9334 B11R1.1 C=CCSc1ccc(cc1)N 62a_100000185761_100000210623 [1,2,0,0,0,0|0,0,0]=3 9335 B11R1.1 C=CCSc1ccc(cc1)N 62a_100000210623_100000185761 [1,2,0,0,0,0|0,0,0]=3 9336 B11R1.1 C=CCSc1ccc(cc1)O 62a_100000210623_100000185759 [1,2,0,0,0,0|0,0,0]=3 9337 B11R1.1 C=CCSc1ccc(cn1)Br 62a_100000210623_100000686858 [1,2,0,0,0,0|1,0,0]=4 9338 B11R1.1 C=CCSc1ccc(cn1)Br 62a_100000686858_100000210623 [1,2,0,0,0,0|1,0,0]=4 9339 B11R1.1 C=CCSc1ccc(cn1)C 62a_100000210623_100000754016 [1,2,0,0,0,0|1,0,0]=4 9340 B11R1.1 C=CCSc1ccc(cn1)C 62a_100011192072_100000210623 [1,2,0,0,0,0|1,0,0]=4 9341 B11R1.1 C=CCSc1ccc(cn1)Cl 62a_100000210623_100011356976 [1,2,0,0,0,0|1,0,0]=4 9342 B11R1.1 C=CCSc1ccc(cn1)Cl 62a_100011356976_100000210623 [1,2,0,0,0,0|1,0,0]=4 9343 B11R1.1 C=CCSc1ccc(cn1)F 62a_100000210623_100000744514 [1,2,0,0,0,0|1,0,0]=4 9344 B11R1.1 C=CCSc1ccc(cn1)F 62a_100000744514_100000210623 [1,2,0,0,0,0|1,0,0]=4 9345 B11R1.1 C=CCSc1ccc(cn1)N 62a_100000210623_100000737798 [1,2,0,0,0,0|1,0,0]=4 9346 B11R1.1 C=CCSc1ccc(cn1)N 62a_100000737798_100000210623 [1,2,0,0,0,0|1,0,0]=4 9347 B11R1.1 C=CCSc1ccc(cn1)O 62a_100000210623_100000744096 [1,2,0,0,0,0|1,0,0]=4 9348 B11R1.1 C=CCSc1ccc(cn1)O 62a_100000685995_100000210623 [1,2,0,0,0,0|1,0,0]=4 9349 B11R1.1 C=CCSc1ccc(nc1)Br 62a_100000210623_100009814638 [1,2,0,0,0,0|1,0,0]=4 9350 B11R1.1 C=CCSc1ccc(nc1)Br 62a_100009814638_100000210623 [1,2,0,0,0,0|1,0,0]=4 9351 B11R1.1 C=CCSc1ccc(nc1)C 62a_100000210623_100000751577 [1,2,0,0,0,0|1,0,0]=4 9352 B11R1.1 C=CCSc1ccc(nc1)C 62a_100000751577_100000210623 [1,2,0,0,0,0|1,0,0]=4 9353 B11R1.1 C=CCSc1ccc(nc1)Cl 62a_100000034144_100000210623 [1,2,0,0,0,0|1,0,0]=4 9354 B11R1.1 C=CCSc1ccc(nc1)Cl 62a_100000210623_100000034144 [1,2,0,0,0,0|1,0,0]=4 9355 B11R1.1 C=CCSc1ccc(nc1)F 62a_100000042367_100000210623 [1,2,0,0,0,0|1,0,0]=4 9356 B11R1.1 C=CCSc1ccc(nc1)F 62a_100000210623_100000042367 [1,2,0,0,0,0|1,0,0]=4 9357 B11R1.1 C=CCSc1ccc(nc1)N 62a_100000187370_100000210623 [1,2,0,0,0,0|1,0,0]=4 9358 B11R1.1 C=CCSc1ccc(nc1)N 62a_100000210623_100000187370 [1,2,0,0,0,0|1,0,0]=4 9359 B11R1.1 CC=NNc1ccc(cc1)Br 4a_100000735608_200000210099 [1,2,0,0,0,0|1,0,0]=4 9360 B11R1.1 CC=NNc1ccc(cc1)C 4a_100000683527_200000210099 [1,2,0,0,0,0|1,0,0]=4 9361 B11R1.1 CC=NNc1ccc(cc1)Cl 4a_100000683521_200000210099 [1,2,0,0,0,0|1,0,0]=4 9362 B11R1.1 CC=NNc1ccc(cc1)F 4a_100000728448_200000210099 [1,2,0,0,0,0|1,0,0]=4 9363 B11R1.1 CC=NNc1ccc(cc1)I 4a_100016988836_200000210099 [1,2,0,0,0,0|1,0,0]=4 9364 B11R1.1 CCCCc1ccc(cc1)Br 271570a_100020621405_100000752885 [1,2,0,0,0,0|0,0,1]=4 9365 B11R1.1 CCCCc1ccc(cc1)C 271570a_100020621405_100000186775 [1,2,0,0,0,0|0,0,1]=4 9366 B11R1.1 CCCCc1ccc(cc1)Cl 271570a_100020621405_100000755918 [1,2,0,0,0,0|0,0,1]=4 9367 B11R1.1 CCCCc1ccc(cc1)F 271570a_100020621405_100000211213 [1,2,0,0,0,0|0,0,1]=4 9368 B11R1.1 CCCCc1ccc(cc1)N 271570a_100020621405_100000185761 [1,2,0,0,0,0|0,0,1]=4 9369 B11R1.1 CCCCc1ccc(cc1)O 271570a_100020621405_100000185759 [1,2,0,0,0,0|0,0,1]=4 9370 B11R1.1 CCCCc1ccc(cc1)O 271570a_203496583355_100011215597 [1,2,0,0,0,0|0,0,1]=4 9371 B11R1.1 CCCNc1ccc(cc1)Br 2230a_100000210018_100000210303 [1,2,0,0,0,0|0,0,1]=4 9372 B11R1.1 CCCNc1ccc(cc1)Br 34a_100000210018_100000210303 [1,2,0,0,0,0|0,0,1]=4 9373 B11R1.1 CCCNc1ccc(cc1)C 34a_100000124888_100000210303 [1,2,0,0,0,0|0,0,1]=4 9374 B11R1.1 CCCNc1ccc(cc1)Cl 2230a_100000210052_100000210303 [1,2,0,0,0,0|0,0,1]=4 9375 B11R1.1 CCCNc1ccc(cc1)Cl 34a_100000210052_100000210303 [1,2,0,0,0,0|0,0,1]=4 9376 B11R1.1 CCCNc1ccc(cc1)F 34a_100000185862_100000210303 [1,2,0,0,0,0|0,0,1]=4 9377 B11R1.1 CCCNc1ccc(cc1)I 34a_100000185761_100000210303 [1,2,0,0,0,0|0,0,1]=4 9378 B11R1.1 CCCNc1ccc(cc1)O 34a_100000185829_100000210303 [1,2,0,0,0,0|0,0,1]=4 9379 B11R1.1 CCCOc1ccc(cc1)Br 34a_100000185759_100000210303 [1,2,0,0,0,0|0,0,1]=4 9380 B11R1.1 CCCOc1ccc(cc1)Br 7a_100000185759_100000210303 [1,2,0,0,0,0|0,0,1]=4 9381 B11R1.1 CCCOc1ccc(cc1)C 34a_100000210336_100000210303 [1,2,0,0,0,0|0,0,1]=4 9382 B11R1.1 CCCOc1ccc(cc1)C 7a_100000210336_100000210303 [1,2,0,0,0,0|0,0,1]=4 9383 B11R1.1 CCCOc1ccc(cc1)Cl 34a_100000210216_100000210303 [1,2,0,0,0,0|0,0,1]=4 9384 B11R1.1 CCCOc1ccc(cc1)Cl 7a_100000210216_100000210303 [1,2,0,0,0,0|0,0,1]=4 9385 B11R1.1 CCCOc1ccc(cc1)F 34a_100000210339_100000210303 [1,2,0,0,0,0|0,0,1]=4 9386 B11R1.1 CCCOc1ccc(cc1)I 34a_100000212066_100000210303 [1,2,0,0,0,0|0,0,1]=4 9387 B11R1.1 CCCOc1ccc(cc1)I 7a_100000212066_100000210303 [1,2,0,0,0,0|0,0,1]=4 9388 B11R1.1 CCCOc1ccc(cc1)N 34a_100000185829_100000210303 [1,2,0,0,0,0|0,0,1]=4 9389 B11R1.1 CCCOc1ccc(cc1)O 271570a_203496583355_100000169948 [1,2,0,0,0,0|0,0,1]=4 9390 B11R1.1 CCCSc1ccc(cc1)Br 62a_100000210303_100000752885 [1,2,0,0,0,0|0,0,1]=4 9391 B11R1.1 CCCSc1ccc(cc1)Br 62a_100000752885_100000210303 [1,2,0,0,0,0|0,0,1]=4 9392 B11R1.1 CCCSc1ccc(cc1)C 62a_100000186775_100000210303 [1,2,0,0,0,0|0,0,1]=4 9393 B11R1.1 CCCSc1ccc(cc1)C 62a_100000210303_100000186775 [1,2,0,0,0,0|0,0,1]=4 9394 B11R1.1 CCCSc1ccc(cc1)Cl 62a_100000210303_100000755918 [1,2,0,0,0,0|0,0,1]=4 9395 B11R1.1 CCCSc1ccc(cc1)Cl 62a_100000755918_100000210303 [1,2,0,0,0,0|0,0,1]=4 9396 B11R1.1 CCCSc1ccc(cc1)F 62a_100000210303_100000211213 [1,2,0,0,0,0|0,0,1]=4 9397 B11R1.1 CCCSc1ccc(cc1)F 62a_100000211213_100000210303 [1,2,0,0,0,0|0,0,1]=4 9398 B11R1.1 CCCSc1ccc(cc1)N 62a_100000185761_100000210303 [1,2,0,0,0,0|0,0,1]=4 9399 B11R1.1 CCCSc1ccc(cc1)N 62a_100000210303_100000185761 [1,2,0,0,0,0|0,0,1]=4 9400 B11R1.1 CCCSc1ccc(cc1)O 271570a_203496583355_200009811899 [1,2,0,0,0,0|0,0,1]=4 9401 B11R1.1 CCCSc1ccc(cc1)O 62a_100000210303_100000185759 [1,2,0,0,0,0|0,0,1]=4 9402 B11R1.1 CCNCc1ccc(cc1)Br 207a_100015525214_100000186029 [1,2,0,0,0,0|0,0,1]=4 9403 B11R1.1 CCNCc1ccc(cc1)Br 2230a_100000174875_100000210202 [1,2,0,0,0,0|0,0,1]=4 9404 B11R1.1 CCNCc1ccc(cc1)Br 2230a_100015525214_100011217064 [1,2,0,0,0,0|0,0,1]=4 9405 B11R1.1 CCNCc1ccc(cc1)Br 270004a_100015525214_100000186029 [1,2,0,0,0,0|0,0,1]=4 9406 B11R1.1 CCNCc1ccc(cc1)Br 34a_100000174875_100000210202 [1,2,0,0,0,0|0,0,1]=4 9407 B11R1.1 CCNCc1ccc(cc1)C 207a_100015525214_100000211033 [1,2,0,0,0,0|0,0,1]=4 9408 B11R1.1 CCNCc1ccc(cc1)C 2230a_100000174908_100000210202 [1,2,0,0,0,0|0,0,1]=4 9409 B11R1.1 CCNCc1ccc(cc1)C 2230a_100015525214_100000210814 [1,2,0,0,0,0|0,0,1]=4 9410 B11R1.1 CCNCc1ccc(cc1)C 270004a_100015525214_100000211033 [1,2,0,0,0,0|0,0,1]=4 9411 B11R1.1 CCNCc1ccc(cc1)C 34a_100000174908_100000210202 [1,2,0,0,0,0|0,0,1]=4 9412 B11R1.1 CCNCc1ccc(cc1)Cl 207a_100015525214_100000189385 [1,2,0,0,0,0|0,0,1]=4 9413 B11R1.1 CCNCc1ccc(cc1)Cl 2230a_100000174871_100000210202 [1,2,0,0,0,0|0,0,1]=4 9414 B11R1.1 CCNCc1ccc(cc1)Cl 2230a_100015525214_100000694040 [1,2,0,0,0,0|0,0,1]=4 9415 B11R1.1 CCNCc1ccc(cc1)Cl 270004a_100015525214_100000189385 [1,2,0,0,0,0|0,0,1]=4 9416 B11R1.1 CCNCc1ccc(cc1)Cl 34a_100000174871_100000210202 [1,2,0,0,0,0|0,0,1]=4 9417 B11R1.1 CCNCc1ccc(cc1)F 207a_100015525214_100000210084 [1,2,0,0,0,0|0,0,1]=4 9418 B11R1.1 CCNCc1ccc(cc1)F 2230a_100000174882_100000210202 [1,2,0,0,0,0|0,0,1]=4 9419 B11R1.1 CCNCc1ccc(cc1)F 2230a_100015525214_100000198546 [1,2,0,0,0,0|0,0,1]=4 9420 B11R1.1 CCNCc1ccc(cc1)F 270004a_100015525214_100000210084 [1,2,0,0,0,0|0,0,1]=4 9421 B11R1.1 CCNCc1ccc(cc1)F 34a_100000174882_100000210202 [1,2,0,0,0,0|0,0,1]=4 9422 B11R1.1 CCNCc1ccc(cc1)I 207a_100015525214_100000188517 [1,2,0,0,0,0|0,0,1]=4 9423 B11R1.1 CCNCc1ccc(cc1)I 2230a_100015525214_100000189116 [1,2,0,0,0,0|0,0,1]=4 9424 B11R1.1 CCNCc1ccc(cc1)I 2230a_100016989417_100000210202 [1,2,0,0,0,0|0,0,1]=4 9425 B11R1.1 CCNCc1ccc(cc1)I 34a_100016989417_100000210202 [1,2,0,0,0,0|0,0,1]=4 9426 B11R1.1 CCNCc1ccc(cc1)O 271570a_203496583355_100000187385 [1,2,0,0,0,0|0,0,1]=4 9427 B11R1.1 CCNCc1ccc(cc1)O 34a_100000185549_100000210202 [1,2,0,0,0,0|0,0,1]=4 9428 B11R1.1 CCOCc1ccc(cc1)Br 34a_100000695286_100000210202 [1,2,0,0,0,0|0,0,1]=4 9429 B11R1.1 CCOCc1ccc(cc1)Br 34a_100121572206_100000189115 [1,2,0,0,0,0|0,0,1]=4 9430 B11R1.1 CCOCc1ccc(cc1)C 34a_100011215236_100000210202 [1,2,0,0,0,0|0,0,1]=4 9431 B11R1.1 CCOCc1ccc(cc1)C 34a_100121572206_100000210814 [1,2,0,0,0,0|0,0,1]=4 9432 B11R1.1 CCOCc1ccc(cc1)C 7a_100011215236_100000210202 [1,2,0,0,0,0|0,0,1]=4 9433 B11R1.1 CCOCc1ccc(cc1)Cl 34a_100000211118_100000210202 [1,2,0,0,0,0|0,0,1]=4 9434 B11R1.1 CCOCc1ccc(cc1)Cl 34a_100121572206_100000694040 [1,2,0,0,0,0|0,0,1]=4 9435 B11R1.1 CCOCc1ccc(cc1)Cl 7a_100000211118_100000210202 [1,2,0,0,0,0|0,0,1]=4 9436 B11R1.1 CCOCc1ccc(cc1)F 34a_100000210977_100000210202 [1,2,0,0,0,0|0,0,1]=4 9437 B11R1.1 CCOCc1ccc(cc1)F 34a_100121572206_100000198546 [1,2,0,0,0,0|0,0,1]=4 9438 B11R1.1 CCOCc1ccc(cc1)F 7a_100000210977_100000210202 [1,2,0,0,0,0|0,0,1]=4 9439 B11R1.1 CCOCc1ccc(cc1)I 34a_100000690907_100000210202 [1,2,0,0,0,0|0,0,1]=4 9440 B11R1.1 CCOCc1ccc(cc1)I 34a_100121572206_100000189116 [1,2,0,0,0,0|0,0,1]=4 9441 B11R1.1 CCOCc1ccc(cc1)I 7a_100000690907_100000210202 [1,2,0,0,0,0|0,0,1]=4 9442 B11R1.1 CCOCc1ccc(cc1)N 34a_100011215238_100000210202 [1,2,0,0,0,0|0,0,1]=4 9443 B11R1.1 CCOCc1ccc(cc1)O 271570a_203496583355_100000758564 [1,2,0,0,0,0|0,0,1]=4 9444 B11R1.1 CCSCc1ccc(cc1)Br 62a_100000189115_100000210202 [1,2,0,0,0,0|0,0,1]=4 9445 B11R1.1 CCSCc1ccc(cc1)Br 62a_100000210202_100000189115 [1,2,0,0,0,0|0,0,1]=4 9446 B11R1.1 CCSCc1ccc(cc1)C 62a_100000210202_100000210814 [1,2,0,0,0,0|0,0,1]=4 9447 B11R1.1 CCSCc1ccc(cc1)C 62a_100000210814_100000210202 [1,2,0,0,0,0|0,0,1]=4 9448 B11R1.1 CCSCc1ccc(cc1)Cl 62a_100000187161_100000210202 [1,2,0,0,0,0|0,0,1]=4 9449 B11R1.1 CCSCc1ccc(cc1)Cl 62a_100000210202_100000187161 [1,2,0,0,0,0|0,0,1]=4 9450 B11R1.1 CCSCc1ccc(cc1)F 62a_100000198546_100000210202 [1,2,0,0,0,0|0,0,1]=4 9451 B11R1.1 CCSCc1ccc(cc1)F 62a_100000210202_100000187164 [1,2,0,0,0,0|0,0,1]=4 9452 B11R1.1 CCSCc1ccc(cc1)I 62a_100000189116_100000210202 [1,2,0,0,0,0|0,0,1]=4 9453 B11R1.1 CCSCc1ccc(cc1)I 62a_100000210202_100000189116 [1,2,0,0,0,0|0,0,1]=4 9454 B11R1.1 CNCCc1ccc(cc1)Br 2230a_100000755846_200000210301 [1,2,0,0,0,0|0,0,1]=4 9455 B11R1.1 CNCCc1ccc(cc1)Br 2230a_106832991635_100011740612 [1,2,0,0,0,0|0,0,1]=4 9456 B11R1.1 CNCCc1ccc(cc1)Br 34a_100000755846_200000210301 [1,2,0,0,0,0|0,0,1]=4 9457 B11R1.1 CNCCc1ccc(cc1)Br 34a_100102657272_100011740612 [1,2,0,0,0,0|0,0,1]=4 9458 B11R1.1 CNCCc1ccc(cc1)Br 7a_106832991635_100011740612 [1,2,0,0,0,0|0,0,1]=4 9459 B11R1.1 CNCCc1ccc(cc1)C 2230a_100000705350_200000210301 [1,2,0,0,0,0|0,0,1]=4 9460 B11R1.1 CNCCc1ccc(cc1)C 2230a_106832991635_100011713686 [1,2,0,0,0,0|0,0,1]=4 9461 B11R1.1 CNCCc1ccc(cc1)C 34a_100000705350_200000210301 [1,2,0,0,0,0|0,0,1]=4 9462 B11R1.1 CNCCc1ccc(cc1)C 34a_100102657272_100011713686 [1,2,0,0,0,0|0,0,1]=4 9463 B11R1.1 CNCCc1ccc(cc1)C 7a_106832991635_100011713686 [1,2,0,0,0,0|0,0,1]=4 9464 B11R1.1 CNCCc1ccc(cc1)Cl 2230a_100000185265_200000210301 [1,2,0,0,0,0|0,0,1]=4 9465 B11R1.1 CNCCc1ccc(cc1)Cl 2230a_106832991635_100011713675 [1,2,0,0,0,0|0,0,1]=4 9466 B11R1.1 CNCCc1ccc(cc1)Cl 34a_100000185265_200000210301 [1,2,0,0,0,0|0,0,1]=4 9467 B11R1.1 CNCCc1ccc(cc1)Cl 34a_100102657272_100011713675 [1,2,0,0,0,0|0,0,1]=4 9468 B11R1.1 CNCCc1ccc(cc1)Cl 7a_106832991635_100011713675 [1,2,0,0,0,0|0,0,1]=4 9469 B11R1.1 CNCCc1ccc(cc1)F 2230a_100000199005_200000210301 [1,2,0,0,0,0|0,0,1]=4 9470 B11R1.1 CNCCc1ccc(cc1)F 2230a_106832991635_100011217392 [1,2,0,0,0,0|0,0,1]=4 9471 B11R1.1 CNCCc1ccc(cc1)F 34a_100000199005_200000210301 [1,2,0,0,0,0|0,0,1]=4 9472 B11R1.1 CNCCc1ccc(cc1)F 34a_100102657272_100011217392 [1,2,0,0,0,0|0,0,1]=4 9473 B11R1.1 CNCCc1ccc(cc1)F 7a_106832991635_100011217392 [1,2,0,0,0,0|0,0,1]=4 9474 B11R1.1 CNCCc1ccc(cc1)O 2230a_106832991635_100009816426 [1,2,0,0,0,0|0,0,1]=4 9475 B11R1.1 CNCCc1ccc(cc1)O 271570a_203496583355_100000752880 [1,2,0,0,0,0|0,0,1]=4 9476 B11R1.1 CNCCc1ccc(cc1)O 34a_100000743037_200000210301 [1,2,0,0,0,0|0,0,1]=4 9477 B11R1.1 CNCCc1ccc(cc1)O 7a_106832991635_100009816426 [1,2,0,0,0,0|0,0,1]=4 9478 B11R1.1 COC=Cc1ccc(cc1)O 271570a_203496583355_100020630460 [1,2,0,0,0,0|0,0,1]=4 9479 B11R1.1 COCCc1ccc(cc1)Br 34a_100000766406_200000210301 [1,2,0,0,0,0|0,0,1]=4 9480 B11R1.1 COCCc1ccc(cc1)Br 34a_100138415774_100011740612 [1,2,0,0,0,0|0,0,1]=4 9481 B11R1.1 COCCc1ccc(cc1)Br 7a_100000766406_200000210301 [1,2,0,0,0,0|0,0,1]=4 9482 B11R1.1 COCCc1ccc(cc1)C 34a_100000756670_200000210301 [1,2,0,0,0,0|0,0,1]=4 9483 B11R1.1 COCCc1ccc(cc1)C 34a_100138415774_100011713686 [1,2,0,0,0,0|0,0,1]=4 9484 B11R1.1 COCCc1ccc(cc1)C 7a_100000756670_200000210301 [1,2,0,0,0,0|0,0,1]=4 9485 B11R1.1 COCCc1ccc(cc1)Cl 34a_100011219627_200000210301 [1,2,0,0,0,0|0,0,1]=4 9486 B11R1.1 COCCc1ccc(cc1)Cl 34a_100138415774_100011713675 [1,2,0,0,0,0|0,0,1]=4 9487 B11R1.1 COCCc1ccc(cc1)Cl 7a_100011219627_200000210301 [1,2,0,0,0,0|0,0,1]=4 9488 B11R1.1 COCCc1ccc(cc1)F 34a_100000754732_200000210301 [1,2,0,0,0,0|0,0,1]=4 9489 B11R1.1 COCCc1ccc(cc1)F 34a_100138415774_100011217392 [1,2,0,0,0,0|0,0,1]=4 9490 B11R1.1 COCCc1ccc(cc1)F 7a_100000754732_200000210301 [1,2,0,0,0,0|0,0,1]=4 9491 B11R1.1 COCCc1ccc(cc1)I 34a_100012291149_200000210301 [1,2,0,0,0,0|0,0,1]=4 9492 B11R1.1 COCCc1ccc(cc1)I 7a_100012291149_200000210301 [1,2,0,0,0,0|0,0,1]=4 9493 B11R1.1 COCCc1ccc(cc1)N 34a_100011204434_200000210301 [1,2,0,0,0,0|0,0,1]=4 9494 B11R1.1 COCCc1ccc(cc1)O 271570a_203496583355_100000739703 [1,2,0,0,0,0|0,0,1]=4 9495 B11R1.1 COCNc1ccc(cc1)Br 2230a_100000210018_100000766300 [1,2,0,0,0,0|1,0,0]=4 9496 B11R1.1 COCNc1ccc(cc1)Cl 2230a_100000210052_100000766300 [1,2,0,0,0,0|1,0,0]=4 9497 B11R1.1 COCOc1ccc(cc1)O 271570a_203496583355_100012265687 [1,2,0,0,0,0|1,0,0]=4 9498 B11R1.1 COCSc1ccc(cc1)Br 62a_100000752885_100000766300 [1,2,0,0,0,0|1,0,0]=4 9499 B11R1.1 COCSc1ccc(cc1)Br 62a_100000766300_100000752885 [1,2,0,0,0,0|1,0,0]=4 9500 B11R1.1 COCSc1ccc(cc1)C 62a_100000186775_100000766300 [1,2,0,0,0,0|1,0,0]=4 9501 B11R1.1 COCSc1ccc(cc1)C 62a_100000766300_100000186775 [1,2,0,0,0,0|1,0,0]=4 9502 B11R1.1 COCSc1ccc(cc1)Cl 62a_100000755918_100000766300 [1,2,0,0,0,0|1,0,0]=4 9503 B11R1.1 COCSc1ccc(cc1)Cl 62a_100000766300_100000755918 [1,2,0,0,0,0|1,0,0]=4 9504 B11R1.1 COCSc1ccc(cc1)F 62a_100000211213_100000766300 [1,2,0,0,0,0|1,0,0]=4 9505 B11R1.1 COCSc1ccc(cc1)F 62a_100000766300_100000211213 [1,2,0,0,0,0|1,0,0]=4 9506 B11R1.1 COCSc1ccc(cc1)N 62a_100000185761_100000766300 [1,2,0,0,0,0|1,0,0]=4 9507 B11R1.1 COCSc1ccc(cc1)N 62a_100000766300_100000185761 [1,2,0,0,0,0|1,0,0]=4 9508 B11R1.1 COCSc1ccc(cc1)O 62a_100000766300_100000185759 [1,2,0,0,0,0|1,0,0]=4 9509 B11R1.1 CSCCc1ccc(cc1)Br 62a_100011740612_200000210301 [1,2,0,0,0,0|0,0,1]=4 9510 B11R1.1 CSCCc1ccc(cc1)Br 62a_200000210301_100011740612 [1,2,0,0,0,0|0,0,1]=4 9511 B11R1.1 CSCCc1ccc(cc1)C 62a_100011713686_200000210301 [1,2,0,0,0,0|0,0,1]=4 9512 B11R1.1 CSCCc1ccc(cc1)C 62a_200000210301_100011713686 [1,2,0,0,0,0|0,0,1]=4 9513 B11R1.1 CSCCc1ccc(cc1)Cl 62a_100011713675_200000210301 [1,2,0,0,0,0|0,0,1]=4 9514 B11R1.1 CSCCc1ccc(cc1)Cl 62a_200000210301_100011713675 [1,2,0,0,0,0|0,0,1]=4 9515 B11R1.1 CSCCc1ccc(cc1)F 62a_100011217392_200000210301 [1,2,0,0,0,0|0,0,1]=4 9516 B11R1.1 CSCCc1ccc(cc1)F 62a_200000210301_100011217392 [1,2,0,0,0,0|0,0,1]=4 9517 B11R1.1 CSCCc1ccc(cc1)O 62a_100009816426_200000210301 [1,2,0,0,0,0|0,0,1]=4 9518 B11R1.1 CSCCc1ccc(cc1)O 62a_200000210301_100009816426 [1,2,0,0,0,0|0,0,1]=4 9519 B11R1.1 CSCNc1ccc(cc1)Br 2230a_100000210018_100011218213 [1,2,0,0,0,0|1,0,0]=4 9520 B11R1.1 CSCNc1ccc(cc1)Br 34a_100000210018_100011218213 [1,2,0,0,0,0|1,0,0]=4 9521 B11R1.1 CSCNc1ccc(cc1)C 34a_100000124888_100011218213 [1,2,0,0,0,0|1,0,0]=4 9522 B11R1.1 CSCNc1ccc(cc1)Cl 2230a_100000210052_100011218213 [1,2,0,0,0,0|1,0,0]=4 9523 B11R1.1 CSCNc1ccc(cc1)Cl 34a_100000210052_100011218213 [1,2,0,0,0,0|1,0,0]=4 9524 B11R1.1 CSCNc1ccc(cc1)F 34a_100000185862_100011218213 [1,2,0,0,0,0|1,0,0]=4 9525 B11R1.1 CSCNc1ccc(cc1)I 34a_100000185761_100011218213 [1,2,0,0,0,0|1,0,0]=4 9526 B11R1.1 CSCNc1ccc(cc1)O 34a_100000185829_100011218213 [1,2,0,0,0,0|1,0,0]=4 9527 B11R1.1 CSCOc1ccc(cc1)Br 34a_100000185759_100011218213 [1,2,0,0,0,0|1,0,0]=4 9528 B11R1.1 CSCOc1ccc(cc1)C 34a_100000210336_100011218213 [1,2,0,0,0,0|1,0,0]=4 9529 B11R1.1 CSCOc1ccc(cc1)Cl 34a_100000210216_100011218213 [1,2,0,0,0,0|1,0,0]=4 9530 B11R1.1 CSCOc1ccc(cc1)F 34a_100000210339_100011218213 [1,2,0,0,0,0|1,0,0]=4 9531 B11R1.1 CSCOc1ccc(cc1)I 34a_100000212066_100011218213 [1,2,0,0,0,0|1,0,0]=4 9532 B11R1.1 CSCOc1ccc(cc1)N 34a_100000185829_100011218213 [1,2,0,0,0,0|1,0,0]=4 9533 B11R1.1 CSCSc1ccc(cc1)Br 62a_100000752885_100011218213 [1,2,0,0,0,0|1,0,0]=4 9534 B11R1.1 CSCSc1ccc(cc1)Br 62a_100011218213_100000752885 [1,2,0,0,0,0|1,0,0]=4 9535 B11R1.1 CSCSc1ccc(cc1)C 62a_100000186775_100011218213 [1,2,0,0,0,0|1,0,0]=4 9536 B11R1.1 CSCSc1ccc(cc1)C 62a_100011218213_100000186775 [1,2,0,0,0,0|1,0,0]=4 9537 B11R1.1 CSCSc1ccc(cc1)Cl 62a_100000755918_100011218213 [1,2,0,0,0,0|1,0,0]=4 9538 B11R1.1 CSCSc1ccc(cc1)Cl 62a_100011218213_100000755918 [1,2,0,0,0,0|1,0,0]=4 9539 B11R1.1 CSCSc1ccc(cc1)F 62a_100000211213_100011218213 [1,2,0,0,0,0|1,0,0]=4 9540 B11R1.1 CSCSc1ccc(cc1)F 62a_100011218213_100000211213 [1,2,0,0,0,0|1,0,0]=4 9541 B11R1.1 CSCSc1ccc(cc1)N 62a_100000185761_100011218213 [1,2,0,0,0,0|1,0,0]=4 9542 B11R1.1 CSCSc1ccc(cc1)N 62a_100011218213_100000185761 [1,2,0,0,0,0|1,0,0]=4 9543 B11R1.1 CSCSc1ccc(cc1)O 62a_100011218213_100000185759 [1,2,0,0,0,0|1,0,0]=4 9544 B11R1.1 Cc1ccc(cc1)CCN[13CH3] 2230a_100000705350_200025704644 [1,2,0,0,0,0|0,0,1]=4 9545 B11R1.1 Cc1ccc(cc1)CCN[13CH3] 34a_100000705350_200025704644 [1,2,0,0,0,0|0,0,1]=4 9546 B11R1.1 Cc1ccc(cc1)CCO[13CH3] 34a_100000756670_200025704644 [1,2,0,0,0,0|0,0,1]=4 9547 B11R1.1 Cc1ccc(cc1)CCO[13CH3] 7a_100000756670_200025704644 [1,2,0,0,0,0|0,0,1]=4 9548 B11R1.1 Cc1ccc(cc1)CCS[13CH3] 62a_100011713686_200025704644 [1,2,0,0,0,0|0,0,1]=4 9549 B11R1.1 Cc1ccc(cc1)CCS[13CH3] 62a_200025704644_100011713686 [1,2,0,0,0,0|0,0,1]=4 9550 B11R1.1 Cc1ccc(cc1)CNCF 34a_100000174908_100015361967 [1,2,0,0,0,0|1,0,0]=4 9551 B11R1.1 Cc1ccc(cc1)COCF 34a_100011215236_100015361967 [1,2,0,0,0,0|1,0,0]=4 9552 B11R1.1 Cc1ccc(cc1)COCF 7a_100011215236_100015361967 [1,2,0,0,0,0|1,0,0]=4 9553 B11R1.1 Cc1ccc(cc1)CSCF 62a_100000210814_100015361967 [1,2,0,0,0,0|1,0,0]=4 9554 B11R1.1 Cc1ccc(cc1)CSCF 62a_100015361967_100000210814 [1,2,0,0,0,0|1,0,0]=4 9555 B11R1.1 Cc1ccc(cc1)NCC=O 34a_100000124888_200009817547 [1,2,0,0,0,0|1,0,0]=4 9556 B11R1.1 Cc1ccc(cc1)OCC=O 34a_100000210336_200009817547 [1,2,0,0,0,0|1,0,0]=4 9557 B11R1.1 Cc1ccc(cc1)OCC=O 7a_100000210336_200015260668 [1,2,0,0,0,0|1,0,0]=4 9558 B11R1.1 Cc1ccc(cc1)SCC=O 62a_100000186775_200015260668 [1,2,0,0,0,0|1,0,0]=4 9559 B11R1.1 Cc1ccc(cc1)SCC=O 62a_200015260668_100000186775 [1,2,0,0,0,0|1,0,0]=4 9560 B11R1.1 FCNCc1ccc(cc1)Br 34a_100000174875_100015361967 [1,2,0,0,0,0|1,0,0]=4 9561 B11R1.1 FCNCc1ccc(cc1)Cl 34a_100000174871_100015361967 [1,2,0,0,0,0|1,0,0]=4 9562 B11R1.1 FCNCc1ccc(cc1)F 34a_100000174882_100015361967 [1,2,0,0,0,0|1,0,0]=4 9563 B11R1.1 FCNCc1ccc(cc1)I 34a_100016989417_100015361967 [1,2,0,0,0,0|1,0,0]=4 9564 B11R1.1 FCOCc1ccc(cc1)Br 34a_100000695286_100015361967 [1,2,0,0,0,0|1,0,0]=4 9565 B11R1.1 FCOCc1ccc(cc1)Cl 34a_100000211118_100015361967 [1,2,0,0,0,0|1,0,0]=4 9566 B11R1.1 FCOCc1ccc(cc1)Cl 7a_100000211118_100015361967 [1,2,0,0,0,0|1,0,0]=4 9567 B11R1.1 FCOCc1ccc(cc1)F 34a_100000210977_100015361967 [1,2,0,0,0,0|1,0,0]=4 9568 B11R1.1 FCOCc1ccc(cc1)F 7a_100000210977_100015361967 [1,2,0,0,0,0|1,0,0]=4 9569 B11R1.1 FCOCc1ccc(cc1)I 34a_100000690907_100015361967 [1,2,0,0,0,0|1,0,0]=4 9570 B11R1.1 FCOCc1ccc(cc1)I 7a_100000690907_100015361967 [1,2,0,0,0,0|1,0,0]=4 9571 B11R1.1 FCSCc1ccc(cc1)Br 62a_100000189115_100015361967 [1,2,0,0,0,0|1,0,0]=4 9572 B11R1.1 FCSCc1ccc(cc1)Br 62a_100015361967_100000189115 [1,2,0,0,0,0|1,0,0]=4 9573 B11R1.1 FCSCc1ccc(cc1)Cl 62a_100000187161_100015361967 [1,2,0,0,0,0|1,0,0]=4 9574 B11R1.1 FCSCc1ccc(cc1)Cl 62a_100015361967_100000187161 [1,2,0,0,0,0|1,0,0]=4 9575 B11R1.1 FCSCc1ccc(cc1)F 62a_100000198546_100015361967 [1,2,0,0,0,0|1,0,0]=4 9576 B11R1.1 FCSCc1ccc(cc1)F 62a_100015361967_100000187164 [1,2,0,0,0,0|1,0,0]=4 9577 B11R1.1 FCSCc1ccc(cc1)I 62a_100000189116_100015361967 [1,2,0,0,0,0|1,0,0]=4 9578 B11R1.1 FCSCc1ccc(cc1)I 62a_100015361967_100000189116 [1,2,0,0,0,0|1,0,0]=4 9579 B11R1.1 NCCCc1ccc(cc1)O 271570a_203496583355_100011297623 [1,2,0,0,0,0|0,0,1]=4 9580 B11R1.1 Nc1ccc(cc1)COCF 34a_100011215238_100015361967 [1,2,0,0,0,0|1,0,0]=4 9581 B11R1.1 Nc1ccc(cc1)OCC=O 34a_100000185829_200009817547 [1,2,0,0,0,0|1,0,0]=4 9582 B11R1.1 Nc1ccc(cc1)SCC=O 62a_100000185761_200015260668 [1,2,0,0,0,0|1,0,0]=4 9583 B11R1.1 Nc1ccc(cc1)SCC=O 62a_200015260668_100000185761 [1,2,0,0,0,0|1,0,0]=4 9584 B11R1.1 O=CCCc1ccc(cc1)O 271570a_203496583355_100011361538 [1,2,0,0,0,0|0,0,1]=4 9585 B11R1.1 O=CCNc1ccc(cc1)Br 2230a_100000210018_200015260668 [1,2,0,0,0,0|1,0,0]=4 9586 B11R1.1 O=CCNc1ccc(cc1)Br 34a_100000210018_200009817547 [1,2,0,0,0,0|1,0,0]=4 9587 B11R1.1 O=CCNc1ccc(cc1)Cl 2230a_100000210052_200015260668 [1,2,0,0,0,0|1,0,0]=4 9588 B11R1.1 O=CCNc1ccc(cc1)Cl 34a_100000210052_200009817547 [1,2,0,0,0,0|1,0,0]=4 9589 B11R1.1 O=CCNc1ccc(cc1)F 34a_100000185862_200009817547 [1,2,0,0,0,0|1,0,0]=4 9590 B11R1.1 O=CCNc1ccc(cc1)I 34a_100000185761_200009817547 [1,2,0,0,0,0|1,0,0]=4 9591 B11R1.1 O=CCNc1ccc(cc1)O 34a_100000185829_200009817547 [1,2,0,0,0,0|1,0,0]=4 9592 B11R1.1 O=CCOc1ccc(cc1)Br 34a_100000185759_200009817547 [1,2,0,0,0,0|1,0,0]=4 9593 B11R1.1 O=CCOc1ccc(cc1)Br 7a_100000185759_200015260668 [1,2,0,0,0,0|1,0,0]=4 9594 B11R1.1 O=CCOc1ccc(cc1)Cl 34a_100000210216_200009817547 [1,2,0,0,0,0|1,0,0]=4 9595 B11R1.1 O=CCOc1ccc(cc1)Cl 7a_100000210216_200015260668 [1,2,0,0,0,0|1,0,0]=4 9596 B11R1.1 O=CCOc1ccc(cc1)F 34a_100000210339_200009817547 [1,2,0,0,0,0|1,0,0]=4 9597 B11R1.1 O=CCOc1ccc(cc1)I 34a_100000212066_200009817547 [1,2,0,0,0,0|1,0,0]=4 9598 B11R1.1 O=CCOc1ccc(cc1)I 7a_100000212066_200015260668 [1,2,0,0,0,0|1,0,0]=4 9599 B11R1.1 O=CCSc1ccc(cc1)Br 62a_100000752885_200015260668 [1,2,0,0,0,0|1,0,0]=4 9600 B11R1.1 O=CCSc1ccc(cc1)Br 62a_200015260668_100000752885 [1,2,0,0,0,0|1,0,0]=4 9601 B11R1.1 O=CCSc1ccc(cc1)Cl 62a_100000755918_200015260668 [1,2,0,0,0,0|1,0,0]=4 9602 B11R1.1 O=CCSc1ccc(cc1)Cl 62a_200015260668_100000755918 [1,2,0,0,0,0|1,0,0]=4 9603 B11R1.1 O=CCSc1ccc(cc1)F 62a_100000211213_200015260668 [1,2,0,0,0,0|1,0,0]=4 9604 B11R1.1 O=CCSc1ccc(cc1)F 62a_200015260668_100000211213 [1,2,0,0,0,0|1,0,0]=4 9605 B11R1.1 O=CCSc1ccc(cc1)O 62a_200015260668_100000185759 [1,2,0,0,0,0|1,0,0]=4 9606 B11R1.1 OCCCc1ccc(cc1)O 271570a_203496583355_100011709247 [1,2,0,0,0,0|0,0,1]=4 9607 B11R1.1 Oc1ccc(cc1)CNCF 34a_100000185549_100015361967 [1,2,0,0,0,0|1,0,0]=4 9608 B11R1.1 [13CH3]NCCc1ccc(cc1)Br 2230a_100000755846_200025704644 [1,2,0,0,0,0|0,0,1]=4 9609 B11R1.1 [13CH3]NCCc1ccc(cc1)Br 34a_100000755846_200025704644 [1,2,0,0,0,0|0,0,1]=4 9610 B11R1.1 [13CH3]NCCc1ccc(cc1)Cl 2230a_100000185265_200025704644 [1,2,0,0,0,0|0,0,1]=4 9611 B11R1.1 [13CH3]NCCc1ccc(cc1)Cl 34a_100000185265_200025704644 [1,2,0,0,0,0|0,0,1]=4 9612 B11R1.1 [13CH3]NCCc1ccc(cc1)F 2230a_100000199005_200025704644 [1,2,0,0,0,0|0,0,1]=4 9613 B11R1.1 [13CH3]NCCc1ccc(cc1)F 34a_100000199005_200025704644 [1,2,0,0,0,0|0,0,1]=4 9614 B11R1.1 [13CH3]NCCc1ccc(cc1)O 34a_100000743037_200025704644 [1,2,0,0,0,0|0,0,1]=4 9615 B11R1.1 [13CH3]OCCc1ccc(cc1)Br 34a_100000766406_200025704644 [1,2,0,0,0,0|0,0,1]=4 9616 B11R1.1 [13CH3]OCCc1ccc(cc1)Br 7a_100000766406_200025704644 [1,2,0,0,0,0|0,0,1]=4 9617 B11R1.1 [13CH3]OCCc1ccc(cc1)Cl 34a_100011219627_200025704644 [1,2,0,0,0,0|0,0,1]=4 9618 B11R1.1 [13CH3]OCCc1ccc(cc1)Cl 7a_100011219627_200025704644 [1,2,0,0,0,0|0,0,1]=4 9619 B11R1.1 [13CH3]OCCc1ccc(cc1)F 34a_100000754732_200025704644 [1,2,0,0,0,0|0,0,1]=4 9620 B11R1.1 [13CH3]OCCc1ccc(cc1)F 7a_100000754732_200025704644 [1,2,0,0,0,0|0,0,1]=4 9621 B11R1.1 [13CH3]OCCc1ccc(cc1)I 34a_100012291149_200025704644 [1,2,0,0,0,0|0,0,1]=4 9622 B11R1.1 [13CH3]OCCc1ccc(cc1)I 7a_100012291149_200025704644 [1,2,0,0,0,0|0,0,1]=4 9623 B11R1.1 [13CH3]OCCc1ccc(cc1)N 34a_100011204434_200025704644 [1,2,0,0,0,0|0,0,1]=4 9624 B11R1.1 [13CH3]SCCc1ccc(cc1)Br 62a_100011740612_200025704644 [1,2,0,0,0,0|0,0,1]=4 9625 B11R1.1 [13CH3]SCCc1ccc(cc1)Br 62a_200025704644_100011740612 [1,2,0,0,0,0|0,0,1]=4 9626 B11R1.1 [13CH3]SCCc1ccc(cc1)Cl 62a_100011713675_200025704644 [1,2,0,0,0,0|0,0,1]=4 9627 B11R1.1 [13CH3]SCCc1ccc(cc1)Cl 62a_200025704644_100011713675 [1,2,0,0,0,0|0,0,1]=4 9628 B11R1.1 [13CH3]SCCc1ccc(cc1)F 62a_100011217392_200025704644 [1,2,0,0,0,0|0,0,1]=4 9629 B11R1.1 [13CH3]SCCc1ccc(cc1)F 62a_200025704644_100011217392 [1,2,0,0,0,0|0,0,1]=4 9630 B11R1.1 [13CH3]SCCc1ccc(cc1)O 62a_100009816426_200025704644 [1,2,0,0,0,0|0,0,1]=4 9631 B11R1.1 [13CH3]SCCc1ccc(cc1)O 62a_200025704644_100009816426 [1,2,0,0,0,0|0,0,1]=4 9632 B11R1.22 CC(O[13CH3])c1ccc(cc1)Br 34a_100000745893_200025704644 [1,2,0,0,0,0|1,0,0]=4 9633 B11R1.22 CC(O[13CH3])c1ccc(cc1)Br 7a_100000745893_200025704644 [1,2,0,0,0,0|1,0,0]=4 9634 B11R1.22 CC(O[13CH3])c1ccc(cc1)F 34a_100000181323_200025704644 [1,2,0,0,0,0|1,0,0]=4 9635 B11R1.22 CC(O[13CH3])c1ccc(cc1)F 7a_100000181323_200025704644 [1,2,0,0,0,0|1,0,0]=4 9636 B11R1.22 CC(O[13CH3])c1ccc(cc1)N 34a_100011216399_200025704644 [1,2,0,0,0,0|1,0,0]=4 9637 B11R1.22 CC(S[13CH3])c1ccc(cc1)Br 62a_100000755118_200025704644 [1,2,0,0,0,0|1,0,0]=4 9638 B11R1.22 CC(S[13CH3])c1ccc(cc1)Br 62a_200025704644_100000755118 [1,2,0,0,0,0|1,0,0]=4 9639 B11R1.22 CC(S[13CH3])c1ccc(cc1)Cl 62a_100000684792_200025704644 [1,2,0,0,0,0|1,0,0]=4 9640 B11R1.22 CC(S[13CH3])c1ccc(cc1)Cl 62a_200025704644_100000684792 [1,2,0,0,0,0|1,0,0]=4 9641 B11R1.22 CC(S[13CH3])c1ccc(cc1)F 62a_100000743420_200025704644 [1,2,0,0,0,0|1,0,0]=4 9642 B11R1.22 CC(S[13CH3])c1ccc(cc1)F 62a_200025704644_100000743420 [1,2,0,0,0,0|1,0,0]=4 9643 B11R1.22 CCC(C)c1ccc(cc1)O 271570a_203496583355_100011221364 [1,2,0,0,0,0|0,0,1]=4 9644 B11R1.22 CCC(O)c1ccc(cc1)O 271570a_203496583355_100000246506 [1,2,0,0,0,0|0,0,1]=4 9645 B11R1.22 CC[C@H](N)c1ccc(cc1)O 271570a_203496583355_100025736560 [1,2,0,0,0,0|0,0,1]=4 9646 B11R1.22 CNC(C)c1ccc(cc1)Br 2230a_106832991635_100000755118 [1,2,0,0,0,0|1,0,0]=4 9647 B11R1.22 CNC(C)c1ccc(cc1)Br 269862a_106832991636_100000185794 [1,2,0,0,0,0|1,0,0]=4 9648 B11R1.22 CNC(C)c1ccc(cc1)Br 34a_100102657272_100000755118 [1,2,0,0,0,0|1,0,0]=4 9649 B11R1.22 CNC(C)c1ccc(cc1)C 2230a_106832991635_100011261388 [1,2,0,0,0,0|1,0,0]=4 9650 B11R1.22 CNC(C)c1ccc(cc1)C 269862a_106832991636_100000185793 [1,2,0,0,0,0|1,0,0]=4 9651 B11R1.22 CNC(C)c1ccc(cc1)C 34a_100102657272_100011261388 [1,2,0,0,0,0|1,0,0]=4 9652 B11R1.22 CNC(C)c1ccc(cc1)C 7a_106832991635_100011261388 [1,2,0,0,0,0|1,0,0]=4 9653 B11R1.22 CNC(C)c1ccc(cc1)Cl 2230a_106832991635_100000684792 [1,2,0,0,0,0|1,0,0]=4 9654 B11R1.22 CNC(C)c1ccc(cc1)Cl 269862a_106832991636_100000185797 [1,2,0,0,0,0|1,0,0]=4 9655 B11R1.22 CNC(C)c1ccc(cc1)Cl 7a_106832991635_100000684792 [1,2,0,0,0,0|1,0,0]=4 9656 B11R1.22 CNC(C)c1ccc(cc1)F 2230a_106832991635_100000743420 [1,2,0,0,0,0|1,0,0]=4 9657 B11R1.22 CNC(C)c1ccc(cc1)F 269862a_106832991636_100000185800 [1,2,0,0,0,0|1,0,0]=4 9658 B11R1.22 CNC(C)c1ccc(cc1)F 34a_100102657272_100000743420 [1,2,0,0,0,0|1,0,0]=4 9659 B11R1.22 CNC(C)c1ccc(cc1)F 7a_106832991635_100000743420 [1,2,0,0,0,0|1,0,0]=4 9660 B11R1.22 CNC(C)c1ccc(cc1)I 269862a_106832991636_100000185465 [1,2,0,0,0,0|1,0,0]=4 9661 B11R1.22 CNC(C)c1ccc(cc1)O 271570a_203496583355_100000231103 [1,2,0,0,0,0|1,0,0]=4 9662 B11R1.22 CN[C@@H](C)c1ccc(cc1)F 2230a_100025705893_200000210301 [1,2,0,0,0,0|1,0,0]=4 9663 B11R1.22 CN[C@@H](C)c1ccc(cc1)F 34a_100025705893_200000210301 [1,2,0,0,0,0|1,0,0]=4 9664 B11R1.22 CN[C@@H](C)c1ccc(cc1)I 2230a_100000753911_200000210301 [1,2,0,0,0,0|1,0,0]=4 9665 B11R1.22 CN[C@@H](C)c1ccc(cc1)O 2230a_100161106496_200000210301 [1,2,0,0,0,0|1,0,0]=4 9666 B11R1.22 CN[C@H](C)c1ccc(cc1)Br 2230a_100000720352_200000210301 [1,2,0,0,0,0|1,0,0]=4 9667 B11R1.22 CN[C@H](C)c1ccc(cc1)C 2230a_100016988085_200000210301 [1,2,0,0,0,0|1,0,0]=4 9668 B11R1.22 CN[C@H](C)c1ccc(cc1)C 34a_100016988085_200000210301 [1,2,0,0,0,0|1,0,0]=4 9669 B11R1.22 CN[C@H](C)c1ccc(cc1)Cl 2230a_100015205461_200000210301 [1,2,0,0,0,0|1,0,0]=4 9670 B11R1.22 CN[C@H](C)c1ccc(cc1)Cl 34a_100015205461_200000210301 [1,2,0,0,0,0|1,0,0]=4 9671 B11R1.22 COC(C)c1ccc(cc1)Br 34a_100000745893_200000210301 [1,2,0,0,0,0|1,0,0]=4 9672 B11R1.22 COC(C)c1ccc(cc1)Br 34a_100138415774_100000755118 [1,2,0,0,0,0|1,0,0]=4 9673 B11R1.22 COC(C)c1ccc(cc1)Br 7a_100000745893_200000210301 [1,2,0,0,0,0|1,0,0]=4 9674 B11R1.22 COC(C)c1ccc(cc1)C 34a_100138415774_100011261388 [1,2,0,0,0,0|1,0,0]=4 9675 B11R1.22 COC(C)c1ccc(cc1)F 34a_100000181323_200000210301 [1,2,0,0,0,0|1,0,0]=4 9676 B11R1.22 COC(C)c1ccc(cc1)F 34a_100138415774_100000743420 [1,2,0,0,0,0|1,0,0]=4 9677 B11R1.22 COC(C)c1ccc(cc1)F 7a_100000181323_200000210301 [1,2,0,0,0,0|1,0,0]=4 9678 B11R1.22 COC(C)c1ccc(cc1)N 34a_100011216399_200000210301 [1,2,0,0,0,0|1,0,0]=4 9679 B11R1.22 COC(C)c1ccc(cc1)O 271570a_203496583355_100010254937 [1,2,0,0,0,0|1,0,0]=4 9680 B11R1.22 CO[C@@H](C)c1ccc(cc1)Cl 34a_100011852131_200000210301 [1,2,0,0,0,0|1,0,0]=4 9681 B11R1.22 CO[C@@H](C)c1ccc(cc1)Cl 7a_100011852131_200000210301 [1,2,0,0,0,0|1,0,0]=4 9682 B11R1.22 CO[C@H](C)c1ccc(cc1)C 34a_100000690690_200000210301 [1,2,0,0,0,0|1,0,0]=4 9683 B11R1.22 CO[C@H](C)c1ccc(cc1)C 7a_100000690690_200000210301 [1,2,0,0,0,0|1,0,0]=4 9684 B11R1.22 CSC(C)c1ccc(cc1)Br 62a_100000755118_200000210301 [1,2,0,0,0,0|1,0,0]=4 9685 B11R1.22 CSC(C)c1ccc(cc1)Br 62a_200000210301_100000755118 [1,2,0,0,0,0|1,0,0]=4 9686 B11R1.22 CSC(C)c1ccc(cc1)C 62a_100011261388_200000210301 [1,2,0,0,0,0|1,0,0]=4 9687 B11R1.22 CSC(C)c1ccc(cc1)C 62a_200000210301_100011261388 [1,2,0,0,0,0|1,0,0]=4 9688 B11R1.22 CSC(C)c1ccc(cc1)Cl 62a_100000684792_200000210301 [1,2,0,0,0,0|1,0,0]=4 9689 B11R1.22 CSC(C)c1ccc(cc1)Cl 62a_200000210301_100000684792 [1,2,0,0,0,0|1,0,0]=4 9690 B11R1.22 CSC(C)c1ccc(cc1)F 62a_100000743420_200000210301 [1,2,0,0,0,0|1,0,0]=4 9691 B11R1.22 CSC(C)c1ccc(cc1)F 62a_200000210301_100000743420 [1,2,0,0,0,0|1,0,0]=4 9692 B11R1.22 C[C@@H](N[13CH3])c1ccc(cc1)Br 2230a_100000720352_200025704644 [1,2,0,0,0,0|1,0,0]=4 9693 B11R1.22 C[C@@H](N[13CH3])c1ccc(cc1)Cl 2230a_100015205461_200025704644 [1,2,0,0,0,0|1,0,0]=4 9694 B11R1.22 C[C@@H](N[13CH3])c1ccc(cc1)Cl 34a_100015205461_200025704644 [1,2,0,0,0,0|1,0,0]=4 9695 B11R1.22 C[C@H](N[13CH3])c1ccc(cc1)F 2230a_100025705893_200025704644 [1,2,0,0,0,0|1,0,0]=4 9696 B11R1.22 C[C@H](N[13CH3])c1ccc(cc1)F 34a_100025705893_200025704644 [1,2,0,0,0,0|1,0,0]=4 9697 B11R1.22 C[C@H](N[13CH3])c1ccc(cc1)I 2230a_100000753911_200025704644 [1,2,0,0,0,0|1,0,0]=4 9698 B11R1.22 C[C@H](N[13CH3])c1ccc(cc1)O 2230a_100161106496_200025704644 [1,2,0,0,0,0|1,0,0]=4 9699 B11R1.22 C[C@H](O[13CH3])c1ccc(cc1)Cl 34a_100011852131_200025704644 [1,2,0,0,0,0|1,0,0]=4 9700 B11R1.22 C[C@H](O[13CH3])c1ccc(cc1)Cl 7a_100011852131_200025704644 [1,2,0,0,0,0|1,0,0]=4 9701 B11R1.22 Cc1ccc(cc1)C(C)S[13CH3] 62a_100011261388_200025704644 [1,2,0,0,0,0|1,0,0]=4 9702 B11R1.22 Cc1ccc(cc1)C(C)S[13CH3] 62a_200025704644_100011261388 [1,2,0,0,0,0|1,0,0]=4 9703 B11R1.22 Cc1ccc(cc1)[C@@H](C)N[13CH3] 2230a_100016988085_200025704644 [1,2,0,0,0,0|1,0,0]=4 9704 B11R1.22 Cc1ccc(cc1)[C@@H](C)N[13CH3] 34a_100016988085_200025704644 [1,2,0,0,0,0|1,0,0]=4 9705 B11R1.22 Cc1ccc(cc1)[C@@H](C)O[13CH3] 34a_100000690690_200025704644 [1,2,0,0,0,0|1,0,0]=4 9706 B11R1.22 Cc1ccc(cc1)[C@@H](C)O[13CH3] 7a_100000690690_200025704644 [1,2,0,0,0,0|1,0,0]=4 9707 B11R1.22 [2H]C(OC)c1ccc(cc1)F 34a_217856618577_200000210301 [1,2,0,0,0,0|1,0,0]=4 9708 B11R1.22 [2H]C(OC)c1ccc(cc1)F 7a_217856618577_200000210301 [1,2,0,0,0,0|1,0,0]=4 9709 B11R1.22 [2H]C(O[13CH3])c1ccc(cc1)F 34a_217856618577_200025704644 [1,2,0,0,0,0|1,0,0]=4 9710 B11R1.22 [2H]C(O[13CH3])c1ccc(cc1)F 7a_217856618577_200025704644 [1,2,0,0,0,0|1,0,0]=4 9711 B11R1.81 CC=Cc1ccc(cc1Br)Br 271570a_100016259895_100011484698 [1,2,0,0,0,0|0,0,1]=4 9712 B11R1.81 CC=Cc1ccc(cc1Br)C 271570a_100016259895_100009813563 [1,2,0,0,0,0|0,0,1]=4 9713 B11R1.81 CC=Cc1ccc(cc1Br)Cl 271570a_100016259895_100011219703 [1,2,0,0,0,0|0,0,1]=4 9714 B11R1.81 CC=Cc1ccc(cc1Br)F 271570a_100016259895_100011217111 [1,2,0,0,0,0|0,0,1]=4 9715 B11R1.81 CC=Cc1ccc(cc1Br)N 271570a_100016259895_100000750458 [1,2,0,0,0,0|0,0,1]=4 9716 B11R1.81 CC=Cc1ccc(cc1Br)O 271570a_100016259895_100000701344 [1,2,0,0,0,0|0,0,1]=4 9717 B11R1.81 CC=Cc1ccc(cc1C)Br 271570a_100016259895_100000701812 [1,2,0,0,0,0|0,0,1]=4 9718 B11R1.81 CC=Cc1ccc(cc1C)C 271570a_100016259895_100011217332 [1,2,0,0,0,0|0,0,1]=4 9719 B11R1.81 CC=Cc1ccc(cc1C)Cl 271570a_100016259895_100011219607 [1,2,0,0,0,0|0,0,1]=4 9720 B11R1.81 CC=Cc1ccc(cc1C)F 271570a_100016259895_100011205405 [1,2,0,0,0,0|0,0,1]=4 9721 B11R1.81 CC=Cc1ccc(cc1C)N 271570a_100016259895_100000210723 [1,2,0,0,0,0|0,0,1]=4 9722 B11R1.81 CC=Cc1ccc(cc1C)O 271570a_100016259895_100000729255 [1,2,0,0,0,0|0,0,1]=4 9723 B11R1.81 CC=Cc1ccc(cc1Cl)Br 271570a_100016259895_100011216062 [1,2,0,0,0,0|0,0,1]=4 9724 B11R1.81 CC=Cc1ccc(cc1Cl)C 271570a_100016259895_100011263221 [1,2,0,0,0,0|0,0,1]=4 9725 B11R1.81 CC=Cc1ccc(cc1Cl)Cl 271570a_100016259895_100000699841 [1,2,0,0,0,0|0,0,1]=4 9726 B11R1.81 CC=Cc1ccc(cc1Cl)F 271570a_100016259895_100000733362 [1,2,0,0,0,0|0,0,1]=4 9727 B11R1.81 CC=Cc1ccc(cc1Cl)N 271570a_100016259895_100000761885 [1,2,0,0,0,0|0,0,1]=4 9728 B11R1.81 CC=Cc1ccc(cc1Cl)O 271570a_100016259895_100000047559 [1,2,0,0,0,0|0,0,1]=4 9729 B11R1.81 CC=Cc1ccc(cc1F)Br 271570a_100016259895_100009814013 [1,2,0,0,0,0|0,0,1]=4 9730 B11R1.81 CC=Cc1ccc(cc1F)C 271570a_100016259895_100011216119 [1,2,0,0,0,0|0,0,1]=4 9731 B11R1.81 CC=Cc1ccc(cc1F)Cl 271570a_100016259895_100011216042 [1,2,0,0,0,0|0,0,1]=4 9732 B11R1.81 CC=Cc1ccc(cc1F)F 271570a_100016259895_100000750030 [1,2,0,0,0,0|0,0,1]=4 9733 B11R1.81 CC=Cc1ccc(cc1F)N 271570a_100016259895_100011356925 [1,2,0,0,0,0|0,0,1]=4 9734 B11R1.81 CC=Cc1ccc(cc1F)O 271570a_100016259895_100000755031 [1,2,0,0,0,0|0,0,1]=4 9735 B11R1.81 CC=Cc1ccc(cc1N)Br 271570a_100016259895_100000743836 [1,2,0,0,0,0|0,0,1]=4 9736 B11R1.81 CC=Cc1ccc(cc1N)C 271570a_100016259895_100011216686 [1,2,0,0,0,0|0,0,1]=4 9737 B11R1.81 CC=Cc1ccc(cc1N)Cl 271570a_100016259895_100000761886 [1,2,0,0,0,0|0,0,1]=4 9738 B11R1.81 CC=Cc1ccc(cc1N)F 271570a_100016259895_100011218093 [1,2,0,0,0,0|0,0,1]=4 9739 B11R1.81 CC=Cc1ccc(cc1N)N 271570a_100016259895_200012175722 [1,2,0,0,0,0|0,0,1]=4 9740 B11R1.81 CC=Cc1ccc(cc1N)O 271570a_100016259895_100011999798 [1,2,0,0,0,0|0,0,1]=4 9741 B11R1.81 CC=Cc1ccc(cc1O)Br 271570a_100016259895_100012344904 [1,2,0,0,0,0|0,0,1]=4 9742 B11R1.81 CC=Cc1ccc(cc1O)C 271570a_100016259895_100012002257 [1,2,0,0,0,0|0,0,1]=4 9743 B11R1.81 CC=Cc1ccc(cc1O)Cl 271570a_100016259895_100000050036 [1,2,0,0,0,0|0,0,1]=4 9744 B11R1.81 CC=Cc1ccc(cc1O)F 271570a_100016259895_100000690578 [1,2,0,0,0,0|0,0,1]=4 9745 B11R1.81 CC=Cc1ccc(cc1O)O 271570a_100016259895_100009813921 [1,2,0,0,0,0|0,0,1]=4 9746 B11R1.81 CNCc1ccc(cc1Br)Br 207a_100102657272_100012351556 [1,2,0,0,0,0|1,0,0]=4 9747 B11R1.81 CNCc1ccc(cc1Br)Br 2230a_106832991635_200012351560 [1,2,0,0,0,0|1,0,0]=4 9748 B11R1.81 CNCc1ccc(cc1Br)Br 26a_100102657272_100000188717 [1,2,0,0,0,0|1,0,0]=4 9749 B11R1.81 CNCc1ccc(cc1Br)Br 270004a_106832991635_100012351556 [1,2,0,0,0,0|1,0,0]=4 9750 B11R1.81 CNCc1ccc(cc1Br)Br 34a_100102657272_200012351560 [1,2,0,0,0,0|1,0,0]=4 9751 B11R1.81 CNCc1ccc(cc1Br)Br 7a_106832991635_200012351560 [1,2,0,0,0,0|1,0,0]=4 9752 B11R1.81 CNCc1ccc(cc1Br)C 207a_100102657272_100000692596 [1,2,0,0,0,0|1,0,0]=4 9753 B11R1.81 CNCc1ccc(cc1Br)C 26a_100102657272_100000210800 [1,2,0,0,0,0|1,0,0]=4 9754 B11R1.81 CNCc1ccc(cc1Br)C 270004a_106832991635_100000692596 [1,2,0,0,0,0|1,0,0]=4 9755 B11R1.81 CNCc1ccc(cc1Br)Cl 207a_100102657272_100000687667 [1,2,0,0,0,0|1,0,0]=4 9756 B11R1.81 CNCc1ccc(cc1Br)Cl 2230a_106832991635_100000755608 [1,2,0,0,0,0|1,0,0]=4 9757 B11R1.81 CNCc1ccc(cc1Br)Cl 26a_100102657272_100000211998 [1,2,0,0,0,0|1,0,0]=4 9758 B11R1.81 CNCc1ccc(cc1Br)Cl 270004a_106832991635_100000687667 [1,2,0,0,0,0|1,0,0]=4 9759 B11R1.81 CNCc1ccc(cc1Br)Cl 34a_100102657272_100000755608 [1,2,0,0,0,0|1,0,0]=4 9760 B11R1.81 CNCc1ccc(cc1Br)Cl 34a_100102692131_200000210301 [1,2,0,0,0,0|1,0,0]=4 9761 B11R1.81 CNCc1ccc(cc1Br)Cl 7a_106832991635_100000755608 [1,2,0,0,0,0|1,0,0]=4 9762 B11R1.81 CNCc1ccc(cc1Br)F 207a_100102657272_100000685661 [1,2,0,0,0,0|1,0,0]=4 9763 B11R1.81 CNCc1ccc(cc1Br)F 2230a_106832991635_100000243222 [1,2,0,0,0,0|1,0,0]=4 9764 B11R1.81 CNCc1ccc(cc1Br)F 26a_100102657272_100000211999 [1,2,0,0,0,0|1,0,0]=4 9765 B11R1.81 CNCc1ccc(cc1Br)F 270004a_106832991635_100000685661 [1,2,0,0,0,0|1,0,0]=4 9766 B11R1.81 CNCc1ccc(cc1Br)F 34a_100000708791_200000210301 [1,2,0,0,0,0|1,0,0]=4 9767 B11R1.81 CNCc1ccc(cc1Br)F 34a_100102657272_100000243222 [1,2,0,0,0,0|1,0,0]=4 9768 B11R1.81 CNCc1ccc(cc1Br)F 7a_106832991635_100000243222 [1,2,0,0,0,0|1,0,0]=4 9769 B11R1.81 CNCc1ccc(cc1Br)I 207a_100102657272_100010185650 [1,2,0,0,0,0|1,0,0]=4 9770 B11R1.81 CNCc1ccc(cc1Br)I 2230a_106832991635_100010146610 [1,2,0,0,0,0|1,0,0]=4 9771 B11R1.81 CNCc1ccc(cc1Br)I 26a_100102657272_100012361655 [1,2,0,0,0,0|1,0,0]=4 9772 B11R1.81 CNCc1ccc(cc1Br)I 34a_100102657272_100010146610 [1,2,0,0,0,0|1,0,0]=4 9773 B11R1.81 CNCc1ccc(cc1Br)I 7a_106832991635_100010146610 [1,2,0,0,0,0|1,0,0]=4 9774 B11R1.81 CNCc1ccc(cc1C)Br 207a_100102657272_100000687586 [1,2,0,0,0,0|1,0,0]=4 9775 B11R1.81 CNCc1ccc(cc1C)Br 2230a_106832991635_100000708836 [1,2,0,0,0,0|1,0,0]=4 9776 B11R1.81 CNCc1ccc(cc1C)Br 26a_100102657272_100000186361 [1,2,0,0,0,0|1,0,0]=4 9777 B11R1.81 CNCc1ccc(cc1C)Br 270004a_106832991635_100000687586 [1,2,0,0,0,0|1,0,0]=4 9778 B11R1.81 CNCc1ccc(cc1C)Br 34a_100000753881_200000210301 [1,2,0,0,0,0|1,0,0]=4 9779 B11R1.81 CNCc1ccc(cc1C)Br 34a_100102657272_100000708836 [1,2,0,0,0,0|1,0,0]=4 9780 B11R1.81 CNCc1ccc(cc1C)Br 7a_106832991635_100000708836 [1,2,0,0,0,0|1,0,0]=4 9781 B11R1.81 CNCc1ccc(cc1C)C 207a_100102657272_100000211342 [1,2,0,0,0,0|1,0,0]=4 9782 B11R1.81 CNCc1ccc(cc1C)C 2230a_106832991635_100011219618 [1,2,0,0,0,0|1,0,0]=4 9783 B11R1.81 CNCc1ccc(cc1C)C 270004a_106832991635_100000211342 [1,2,0,0,0,0|1,0,0]=4 9784 B11R1.81 CNCc1ccc(cc1C)C 34a_100000737523_200000210301 [1,2,0,0,0,0|1,0,0]=4 9785 B11R1.81 CNCc1ccc(cc1C)C 34a_100102657272_100011219618 [1,2,0,0,0,0|1,0,0]=4 9786 B11R1.81 CNCc1ccc(cc1C)C 7a_106832991635_100011219618 [1,2,0,0,0,0|1,0,0]=4 9787 B11R1.81 CNCc1ccc(cc1C)Cl 207a_100102657272_100000766358 [1,2,0,0,0,0|1,0,0]=4 9788 B11R1.81 CNCc1ccc(cc1C)Cl 2230a_106832991635_100012361307 [1,2,0,0,0,0|1,0,0]=4 9789 B11R1.81 CNCc1ccc(cc1C)Cl 270004a_106832991635_100000766358 [1,2,0,0,0,0|1,0,0]=4 9790 B11R1.81 CNCc1ccc(cc1C)Cl 34a_100102657272_100012361307 [1,2,0,0,0,0|1,0,0]=4 9791 B11R1.81 CNCc1ccc(cc1C)Cl 34a_103436540063_200000210301 [1,2,0,0,0,0|1,0,0]=4 9792 B11R1.81 CNCc1ccc(cc1C)Cl 7a_106832991635_100012361307 [1,2,0,0,0,0|1,0,0]=4 9793 B11R1.81 CNCc1ccc(cc1C)F 207a_100102657272_100000745986 [1,2,0,0,0,0|1,0,0]=4 9794 B11R1.81 CNCc1ccc(cc1C)F 2230a_106832991635_100000700533 [1,2,0,0,0,0|1,0,0]=4 9795 B11R1.81 CNCc1ccc(cc1C)F 270004a_106832991635_100000745986 [1,2,0,0,0,0|1,0,0]=4 9796 B11R1.81 CNCc1ccc(cc1C)F 34a_100102657272_100000700533 [1,2,0,0,0,0|1,0,0]=4 9797 B11R1.81 CNCc1ccc(cc1C)F 34a_100137329023_200000210301 [1,2,0,0,0,0|1,0,0]=4 9798 B11R1.81 CNCc1ccc(cc1C)F 7a_106832991635_100000700533 [1,2,0,0,0,0|1,0,0]=4 9799 B11R1.81 CNCc1ccc(cc1Cl)Br 207a_100102657272_100000764164 [1,2,0,0,0,0|1,0,0]=4 9800 B11R1.81 CNCc1ccc(cc1Cl)Br 2230a_106832991635_100011740631 [1,2,0,0,0,0|1,0,0]=4 9801 B11R1.81 CNCc1ccc(cc1Cl)Br 26a_100102657272_100000186472 [1,2,0,0,0,0|1,0,0]=4 9802 B11R1.81 CNCc1ccc(cc1Cl)Br 270004a_106832991635_100000764164 [1,2,0,0,0,0|1,0,0]=4 9803 B11R1.81 CNCc1ccc(cc1Cl)Br 34a_100020628970_200000210301 [1,2,0,0,0,0|1,0,0]=4 9804 B11R1.81 CNCc1ccc(cc1Cl)Br 34a_100102657272_100011740631 [1,2,0,0,0,0|1,0,0]=4 9805 B11R1.81 CNCc1ccc(cc1Cl)Br 7a_106832991635_100011740631 [1,2,0,0,0,0|1,0,0]=4 9806 B11R1.81 CNCc1ccc(cc1Cl)C 207a_100102657272_100011935181 [1,2,0,0,0,0|1,0,0]=4 9807 B11R1.81 CNCc1ccc(cc1Cl)C 2230a_106832991635_100012349684 [1,2,0,0,0,0|1,0,0]=4 9808 B11R1.81 CNCc1ccc(cc1Cl)C 26a_100102657272_100000749699 [1,2,0,0,0,0|1,0,0]=4 9809 B11R1.81 CNCc1ccc(cc1Cl)C 270004a_106832991635_100011935181 [1,2,0,0,0,0|1,0,0]=4 9810 B11R1.81 CNCc1ccc(cc1Cl)C 34a_100011997539_200000210301 [1,2,0,0,0,0|1,0,0]=4 9811 B11R1.81 CNCc1ccc(cc1Cl)C 34a_100102657272_100012349684 [1,2,0,0,0,0|1,0,0]=4 9812 B11R1.81 CNCc1ccc(cc1Cl)C 7a_106832991635_100012349684 [1,2,0,0,0,0|1,0,0]=4 9813 B11R1.81 CNCc1ccc(cc1Cl)Cl 207a_100102657272_100000188887 [1,2,0,0,0,0|1,0,0]=4 9814 B11R1.81 CNCc1ccc(cc1Cl)Cl 2230a_106832991635_100000188473 [1,2,0,0,0,0|1,0,0]=4 9815 B11R1.81 CNCc1ccc(cc1Cl)Cl 26a_100102657272_100015191787 [1,2,0,0,0,0|1,0,0]=4 9816 B11R1.81 CNCc1ccc(cc1Cl)Cl 270004a_106832991635_100000188887 [1,2,0,0,0,0|1,0,0]=4 9817 B11R1.81 CNCc1ccc(cc1Cl)Cl 34a_100000174880_200000210301 [1,2,0,0,0,0|1,0,0]=4 9818 B11R1.81 CNCc1ccc(cc1Cl)Cl 34a_100102657272_100000188473 [1,2,0,0,0,0|1,0,0]=4 9819 B11R1.81 CNCc1ccc(cc1Cl)Cl 7a_106832991635_100000188473 [1,2,0,0,0,0|1,0,0]=4 9820 B11R1.81 CNCc1ccc(cc1Cl)F 207a_100102657272_100000752949 [1,2,0,0,0,0|1,0,0]=4 9821 B11R1.81 CNCc1ccc(cc1Cl)F 2230a_106832991635_100011216360 [1,2,0,0,0,0|1,0,0]=4 9822 B11R1.81 CNCc1ccc(cc1Cl)F 26a_100102657272_100000212004 [1,2,0,0,0,0|1,0,0]=4 9823 B11R1.81 CNCc1ccc(cc1Cl)F 270004a_106832991635_100000752949 [1,2,0,0,0,0|1,0,0]=4 9824 B11R1.81 CNCc1ccc(cc1Cl)F 34a_100000174946_200000210301 [1,2,0,0,0,0|1,0,0]=4 9825 B11R1.81 CNCc1ccc(cc1Cl)F 34a_100102657272_100011216360 [1,2,0,0,0,0|1,0,0]=4 9826 B11R1.81 CNCc1ccc(cc1Cl)F 7a_106832991635_100011216360 [1,2,0,0,0,0|1,0,0]=4 9827 B11R1.81 CNCc1ccc(cc1Cl)I 207a_100102657272_100000727542 [1,2,0,0,0,0|1,0,0]=4 9828 B11R1.81 CNCc1ccc(cc1Cl)O 34a_200161156549_200000210301 [1,2,0,0,0,0|1,0,0]=4 9829 B11R1.81 CNCc1ccc(cc1F)Br 207a_100102657272_100000211676 [1,2,0,0,0,0|1,0,0]=4 9830 B11R1.81 CNCc1ccc(cc1F)Br 2230a_106832991635_100000211606 [1,2,0,0,0,0|1,0,0]=4 9831 B11R1.81 CNCc1ccc(cc1F)Br 26a_100102657272_100000185481 [1,2,0,0,0,0|1,0,0]=4 9832 B11R1.81 CNCc1ccc(cc1F)Br 270004a_106832991635_100000211676 [1,2,0,0,0,0|1,0,0]=4 9833 B11R1.81 CNCc1ccc(cc1F)Br 34a_100000754580_200000210301 [1,2,0,0,0,0|1,0,0]=4 9834 B11R1.81 CNCc1ccc(cc1F)Br 34a_100102657272_100000211606 [1,2,0,0,0,0|1,0,0]=4 9835 B11R1.81 CNCc1ccc(cc1F)Br 7a_106832991635_100000211606 [1,2,0,0,0,0|1,0,0]=4 9836 B11R1.81 CNCc1ccc(cc1F)C 207a_100102657272_100011217368 [1,2,0,0,0,0|1,0,0]=4 9837 B11R1.81 CNCc1ccc(cc1F)C 2230a_106832991635_100011217900 [1,2,0,0,0,0|1,0,0]=4 9838 B11R1.81 CNCc1ccc(cc1F)C 270004a_106832991635_100011217368 [1,2,0,0,0,0|1,0,0]=4 9839 B11R1.81 CNCc1ccc(cc1F)C 34a_100102657272_100012002367 [1,2,0,0,0,0|1,0,0]=4 9840 B11R1.81 CNCc1ccc(cc1F)C 34a_100102887089_200000210301 [1,2,0,0,0,0|1,0,0]=4 9841 B11R1.81 CNCc1ccc(cc1F)C 7a_106832991635_100012002367 [1,2,0,0,0,0|1,0,0]=4 9842 B11R1.81 CNCc1ccc(cc1F)Cl 207a_100102657272_100000697372 [1,2,0,0,0,0|1,0,0]=4 9843 B11R1.81 CNCc1ccc(cc1F)Cl 2230a_106832991635_100000709361 [1,2,0,0,0,0|1,0,0]=4 9844 B11R1.81 CNCc1ccc(cc1F)Cl 270004a_106832991635_100000697372 [1,2,0,0,0,0|1,0,0]=4 9845 B11R1.81 CNCc1ccc(cc1F)Cl 34a_100000708496_200000210301 [1,2,0,0,0,0|1,0,0]=4 9846 B11R1.81 CNCc1ccc(cc1F)Cl 34a_100102657272_100000709361 [1,2,0,0,0,0|1,0,0]=4 9847 B11R1.81 CNCc1ccc(cc1F)Cl 7a_106832991635_100000709361 [1,2,0,0,0,0|1,0,0]=4 9848 B11R1.81 CNCc1ccc(cc1F)F 207a_100102657272_100000211964 [1,2,0,0,0,0|1,0,0]=4 9849 B11R1.81 CNCc1ccc(cc1F)F 2230a_106832991635_100000748237 [1,2,0,0,0,0|1,0,0]=4 9850 B11R1.81 CNCc1ccc(cc1F)F 270004a_106832991635_100000211964 [1,2,0,0,0,0|1,0,0]=4 9851 B11R1.81 CNCc1ccc(cc1F)F 34a_100000737868_200000210301 [1,2,0,0,0,0|1,0,0]=4 9852 B11R1.81 CNCc1ccc(cc1F)F 34a_100102657272_100000748237 [1,2,0,0,0,0|1,0,0]=4 9853 B11R1.81 CNCc1ccc(cc1F)F 7a_106832991635_100000748237 [1,2,0,0,0,0|1,0,0]=4 9854 B11R1.81 CNCc1ccc(cc1F)I 207a_100102657272_100000050965 [1,2,0,0,0,0|1,0,0]=4 9855 B11R1.81 CNCc1ccc(cc1F)I 2230a_106832991635_100010244991 [1,2,0,0,0,0|1,0,0]=4 9856 B11R1.81 CNCc1ccc(cc1F)I 34a_100102657272_100010244991 [1,2,0,0,0,0|1,0,0]=4 9857 B11R1.81 CNCc1ccc(cc1F)I 7a_106832991635_100010244991 [1,2,0,0,0,0|1,0,0]=4 9858 B11R1.81 CNCc1ccc(cc1I)Br 207a_100102657272_100010146562 [1,2,0,0,0,0|1,0,0]=4 9859 B11R1.81 CNCc1ccc(cc1I)Br 2230a_106832991635_100010146615 [1,2,0,0,0,0|1,0,0]=4 9860 B11R1.81 CNCc1ccc(cc1I)Br 26a_100102657272_100012355227 [1,2,0,0,0,0|1,0,0]=4 9861 B11R1.81 CNCc1ccc(cc1I)Br 270004a_106832991635_100010146562 [1,2,0,0,0,0|1,0,0]=4 9862 B11R1.81 CNCc1ccc(cc1I)Br 34a_100102657272_100010146615 [1,2,0,0,0,0|1,0,0]=4 9863 B11R1.81 CNCc1ccc(cc1I)Br 7a_106832991635_100010146615 [1,2,0,0,0,0|1,0,0]=4 9864 B11R1.81 CNCc1ccc(cc1I)C 207a_100102657272_100010150104 [1,2,0,0,0,0|1,0,0]=4 9865 B11R1.81 CNCc1ccc(cc1I)C 270004a_106832991635_100010150104 [1,2,0,0,0,0|1,0,0]=4 9866 B11R1.81 CNCc1ccc(cc1I)Cl 2230a_106832991635_100010254388 [1,2,0,0,0,0|1,0,0]=4 9867 B11R1.81 CNCc1ccc(cc1I)Cl 34a_100102657272_100010254388 [1,2,0,0,0,0|1,0,0]=4 9868 B11R1.81 CNCc1ccc(cc1I)Cl 7a_106832991635_100010254388 [1,2,0,0,0,0|1,0,0]=4 9869 B11R1.81 CNCc1ccc(cc1I)F 207a_100102657272_100010254405 [1,2,0,0,0,0|1,0,0]=4 9870 B11R1.81 CNCc1ccc(cc1I)F 2230a_106832991635_100012354799 [1,2,0,0,0,0|1,0,0]=4 9871 B11R1.81 CNCc1ccc(cc1I)F 34a_100102657272_100012354799 [1,2,0,0,0,0|1,0,0]=4 9872 B11R1.81 CNCc1ccc(cc1I)F 7a_106832991635_100012354799 [1,2,0,0,0,0|1,0,0]=4 9873 B11R1.81 CNCc1ccc(cc1O)F 271570a_203496583355_200011192132 [1,2,0,0,0,0|1,0,0]=4 9874 B11R1.81 COCc1ccc(cc1Br)Br 34a_100012357508_200000210301 [1,2,0,0,0,0|1,0,0]=4 9875 B11R1.81 COCc1ccc(cc1Br)Br 34a_100138415774_200012351560 [1,2,0,0,0,0|1,0,0]=4 9876 B11R1.81 COCc1ccc(cc1Br)Br 7a_100012357508_200000210301 [1,2,0,0,0,0|1,0,0]=4 9877 B11R1.81 COCc1ccc(cc1Br)Cl 34a_100000707881_200000210301 [1,2,0,0,0,0|1,0,0]=4 9878 B11R1.81 COCc1ccc(cc1Br)Cl 34a_100138415774_100000755608 [1,2,0,0,0,0|1,0,0]=4 9879 B11R1.81 COCc1ccc(cc1Br)Cl 7a_100000707881_200000210301 [1,2,0,0,0,0|1,0,0]=4 9880 B11R1.81 COCc1ccc(cc1Br)F 34a_100000744086_200000210301 [1,2,0,0,0,0|1,0,0]=4 9881 B11R1.81 COCc1ccc(cc1Br)F 34a_100138415774_100000243222 [1,2,0,0,0,0|1,0,0]=4 9882 B11R1.81 COCc1ccc(cc1Br)F 7a_100000744086_200000210301 [1,2,0,0,0,0|1,0,0]=4 9883 B11R1.81 COCc1ccc(cc1Br)I 34a_100138415774_100010146610 [1,2,0,0,0,0|1,0,0]=4 9884 B11R1.81 COCc1ccc(cc1Br)I 7a_100010240206_200000210301 [1,2,0,0,0,0|1,0,0]=4 9885 B11R1.81 COCc1ccc(cc1C)Br 34a_100000748258_200000210301 [1,2,0,0,0,0|1,0,0]=4 9886 B11R1.81 COCc1ccc(cc1C)Br 34a_100138415774_100000708836 [1,2,0,0,0,0|1,0,0]=4 9887 B11R1.81 COCc1ccc(cc1C)Br 7a_100000748258_200000210301 [1,2,0,0,0,0|1,0,0]=4 9888 B11R1.81 COCc1ccc(cc1C)C 34a_100011215341_200000210301 [1,2,0,0,0,0|1,0,0]=4 9889 B11R1.81 COCc1ccc(cc1C)C 34a_100138415774_100011219618 [1,2,0,0,0,0|1,0,0]=4 9890 B11R1.81 COCc1ccc(cc1C)C 7a_100011215341_200000210301 [1,2,0,0,0,0|1,0,0]=4 9891 B11R1.81 COCc1ccc(cc1C)Cl 34a_100000702939_200000210301 [1,2,0,0,0,0|1,0,0]=4 9892 B11R1.81 COCc1ccc(cc1C)Cl 34a_100138415774_100012361307 [1,2,0,0,0,0|1,0,0]=4 9893 B11R1.81 COCc1ccc(cc1C)Cl 7a_100000702939_200000210301 [1,2,0,0,0,0|1,0,0]=4 9894 B11R1.81 COCc1ccc(cc1C)F 34a_100000700136_200000210301 [1,2,0,0,0,0|1,0,0]=4 9895 B11R1.81 COCc1ccc(cc1C)F 34a_100138415774_100000700533 [1,2,0,0,0,0|1,0,0]=4 9896 B11R1.81 COCc1ccc(cc1C)F 7a_100000700136_200000210301 [1,2,0,0,0,0|1,0,0]=4 9897 B11R1.81 COCc1ccc(cc1C)N 34a_100000102464_200000210301 [1,2,0,0,0,0|1,0,0]=4 9898 B11R1.81 COCc1ccc(cc1C)N 7a_100000102464_200000210301 [1,2,0,0,0,0|1,0,0]=4 9899 B11R1.81 COCc1ccc(cc1Cl)Br 34a_100000756401_200000210301 [1,2,0,0,0,0|1,0,0]=4 9900 B11R1.81 COCc1ccc(cc1Cl)Br 34a_100138415774_100011740631 [1,2,0,0,0,0|1,0,0]=4 9901 B11R1.81 COCc1ccc(cc1Cl)Br 7a_100000756401_200000210301 [1,2,0,0,0,0|1,0,0]=4 9902 B11R1.81 COCc1ccc(cc1Cl)C 34a_100000720314_200000210301 [1,2,0,0,0,0|1,0,0]=4 9903 B11R1.81 COCc1ccc(cc1Cl)C 34a_100138415774_100012349684 [1,2,0,0,0,0|1,0,0]=4 9904 B11R1.81 COCc1ccc(cc1Cl)C 7a_100000720314_200000210301 [1,2,0,0,0,0|1,0,0]=4 9905 B11R1.81 COCc1ccc(cc1Cl)Cl 34a_100000215721_200000210301 [1,2,0,0,0,0|1,0,0]=4 9906 B11R1.81 COCc1ccc(cc1Cl)Cl 34a_100138415774_100000188473 [1,2,0,0,0,0|1,0,0]=4 9907 B11R1.81 COCc1ccc(cc1Cl)Cl 7a_100000215721_200000210301 [1,2,0,0,0,0|1,0,0]=4 9908 B11R1.81 COCc1ccc(cc1Cl)F 34a_100011219954_200000210301 [1,2,0,0,0,0|1,0,0]=4 9909 B11R1.81 COCc1ccc(cc1Cl)F 34a_100138415774_100011216360 [1,2,0,0,0,0|1,0,0]=4 9910 B11R1.81 COCc1ccc(cc1Cl)F 7a_100011219954_200000210301 [1,2,0,0,0,0|1,0,0]=4 9911 B11R1.81 COCc1ccc(cc1Cl)N 34a_100000689119_200000210301 [1,2,0,0,0,0|1,0,0]=4 9912 B11R1.81 COCc1ccc(cc1F)Br 34a_100011191541_200000210301 [1,2,0,0,0,0|1,0,0]=4 9913 B11R1.81 COCc1ccc(cc1F)Br 34a_100138415774_100000211606 [1,2,0,0,0,0|1,0,0]=4 9914 B11R1.81 COCc1ccc(cc1F)Br 7a_100011191541_200000210301 [1,2,0,0,0,0|1,0,0]=4 9915 B11R1.81 COCc1ccc(cc1F)C 34a_100011216587_200000210301 [1,2,0,0,0,0|1,0,0]=4 9916 B11R1.81 COCc1ccc(cc1F)C 34a_100138415774_100012002367 [1,2,0,0,0,0|1,0,0]=4 9917 B11R1.81 COCc1ccc(cc1F)C 7a_100011216587_200000210301 [1,2,0,0,0,0|1,0,0]=4 9918 B11R1.81 COCc1ccc(cc1F)Cl 34a_100011217562_200000210301 [1,2,0,0,0,0|1,0,0]=4 9919 B11R1.81 COCc1ccc(cc1F)Cl 34a_100138415774_100000709361 [1,2,0,0,0,0|1,0,0]=4 9920 B11R1.81 COCc1ccc(cc1F)Cl 7a_100011217562_200000210301 [1,2,0,0,0,0|1,0,0]=4 9921 B11R1.81 COCc1ccc(cc1F)F 34a_100011215441_200000210301 [1,2,0,0,0,0|1,0,0]=4 9922 B11R1.81 COCc1ccc(cc1F)F 34a_100138415774_100000748237 [1,2,0,0,0,0|1,0,0]=4 9923 B11R1.81 COCc1ccc(cc1F)F 7a_100011215441_200000210301 [1,2,0,0,0,0|1,0,0]=4 9924 B11R1.81 COCc1ccc(cc1F)I 34a_100138415774_100010244991 [1,2,0,0,0,0|1,0,0]=4 9925 B11R1.81 COCc1ccc(cc1F)I 34a_200010202041_200000210301 [1,2,0,0,0,0|1,0,0]=4 9926 B11R1.81 COCc1ccc(cc1F)I 7a_200010202041_200000210301 [1,2,0,0,0,0|1,0,0]=4 9927 B11R1.81 COCc1ccc(cc1I)Br 34a_100138415774_100010146615 [1,2,0,0,0,0|1,0,0]=4 9928 B11R1.81 COCc1ccc(cc1I)Br 7a_100010146605_200000210301 [1,2,0,0,0,0|1,0,0]=4 9929 B11R1.81 COCc1ccc(cc1I)Cl 34a_100000722340_200000210301 [1,2,0,0,0,0|1,0,0]=4 9930 B11R1.81 COCc1ccc(cc1I)Cl 34a_100138415774_100010254388 [1,2,0,0,0,0|1,0,0]=4 9931 B11R1.81 COCc1ccc(cc1I)Cl 7a_100000722340_200000210301 [1,2,0,0,0,0|1,0,0]=4 9932 B11R1.81 COCc1ccc(cc1I)F 34a_100011356828_200000210301 [1,2,0,0,0,0|1,0,0]=4 9933 B11R1.81 COCc1ccc(cc1I)F 34a_100138415774_100012354799 [1,2,0,0,0,0|1,0,0]=4 9934 B11R1.81 COCc1ccc(cc1I)F 7a_100011356828_200000210301 [1,2,0,0,0,0|1,0,0]=4 9935 B11R1.81 COCc1ccc(cc1N)Br 34a_100000718831_200000210301 [1,2,0,0,0,0|1,0,0]=4 9936 B11R1.81 COCc1ccc(cc1N)Br 7a_100000718831_200000210301 [1,2,0,0,0,0|1,0,0]=4 9937 B11R1.81 COCc1ccc(cc1N)C 34a_100000087799_200000210301 [1,2,0,0,0,0|1,0,0]=4 9938 B11R1.81 COCc1ccc(cc1N)C 7a_100000087799_200000210301 [1,2,0,0,0,0|1,0,0]=4 9939 B11R1.81 COCc1ccc(cc1N)Cl 34a_100000238622_200000210301 [1,2,0,0,0,0|1,0,0]=4 9940 B11R1.81 COCc1ccc(cc1N)Cl 7a_100000238622_200000210301 [1,2,0,0,0,0|1,0,0]=4 9941 B11R1.81 COCc1ccc(cc1N)F 34a_100011996588_200000210301 [1,2,0,0,0,0|1,0,0]=4 9942 B11R1.81 COCc1ccc(cc1N)O 271570a_203496583355_100013084866 [1,2,0,0,0,0|1,0,0]=4 9943 B11R1.81 CSCc1ccc(cc1Br)Br 62a_200000210301_200012351560 [1,2,0,0,0,0|1,0,0]=4 9944 B11R1.81 CSCc1ccc(cc1Br)Br 62a_200012351560_200000210301 [1,2,0,0,0,0|1,0,0]=4 9945 B11R1.81 CSCc1ccc(cc1Br)Cl 62a_100000755608_200000210301 [1,2,0,0,0,0|1,0,0]=4 9946 B11R1.81 CSCc1ccc(cc1Br)Cl 62a_200000210301_100000755608 [1,2,0,0,0,0|1,0,0]=4 9947 B11R1.81 CSCc1ccc(cc1Br)F 62a_100000243222_200000210301 [1,2,0,0,0,0|1,0,0]=4 9948 B11R1.81 CSCc1ccc(cc1Br)F 62a_200000210301_100000243222 [1,2,0,0,0,0|1,0,0]=4 9949 B11R1.81 CSCc1ccc(cc1Br)I 62a_100010146610_200000210301 [1,2,0,0,0,0|1,0,0]=4 9950 B11R1.81 CSCc1ccc(cc1Br)I 62a_200000210301_100010146610 [1,2,0,0,0,0|1,0,0]=4 9951 B11R1.81 CSCc1ccc(cc1C)Br 62a_100000708836_200000210301 [1,2,0,0,0,0|1,0,0]=4 9952 B11R1.81 CSCc1ccc(cc1C)Br 62a_200000210301_100000708836 [1,2,0,0,0,0|1,0,0]=4 9953 B11R1.81 CSCc1ccc(cc1C)C 62a_100011219618_200000210301 [1,2,0,0,0,0|1,0,0]=4 9954 B11R1.81 CSCc1ccc(cc1C)C 62a_200000210301_100011219618 [1,2,0,0,0,0|1,0,0]=4 9955 B11R1.81 CSCc1ccc(cc1C)Cl 62a_100012361307_200000210301 [1,2,0,0,0,0|1,0,0]=4 9956 B11R1.81 CSCc1ccc(cc1C)Cl 62a_200000210301_100012361307 [1,2,0,0,0,0|1,0,0]=4 9957 B11R1.81 CSCc1ccc(cc1C)F 62a_100000700533_200000210301 [1,2,0,0,0,0|1,0,0]=4 9958 B11R1.81 CSCc1ccc(cc1C)F 62a_200000210301_100000700533 [1,2,0,0,0,0|1,0,0]=4 9959 B11R1.81 CSCc1ccc(cc1Cl)Br 62a_100011740631_200000210301 [1,2,0,0,0,0|1,0,0]=4 9960 B11R1.81 CSCc1ccc(cc1Cl)Br 62a_200000210301_100011740631 [1,2,0,0,0,0|1,0,0]=4 9961 B11R1.81 CSCc1ccc(cc1Cl)C 62a_100012349684_200000210301 [1,2,0,0,0,0|1,0,0]=4 9962 B11R1.81 CSCc1ccc(cc1Cl)C 62a_200000210301_100012349684 [1,2,0,0,0,0|1,0,0]=4 9963 B11R1.81 CSCc1ccc(cc1Cl)Cl 62a_100000188473_200000210301 [1,2,0,0,0,0|1,0,0]=4 9964 B11R1.81 CSCc1ccc(cc1Cl)Cl 62a_200000210301_100000188473 [1,2,0,0,0,0|1,0,0]=4 9965 B11R1.81 CSCc1ccc(cc1Cl)F 62a_100000187853_200000210301 [1,2,0,0,0,0|1,0,0]=4 9966 B11R1.81 CSCc1ccc(cc1Cl)F 62a_200000210301_100000187853 [1,2,0,0,0,0|1,0,0]=4 9967 B11R1.81 CSCc1ccc(cc1F)Br 62a_100000211606_200000210301 [1,2,0,0,0,0|1,0,0]=4 9968 B11R1.81 CSCc1ccc(cc1F)Br 62a_200000210301_100000211606 [1,2,0,0,0,0|1,0,0]=4 9969 B11R1.81 CSCc1ccc(cc1F)C 62a_100011217900_200000210301 [1,2,0,0,0,0|1,0,0]=4 9970 B11R1.81 CSCc1ccc(cc1F)C 62a_200000210301_100011217900 [1,2,0,0,0,0|1,0,0]=4 9971 B11R1.81 CSCc1ccc(cc1F)Cl 62a_100000709361_200000210301 [1,2,0,0,0,0|1,0,0]=4 9972 B11R1.81 CSCc1ccc(cc1F)Cl 62a_200000210301_100000709361 [1,2,0,0,0,0|1,0,0]=4 9973 B11R1.81 CSCc1ccc(cc1F)F 62a_100000748237_200000210301 [1,2,0,0,0,0|1,0,0]=4 9974 B11R1.81 CSCc1ccc(cc1F)F 62a_200000210301_100000748237 [1,2,0,0,0,0|1,0,0]=4 9975 B11R1.81 CSCc1ccc(cc1F)I 62a_100010244991_200000210301 [1,2,0,0,0,0|1,0,0]=4 9976 B11R1.81 CSCc1ccc(cc1F)I 62a_200000210301_100010244991 [1,2,0,0,0,0|1,0,0]=4 9977 B11R1.81 CSCc1ccc(cc1I)Br 62a_100010146615_200000210301 [1,2,0,0,0,0|1,0,0]=4 9978 B11R1.81 CSCc1ccc(cc1I)Br 62a_200000210301_100010146615 [1,2,0,0,0,0|1,0,0]=4 9979 B11R1.81 CSCc1ccc(cc1I)Cl 62a_100010254388_200000210301 [1,2,0,0,0,0|1,0,0]=4 9980 B11R1.81 CSCc1ccc(cc1I)Cl 62a_200000210301_100010254388 [1,2,0,0,0,0|1,0,0]=4 9981 B11R1.81 CSCc1ccc(cc1I)F 62a_100012354799_200000210301 [1,2,0,0,0,0|1,0,0]=4 9982 B11R1.81 CSCc1ccc(cc1I)F 62a_200000210301_100012354799 [1,2,0,0,0,0|1,0,0]=4 9983 B11R1.81 Cc1cc(ccc1CN[13CH3])Br 34a_100000753881_200025704644 [1,2,0,0,0,0|1,0,0]=4 9984 B11R1.81 Cc1cc(ccc1CN[13CH3])Cl 34a_103436540063_200025704644 [1,2,0,0,0,0|1,0,0]=4 9985 B11R1.81 Cc1cc(ccc1CN[13CH3])F 34a_100137329023_200025704644 [1,2,0,0,0,0|1,0,0]=4 9986 B11R1.81 Cc1cc(ccc1CO[13CH3])Br 34a_100000748258_200025704644 [1,2,0,0,0,0|1,0,0]=4 9987 B11R1.81 Cc1cc(ccc1CO[13CH3])Br 7a_100000748258_200025704644 [1,2,0,0,0,0|1,0,0]=4 9988 B11R1.81 Cc1cc(ccc1CO[13CH3])Cl 34a_100000702939_200025704644 [1,2,0,0,0,0|1,0,0]=4 9989 B11R1.81 Cc1cc(ccc1CO[13CH3])Cl 7a_100000702939_200025704644 [1,2,0,0,0,0|1,0,0]=4 9990 B11R1.81 Cc1cc(ccc1CO[13CH3])F 34a_100000700136_200025704644 [1,2,0,0,0,0|1,0,0]=4 9991 B11R1.81 Cc1cc(ccc1CO[13CH3])F 7a_100000700136_200025704644 [1,2,0,0,0,0|1,0,0]=4 9992 B11R1.81 Cc1cc(ccc1CO[13CH3])N 34a_100000102464_200025704644 [1,2,0,0,0,0|1,0,0]=4 9993 B11R1.81 Cc1cc(ccc1CO[13CH3])N 7a_100000102464_200025704644 [1,2,0,0,0,0|1,0,0]=4 9994 B11R1.81 Cc1cc(ccc1CS[13CH3])Br 62a_100000708836_200025704644 [1,2,0,0,0,0|1,0,0]=4 9995 B11R1.81 Cc1cc(ccc1CS[13CH3])Br 62a_200025704644_100000708836 [1,2,0,0,0,0|1,0,0]=4 9996 B11R1.81 Cc1cc(ccc1CS[13CH3])Cl 62a_100012361307_200025704644 [1,2,0,0,0,0|1,0,0]=4 9997 B11R1.81 Cc1cc(ccc1CS[13CH3])Cl 62a_200025704644_100012361307 [1,2,0,0,0,0|1,0,0]=4 9998 B11R1.81 Cc1cc(ccc1CS[13CH3])F 62a_100000700533_200025704644 [1,2,0,0,0,0|1,0,0]=4 9999 B11R1.81 Cc1cc(ccc1CS[13CH3])F 62a_200025704644_100000700533 [1,2,0,0,0,0|1,0,0]=4 10000 B11R1.81 Cc1ccc(c(c1)C)CN[13CH3] 34a_100000737523_200025704644 [1,2,0,0,0,0|1,0,0]=4 10001 B11R1.81 Cc1ccc(c(c1)C)CO[13CH3] 34a_100011215341_200025704644 [1,2,0,0,0,0|1,0,0]=4 10002 B11R1.81 Cc1ccc(c(c1)C)CO[13CH3] 7a_100011215341_200025704644 [1,2,0,0,0,0|1,0,0]=4 10003 B11R1.81 Cc1ccc(c(c1)C)CS[13CH3] 62a_100011219618_200025704644 [1,2,0,0,0,0|1,0,0]=4 10004 B11R1.81 Cc1ccc(c(c1)C)CS[13CH3] 62a_200025704644_100011219618 [1,2,0,0,0,0|1,0,0]=4 10005 B11R1.81 Cc1ccc(c(c1)Cl)CN[13CH3] 34a_100011997539_200025704644 [1,2,0,0,0,0|1,0,0]=4 10006 B11R1.81 Cc1ccc(c(c1)Cl)CO[13CH3] 34a_100000720314_200025704644 [1,2,0,0,0,0|1,0,0]=4 10007 B11R1.81 Cc1ccc(c(c1)Cl)CO[13CH3] 7a_100000720314_200025704644 [1,2,0,0,0,0|1,0,0]=4 10008 B11R1.81 Cc1ccc(c(c1)Cl)CS[13CH3] 62a_100012349684_200025704644 [1,2,0,0,0,0|1,0,0]=4 10009 B11R1.81 Cc1ccc(c(c1)Cl)CS[13CH3] 62a_200025704644_100012349684 [1,2,0,0,0,0|1,0,0]=4 10010 B11R1.81 Cc1ccc(c(c1)F)CN[13CH3] 34a_100102887089_200025704644 [1,2,0,0,0,0|1,0,0]=4 10011 B11R1.81 Cc1ccc(c(c1)F)CO[13CH3] 34a_100011216587_200025704644 [1,2,0,0,0,0|1,0,0]=4 10012 B11R1.81 Cc1ccc(c(c1)F)CO[13CH3] 7a_100011216587_200025704644 [1,2,0,0,0,0|1,0,0]=4 10013 B11R1.81 Cc1ccc(c(c1)F)CS[13CH3] 62a_100011217900_200025704644 [1,2,0,0,0,0|1,0,0]=4 10014 B11R1.81 Cc1ccc(c(c1)F)CS[13CH3] 62a_200025704644_100011217900 [1,2,0,0,0,0|1,0,0]=4 10015 B11R1.81 Cc1ccc(c(c1)N)CO[13CH3] 34a_100000087799_200025704644 [1,2,0,0,0,0|1,0,0]=4 10016 B11R1.81 Cc1ccc(c(c1)N)CO[13CH3] 7a_100000087799_200025704644 [1,2,0,0,0,0|1,0,0]=4 10017 B11R1.81 [13CH3]NCc1ccc(cc1Br)Cl 34a_100102692131_200025704644 [1,2,0,0,0,0|1,0,0]=4 10018 B11R1.81 [13CH3]NCc1ccc(cc1Br)F 34a_100000708791_200025704644 [1,2,0,0,0,0|1,0,0]=4 10019 B11R1.81 [13CH3]NCc1ccc(cc1Cl)Br 34a_100020628970_200025704644 [1,2,0,0,0,0|1,0,0]=4 10020 B11R1.81 [13CH3]NCc1ccc(cc1Cl)Cl 34a_100000174880_200025704644 [1,2,0,0,0,0|1,0,0]=4 10021 B11R1.81 [13CH3]NCc1ccc(cc1Cl)F 34a_100000174946_200025704644 [1,2,0,0,0,0|1,0,0]=4 10022 B11R1.81 [13CH3]NCc1ccc(cc1Cl)O 34a_200161156549_200025704644 [1,2,0,0,0,0|1,0,0]=4 10023 B11R1.81 [13CH3]NCc1ccc(cc1F)Br 34a_100000754580_200025704644 [1,2,0,0,0,0|1,0,0]=4 10024 B11R1.81 [13CH3]NCc1ccc(cc1F)Cl 34a_100000708496_200025704644 [1,2,0,0,0,0|1,0,0]=4 10025 B11R1.81 [13CH3]NCc1ccc(cc1F)F 34a_100000737868_200025704644 [1,2,0,0,0,0|1,0,0]=4 10026 B11R1.81 [13CH3]OCc1ccc(cc1Br)Br 34a_100012357508_200025704644 [1,2,0,0,0,0|1,0,0]=4 10027 B11R1.81 [13CH3]OCc1ccc(cc1Br)Br 7a_100012357508_200025704644 [1,2,0,0,0,0|1,0,0]=4 10028 B11R1.81 [13CH3]OCc1ccc(cc1Br)Cl 34a_100000707881_200025704644 [1,2,0,0,0,0|1,0,0]=4 10029 B11R1.81 [13CH3]OCc1ccc(cc1Br)Cl 7a_100000707881_200025704644 [1,2,0,0,0,0|1,0,0]=4 10030 B11R1.81 [13CH3]OCc1ccc(cc1Br)F 34a_100000744086_200025704644 [1,2,0,0,0,0|1,0,0]=4 10031 B11R1.81 [13CH3]OCc1ccc(cc1Br)F 7a_100000744086_200025704644 [1,2,0,0,0,0|1,0,0]=4 10032 B11R1.81 [13CH3]OCc1ccc(cc1Br)I 7a_100010240206_200025704644 [1,2,0,0,0,0|1,0,0]=4 10033 B11R1.81 [13CH3]OCc1ccc(cc1Cl)Br 34a_100000756401_200025704644 [1,2,0,0,0,0|1,0,0]=4 10034 B11R1.81 [13CH3]OCc1ccc(cc1Cl)Br 7a_100000756401_200025704644 [1,2,0,0,0,0|1,0,0]=4 10035 B11R1.81 [13CH3]OCc1ccc(cc1Cl)Cl 34a_100000215721_200025704644 [1,2,0,0,0,0|1,0,0]=4 10036 B11R1.81 [13CH3]OCc1ccc(cc1Cl)Cl 7a_100000215721_200025704644 [1,2,0,0,0,0|1,0,0]=4 10037 B11R1.81 [13CH3]OCc1ccc(cc1Cl)F 34a_100011219954_200025704644 [1,2,0,0,0,0|1,0,0]=4 10038 B11R1.81 [13CH3]OCc1ccc(cc1Cl)F 7a_100011219954_200025704644 [1,2,0,0,0,0|1,0,0]=4 10039 B11R1.81 [13CH3]OCc1ccc(cc1Cl)N 34a_100000689119_200025704644 [1,2,0,0,0,0|1,0,0]=4 10040 B11R1.81 [13CH3]OCc1ccc(cc1F)Br 34a_100011191541_200025704644 [1,2,0,0,0,0|1,0,0]=4 10041 B11R1.81 [13CH3]OCc1ccc(cc1F)Br 7a_100011191541_200025704644 [1,2,0,0,0,0|1,0,0]=4 10042 B11R1.81 [13CH3]OCc1ccc(cc1F)Cl 34a_100011217562_200025704644 [1,2,0,0,0,0|1,0,0]=4 10043 B11R1.81 [13CH3]OCc1ccc(cc1F)Cl 7a_100011217562_200025704644 [1,2,0,0,0,0|1,0,0]=4 10044 B11R1.81 [13CH3]OCc1ccc(cc1F)F 34a_100011215441_200025704644 [1,2,0,0,0,0|1,0,0]=4 10045 B11R1.81 [13CH3]OCc1ccc(cc1F)F 7a_100011215441_200025704644 [1,2,0,0,0,0|1,0,0]=4 10046 B11R1.81 [13CH3]OCc1ccc(cc1F)I 34a_200010202041_200025704644 [1,2,0,0,0,0|1,0,0]=4 10047 B11R1.81 [13CH3]OCc1ccc(cc1F)I 7a_200010202041_200025704644 [1,2,0,0,0,0|1,0,0]=4 10048 B11R1.81 [13CH3]OCc1ccc(cc1I)Br 7a_100010146605_200025704644 [1,2,0,0,0,0|1,0,0]=4 10049 B11R1.81 [13CH3]OCc1ccc(cc1I)Cl 34a_100000722340_200025704644 [1,2,0,0,0,0|1,0,0]=4 10050 B11R1.81 [13CH3]OCc1ccc(cc1I)Cl 7a_100000722340_200025704644 [1,2,0,0,0,0|1,0,0]=4 10051 B11R1.81 [13CH3]OCc1ccc(cc1I)F 34a_100011356828_200025704644 [1,2,0,0,0,0|1,0,0]=4 10052 B11R1.81 [13CH3]OCc1ccc(cc1I)F 7a_100011356828_200025704644 [1,2,0,0,0,0|1,0,0]=4 10053 B11R1.81 [13CH3]OCc1ccc(cc1N)Br 34a_100000718831_200025704644 [1,2,0,0,0,0|1,0,0]=4 10054 B11R1.81 [13CH3]OCc1ccc(cc1N)Br 7a_100000718831_200025704644 [1,2,0,0,0,0|1,0,0]=4 10055 B11R1.81 [13CH3]OCc1ccc(cc1N)Cl 34a_100000238622_200025704644 [1,2,0,0,0,0|1,0,0]=4 10056 B11R1.81 [13CH3]OCc1ccc(cc1N)Cl 7a_100000238622_200025704644 [1,2,0,0,0,0|1,0,0]=4 10057 B11R1.81 [13CH3]OCc1ccc(cc1N)F 34a_100011996588_200025704644 [1,2,0,0,0,0|1,0,0]=4 10058 B11R1.81 [13CH3]SCc1ccc(cc1Br)Br 62a_200012351560_200025704644 [1,2,0,0,0,0|1,0,0]=4 10059 B11R1.81 [13CH3]SCc1ccc(cc1Br)Br 62a_200025704644_200012351560 [1,2,0,0,0,0|1,0,0]=4 10060 B11R1.81 [13CH3]SCc1ccc(cc1Br)Cl 62a_100000755608_200025704644 [1,2,0,0,0,0|1,0,0]=4 10061 B11R1.81 [13CH3]SCc1ccc(cc1Br)Cl 62a_200025704644_100000755608 [1,2,0,0,0,0|1,0,0]=4 10062 B11R1.81 [13CH3]SCc1ccc(cc1Br)F 62a_100000243222_200025704644 [1,2,0,0,0,0|1,0,0]=4 10063 B11R1.81 [13CH3]SCc1ccc(cc1Br)F 62a_200025704644_100000243222 [1,2,0,0,0,0|1,0,0]=4 10064 B11R1.81 [13CH3]SCc1ccc(cc1Br)I 62a_100010146610_200025704644 [1,2,0,0,0,0|1,0,0]=4 10065 B11R1.81 [13CH3]SCc1ccc(cc1Br)I 62a_200025704644_100010146610 [1,2,0,0,0,0|1,0,0]=4 10066 B11R1.81 [13CH3]SCc1ccc(cc1Cl)Br 62a_100011740631_200025704644 [1,2,0,0,0,0|1,0,0]=4 10067 B11R1.81 [13CH3]SCc1ccc(cc1Cl)Br 62a_200025704644_100011740631 [1,2,0,0,0,0|1,0,0]=4 10068 B11R1.81 [13CH3]SCc1ccc(cc1Cl)Cl 62a_100000188473_200025704644 [1,2,0,0,0,0|1,0,0]=4 10069 B11R1.81 [13CH3]SCc1ccc(cc1Cl)Cl 62a_200025704644_100000188473 [1,2,0,0,0,0|1,0,0]=4 10070 B11R1.81 [13CH3]SCc1ccc(cc1Cl)F 62a_100000187853_200025704644 [1,2,0,0,0,0|1,0,0]=4 10071 B11R1.81 [13CH3]SCc1ccc(cc1Cl)F 62a_200025704644_100000187853 [1,2,0,0,0,0|1,0,0]=4 10072 B11R1.81 [13CH3]SCc1ccc(cc1F)Br 62a_100000211606_200025704644 [1,2,0,0,0,0|1,0,0]=4 10073 B11R1.81 [13CH3]SCc1ccc(cc1F)Br 62a_200025704644_100000211606 [1,2,0,0,0,0|1,0,0]=4 10074 B11R1.81 [13CH3]SCc1ccc(cc1F)Cl 62a_100000709361_200025704644 [1,2,0,0,0,0|1,0,0]=4 10075 B11R1.81 [13CH3]SCc1ccc(cc1F)Cl 62a_200025704644_100000709361 [1,2,0,0,0,0|1,0,0]=4 10076 B11R1.81 [13CH3]SCc1ccc(cc1F)F 62a_100000748237_200025704644 [1,2,0,0,0,0|1,0,0]=4 10077 B11R1.81 [13CH3]SCc1ccc(cc1F)F 62a_200025704644_100000748237 [1,2,0,0,0,0|1,0,0]=4 10078 B11R1.81 [13CH3]SCc1ccc(cc1F)I 62a_100010244991_200025704644 [1,2,0,0,0,0|1,0,0]=4 10079 B11R1.81 [13CH3]SCc1ccc(cc1F)I 62a_200025704644_100010244991 [1,2,0,0,0,0|1,0,0]=4 10080 B11R1.81 [13CH3]SCc1ccc(cc1I)Br 62a_100010146615_200025704644 [1,2,0,0,0,0|1,0,0]=4 10081 B11R1.81 [13CH3]SCc1ccc(cc1I)Br 62a_200025704644_100010146615 [1,2,0,0,0,0|1,0,0]=4 10082 B11R1.81 [13CH3]SCc1ccc(cc1I)Cl 62a_100010254388_200025704644 [1,2,0,0,0,0|1,0,0]=4 10083 B11R1.81 [13CH3]SCc1ccc(cc1I)Cl 62a_200025704644_100010254388 [1,2,0,0,0,0|1,0,0]=4 10084 B11R1.81 [13CH3]SCc1ccc(cc1I)F 62a_100012354799_200025704644 [1,2,0,0,0,0|1,0,0]=4 10085 B11R1.81 [13CH3]SCc1ccc(cc1I)F 62a_200025704644_100012354799 [1,2,0,0,0,0|1,0,0]=4 10086 B11R1.83 C#Cc1ccc(cc1)CNC 207a_100102657272_100011361452 [1,2,0,0,0,0|1,0,0]=4 10087 B11R1.83 C#Cc1ccc(cc1)CNC 2230a_100015199678_200000210301 [1,2,0,0,0,0|1,0,0]=4 10088 B11R1.83 C#Cc1ccc(cc1)CNC 2230a_106832991635_100000140223 [1,2,0,0,0,0|1,0,0]=4 10089 B11R1.83 C#Cc1ccc(cc1)CNC 270004a_106832991635_100011361452 [1,2,0,0,0,0|1,0,0]=4 10090 B11R1.83 C#Cc1ccc(cc1)CNC 34a_100015199678_200000210301 [1,2,0,0,0,0|1,0,0]=4 10091 B11R1.83 C#Cc1ccc(cc1)CNC 34a_100102657272_100000140223 [1,2,0,0,0,0|1,0,0]=4 10092 B11R1.83 C#Cc1ccc(cc1)CNC 7a_106832991635_100000140223 [1,2,0,0,0,0|1,0,0]=4 10093 B11R1.83 C#Cc1ccc(cc1)CN[13CH3] 2230a_100015199678_200025704644 [1,2,0,0,0,0|1,0,0]=4 10094 B11R1.83 C#Cc1ccc(cc1)CN[13CH3] 34a_100015199678_200025704644 [1,2,0,0,0,0|1,0,0]=4 10095 B11R1.83 C#Cc1ccc(cc1)COC 34a_100000054647_200000210301 [1,2,0,0,0,0|1,0,0]=4 10096 B11R1.83 C#Cc1ccc(cc1)COC 34a_100138415774_100000140223 [1,2,0,0,0,0|1,0,0]=4 10097 B11R1.83 C#Cc1ccc(cc1)COC 7a_100000054647_200000210301 [1,2,0,0,0,0|1,0,0]=4 10098 B11R1.83 C#Cc1ccc(cc1)CO[13CH3] 34a_100000054647_200025704644 [1,2,0,0,0,0|1,0,0]=4 10099 B11R1.83 C#Cc1ccc(cc1)CO[13CH3] 7a_100000054647_200025704644 [1,2,0,0,0,0|1,0,0]=4 10100 B11R1.83 C#Cc1ccc(cc1)CSC 62a_200000210301_100000140223 [1,2,0,0,0,0|1,0,0]=4 10101 B11R1.83 C#Cc1ccc(cc1)CS[13CH3] 62a_200025704644_100000140223 [1,2,0,0,0,0|1,0,0]=4 10102 B11R1.83 C/C=C/c1ccc(cc1)SC 62a_100016259036_200000210301 [1,2,0,0,0,0|0,0,1]=4 10103 B11R1.83 C/C=C/c1ccc(cc1)SC 62a_200000210301_100016259036 [1,2,0,0,0,0|0,0,1]=4 10104 B11R1.83 C/C=C/c1ccc(cc1)S[13CH3] 62a_100016259036_200025704644 [1,2,0,0,0,0|0,0,1]=4 10105 B11R1.83 C/C=C/c1ccc(cc1)S[13CH3] 62a_200025704644_100016259036 [1,2,0,0,0,0|0,0,1]=4 10106 B11R1.83 C=CCc1ccc(cc1)OC 34a_100000078792_200000210301 [1,2,0,0,0,0|0,0,0]=3 10107 B11R1.83 C=CCc1ccc(cc1)OC 7a_100000078792_200000210301 [1,2,0,0,0,0|0,0,0]=3 10108 B11R1.83 C=CCc1ccc(cc1)O[13CH3] 34a_100000078792_200025704644 [1,2,0,0,0,0|0,0,0]=3 10109 B11R1.83 C=CCc1ccc(cc1)O[13CH3] 7a_100000078792_200025704644 [1,2,0,0,0,0|0,0,0]=3 10110 B11R1.83 C=COc1ccc(cc1)SC 62a_100000704263_200000210301 [1,2,0,0,0,0|1,0,0]=4 10111 B11R1.83 C=COc1ccc(cc1)SC 62a_200000210301_100000704263 [1,2,0,0,0,0|1,0,0]=4 10112 B11R1.83 C=COc1ccc(cc1)S[13CH3] 62a_100000704263_200025704644 [1,2,0,0,0,0|1,0,0]=4 10113 B11R1.83 C=COc1ccc(cc1)S[13CH3] 62a_200025704644_100000704263 [1,2,0,0,0,0|1,0,0]=4 10114 B11R1.83 C=Cc1ccc(cc1)/C=C/C 271570a_100011290941_100016259036 [1,2,0,0,0,0|0,0,1]=4 10115 B11R1.83 C=Cc1ccc(cc1)CC=O 271570a_100011290941_100011361690 [1,2,0,0,0,0|1,0,0]=4 10116 B11R1.83 C=Cc1ccc(cc1)CCC 271570a_100011290941_100000750032 [1,2,0,0,0,0|0,0,1]=4 10117 B11R1.83 C=Cc1ccc(cc1)CNC 2230a_106832991635_100000034074 [1,2,0,0,0,0|1,0,0]=4 10118 B11R1.83 C=Cc1ccc(cc1)CNC 26a_100102657272_100000189437 [1,2,0,0,0,0|1,0,0]=4 10119 B11R1.83 C=Cc1ccc(cc1)CNC 270004a_106832991635_100011361436 [1,2,0,0,0,0|1,0,0]=4 10120 B11R1.83 C=Cc1ccc(cc1)CNC 271570a_100011290941_100000180866 [1,2,0,0,0,0|1,0,0]=4 10121 B11R1.83 C=Cc1ccc(cc1)CNC 34a_100102657272_100000034074 [1,2,0,0,0,0|1,0,0]=4 10122 B11R1.83 C=Cc1ccc(cc1)CNC 34a_200011934891_200000210301 [1,2,0,0,0,0|1,0,0]=4 10123 B11R1.83 C=Cc1ccc(cc1)CNC 7a_106832991635_100000034074 [1,2,0,0,0,0|1,0,0]=4 10124 B11R1.83 C=Cc1ccc(cc1)CN[13CH3] 34a_200011934891_200025704644 [1,2,0,0,0,0|1,0,0]=4 10125 B11R1.83 C=Cc1ccc(cc1)COC 271570a_100011290941_100011493685 [1,2,0,0,0,0|1,0,0]=4 10126 B11R1.83 C=Cc1ccc(cc1)COC 34a_100000073583_200000210301 [1,2,0,0,0,0|1,0,0]=4 10127 B11R1.83 C=Cc1ccc(cc1)COC 34a_100138415774_100000034074 [1,2,0,0,0,0|1,0,0]=4 10128 B11R1.83 C=Cc1ccc(cc1)COC 7a_100000073583_200000210301 [1,2,0,0,0,0|1,0,0]=4 10129 B11R1.83 C=Cc1ccc(cc1)CO[13CH3] 34a_100000073583_200025704644 [1,2,0,0,0,0|1,0,0]=4 10130 B11R1.83 C=Cc1ccc(cc1)CO[13CH3] 7a_100000073583_200025704644 [1,2,0,0,0,0|1,0,0]=4 10131 B11R1.83 C=Cc1ccc(cc1)CSC 62a_100000034074_200000210301 [1,2,0,0,0,0|1,0,0]=4 10132 B11R1.83 C=Cc1ccc(cc1)CSC 62a_200000210301_100000034074 [1,2,0,0,0,0|1,0,0]=4 10133 B11R1.83 C=Cc1ccc(cc1)CS[13CH3] 62a_100000034074_200025704644 [1,2,0,0,0,0|1,0,0]=4 10134 B11R1.83 C=Cc1ccc(cc1)CS[13CH3] 62a_200025704644_100000034074 [1,2,0,0,0,0|1,0,0]=4 10135 B11R1.83 CC=Cc1ccc(cc1)C#N 271570a_100016259895_100000179745 [1,2,0,0,0,0|0,0,1]=4 10136 B11R1.83 CC=Cc1ccc(cc1)C=O 271570a_100016259895_100000186029 [1,2,0,0,0,0|0,0,1]=4 10137 B11R1.83 CC=Cc1ccc(cc1)CC 271570a_100016259895_100011215824 [1,2,0,0,0,0|0,0,1]=4 10138 B11R1.83 CC=Cc1ccc(cc1)CF 271570a_100016259895_100010268989 [1,2,0,0,0,0|0,0,1]=4 10139 B11R1.83 CC=Cc1ccc(cc1)CN 271570a_100016259895_100016989417 [1,2,0,0,0,0|0,0,1]=4 10140 B11R1.83 CC=Cc1ccc(cc1)CO 271570a_100016259895_100000690907 [1,2,0,0,0,0|0,0,1]=4 10141 B11R1.83 CC=Cc1ccc(cc1)NC 271570a_100016259895_100000219623 [1,2,0,0,0,0|0,0,1]=4 10142 B11R1.83 CC=Cc1ccc(cc1)NN 271570a_100016259895_100016988836 [1,2,0,0,0,0|0,0,1]=4 10143 B11R1.83 CC=Cc1ccc(cc1)OC 271570a_100016259895_100000171711 [1,2,0,0,0,0|0,0,1]=4 10144 B11R1.83 CC=Cc1ccc(cc1)SC 271570a_100016259895_100011263217 [1,2,0,0,0,0|0,0,1]=4 10145 B11R1.83 CCCc1ccc(cc1)NC 2230a_100000211780_200000210301 [1,2,0,0,0,0|0,0,1]=4 10146 B11R1.83 CCCc1ccc(cc1)NC 34a_100000211780_200000210301 [1,2,0,0,0,0|0,0,1]=4 10147 B11R1.83 CCCc1ccc(cc1)N[13CH3] 2230a_100000211780_200025704644 [1,2,0,0,0,0|0,0,1]=4 10148 B11R1.83 CCCc1ccc(cc1)N[13CH3] 34a_100000211780_200025704644 [1,2,0,0,0,0|0,0,1]=4 10149 B11R1.83 CCCc1ccc(cc1)OC 34a_100000749406_200000210301 [1,2,0,0,0,0|0,0,1]=4 10150 B11R1.83 CCCc1ccc(cc1)OC 7a_100000749406_200000210301 [1,2,0,0,0,0|0,0,1]=4 10151 B11R1.83 CCCc1ccc(cc1)O[13CH3] 34a_100000749406_200025704644 [1,2,0,0,0,0|0,0,1]=4 10152 B11R1.83 CCCc1ccc(cc1)O[13CH3] 7a_100000749406_200025704644 [1,2,0,0,0,0|0,0,1]=4 10153 B11R1.83 CCCc1ccc(cc1)SC 62a_100000750032_200000210301 [1,2,0,0,0,0|0,0,1]=4 10154 B11R1.83 CCCc1ccc(cc1)SC 62a_200000210301_100000750032 [1,2,0,0,0,0|0,0,1]=4 10155 B11R1.83 CCCc1ccc(cc1)S[13CH3] 62a_100000750032_200025704644 [1,2,0,0,0,0|0,0,1]=4 10156 B11R1.83 CCCc1ccc(cc1)S[13CH3] 62a_200025704644_100000750032 [1,2,0,0,0,0|0,0,1]=4 10157 B11R1.83 CCc1ccc(cc1)CNC 207a_100102657272_100000211036 [1,2,0,0,0,0|1,0,0]=4 10158 B11R1.83 CCc1ccc(cc1)CNC 2230a_100000721222_200000210301 [1,2,0,0,0,0|1,0,0]=4 10159 B11R1.83 CCc1ccc(cc1)CNC 2230a_106832991635_100000747183 [1,2,0,0,0,0|1,0,0]=4 10160 B11R1.83 CCc1ccc(cc1)CNC 26a_100102657272_100000211359 [1,2,0,0,0,0|1,0,0]=4 10161 B11R1.83 CCc1ccc(cc1)CNC 270004a_106832991635_100000211036 [1,2,0,0,0,0|1,0,0]=4 10162 B11R1.83 CCc1ccc(cc1)CNC 34a_100000721222_200000210301 [1,2,0,0,0,0|1,0,0]=4 10163 B11R1.83 CCc1ccc(cc1)CNC 34a_100102657272_100000747183 [1,2,0,0,0,0|1,0,0]=4 10164 B11R1.83 CCc1ccc(cc1)CNC 7a_106832991635_100000747183 [1,2,0,0,0,0|1,0,0]=4 10165 B11R1.83 CCc1ccc(cc1)CN[13CH3] 2230a_100000721222_200025704644 [1,2,0,0,0,0|1,0,0]=4 10166 B11R1.83 CCc1ccc(cc1)CN[13CH3] 34a_100000721222_200025704644 [1,2,0,0,0,0|1,0,0]=4 10167 B11R1.83 CCc1ccc(cc1)COC 34a_100000702245_200000210301 [1,2,0,0,0,0|1,0,0]=4 10168 B11R1.83 CCc1ccc(cc1)COC 34a_100138415774_100000747183 [1,2,0,0,0,0|1,0,0]=4 10169 B11R1.83 CCc1ccc(cc1)COC 7a_100000702245_200000210301 [1,2,0,0,0,0|1,0,0]=4 10170 B11R1.83 CCc1ccc(cc1)CO[13CH3] 34a_100000702245_200025704644 [1,2,0,0,0,0|1,0,0]=4 10171 B11R1.83 CCc1ccc(cc1)CO[13CH3] 7a_100000702245_200025704644 [1,2,0,0,0,0|1,0,0]=4 10172 B11R1.83 CCc1ccc(cc1)CSC 62a_100000757233_200000210301 [1,2,0,0,0,0|1,0,0]=4 10173 B11R1.83 CCc1ccc(cc1)CSC 62a_200000210301_100000747183 [1,2,0,0,0,0|1,0,0]=4 10174 B11R1.83 CCc1ccc(cc1)CS[13CH3] 62a_100000757233_200025704644 [1,2,0,0,0,0|1,0,0]=4 10175 B11R1.83 CCc1ccc(cc1)CS[13CH3] 62a_200025704644_100000747183 [1,2,0,0,0,0|1,0,0]=4 10176 B11R1.83 CNCc1ccc(cc1)C#N 207a_100102657272_100000211122 [1,2,0,0,0,0|1,0,0]=4 10177 B11R1.83 CNCc1ccc(cc1)C#N 2230a_106832991635_100000184898 [1,2,0,0,0,0|1,0,0]=4 10178 B11R1.83 CNCc1ccc(cc1)C#N 26a_100102657272_100000210344 [1,2,0,0,0,0|1,0,0]=4 10179 B11R1.83 CNCc1ccc(cc1)C#N 270004a_106832991635_100000211122 [1,2,0,0,0,0|1,0,0]=4 10180 B11R1.83 CNCc1ccc(cc1)C#N 34a_100015207190_200000210301 [1,2,0,0,0,0|1,0,0]=4 10181 B11R1.83 CNCc1ccc(cc1)C#N 34a_100102657272_100000184898 [1,2,0,0,0,0|1,0,0]=4 10182 B11R1.83 CNCc1ccc(cc1)C#N 7a_106832991635_100000184898 [1,2,0,0,0,0|1,0,0]=4 10183 B11R1.83 CNCc1ccc(cc1)C=O 2230a_106832991635_100009816848 [1,2,0,0,0,0|1,0,0]=4 10184 B11R1.83 CNCc1ccc(cc1)C=O 34a_100102657272_100009816848 [1,2,0,0,0,0|1,0,0]=4 10185 B11R1.83 CNCc1ccc(cc1)C=O 7a_106832991635_100009816848 [1,2,0,0,0,0|1,0,0]=4 10186 B11R1.83 CNCc1ccc(cc1)CO 207a_100102657272_100009832023 [1,2,0,0,0,0|1,0,0]=4 10187 B11R1.83 CNCc1ccc(cc1)CO 2230a_100015189231_200000210301 [1,2,0,0,0,0|1,0,0]=4 10188 B11R1.83 CNCc1ccc(cc1)CO 2230a_106832991635_100000067286 [1,2,0,0,0,0|1,0,0]=4 10189 B11R1.83 CNCc1ccc(cc1)CO 26a_100102657272_100000211755 [1,2,0,0,0,0|1,0,0]=4 10190 B11R1.83 CNCc1ccc(cc1)CO 270004a_106832991635_100009832023 [1,2,0,0,0,0|1,0,0]=4 10191 B11R1.83 CNCc1ccc(cc1)CO 34a_100015189231_200000210301 [1,2,0,0,0,0|1,0,0]=4 10192 B11R1.83 CNCc1ccc(cc1)CO 34a_100102657272_100000067286 [1,2,0,0,0,0|1,0,0]=4 10193 B11R1.83 CNCc1ccc(cc1)CO 7a_106832991635_100000067286 [1,2,0,0,0,0|1,0,0]=4 10194 B11R1.83 CNCc1ccc(cc1)OC 207a_100102657272_100000169835 [1,2,0,0,0,0|1,0,0]=4 10195 B11R1.83 CNCc1ccc(cc1)OC 2230a_106832991635_100000742318 [1,2,0,0,0,0|1,0,0]=4 10196 B11R1.83 CNCc1ccc(cc1)OC 26a_100102657272_100000210503 [1,2,0,0,0,0|1,0,0]=4 10197 B11R1.83 CNCc1ccc(cc1)OC 270004a_106832991635_100000169835 [1,2,0,0,0,0|1,0,0]=4 10198 B11R1.83 CNCc1ccc(cc1)OC 34a_100000185587_200000210301 [1,2,0,0,0,0|1,0,0]=4 10199 B11R1.83 CNCc1ccc(cc1)OC 34a_100000207500_200000210301 [1,2,0,0,0,0|1,0,0]=4 10200 B11R1.83 CNCc1ccc(cc1)OC 34a_100102657272_100000742318 [1,2,0,0,0,0|1,0,0]=4 10201 B11R1.83 CNCc1ccc(cc1)OC 7a_106832991635_100000742318 [1,2,0,0,0,0|1,0,0]=4 10202 B11R1.83 CNCc1ccc(cc1)O[13CH3] 34a_100000207500_200025704644 [1,2,0,0,0,0|1,0,0]=4 10203 B11R1.83 CNCc1ccc(cc1)SC 207a_100102657272_100000211154 [1,2,0,0,0,0|1,0,0]=4 10204 B11R1.83 CNCc1ccc(cc1)SC 2230a_100000174980_200000210301 [1,2,0,0,0,0|1,0,0]=4 10205 B11R1.83 CNCc1ccc(cc1)SC 2230a_106832991635_100000181263 [1,2,0,0,0,0|1,0,0]=4 10206 B11R1.83 CNCc1ccc(cc1)SC 26a_100102657272_100000211864 [1,2,0,0,0,0|1,0,0]=4 10207 B11R1.83 CNCc1ccc(cc1)SC 270004a_106832991635_100000211154 [1,2,0,0,0,0|1,0,0]=4 10208 B11R1.83 CNCc1ccc(cc1)SC 34a_100000174980_200000210301 [1,2,0,0,0,0|1,0,0]=4 10209 B11R1.83 CNCc1ccc(cc1)SC 34a_100102657272_100000181263 [1,2,0,0,0,0|1,0,0]=4 10210 B11R1.83 CNCc1ccc(cc1)SC 62a_100000180866_200000210301 [1,2,0,0,0,0|1,0,0]=4 10211 B11R1.83 CNCc1ccc(cc1)SC 62a_200000210301_100000180866 [1,2,0,0,0,0|1,0,0]=4 10212 B11R1.83 CNCc1ccc(cc1)SC 7a_106832991635_100000181263 [1,2,0,0,0,0|1,0,0]=4 10213 B11R1.83 CNCc1ccc(cc1)S[13CH3] 62a_100000180866_200025704644 [1,2,0,0,0,0|1,0,0]=4 10214 B11R1.83 CNCc1ccc(cc1)S[13CH3] 62a_200025704644_100000180866 [1,2,0,0,0,0|1,0,0]=4 10215 B11R1.83 CNc1ccc(cc1)COC 34a_100000694113_200000210301 [1,2,0,0,0,0|1,0,0]=4 10216 B11R1.83 CNc1ccc(cc1)CSC 2230a_106726388226_200000210301 [1,2,0,0,0,0|1,0,0]=4 10217 B11R1.83 CNc1ccc(cc1)CSC 34a_106726388226_200000210301 [1,2,0,0,0,0|1,0,0]=4 10218 B11R1.83 CNc1ccc(cc1)CSC 7a_106726388226_200000210301 [1,2,0,0,0,0|1,0,0]=4 10219 B11R1.83 COCc1ccc(cc1)C#N 34a_100000238739_200000210301 [1,2,0,0,0,0|1,0,0]=4 10220 B11R1.83 COCc1ccc(cc1)C#N 34a_100138415774_100000184898 [1,2,0,0,0,0|1,0,0]=4 10221 B11R1.83 COCc1ccc(cc1)C#N 7a_100000238739_200000210301 [1,2,0,0,0,0|1,0,0]=4 10222 B11R1.83 COCc1ccc(cc1)C=O 34a_100138415774_100009816848 [1,2,0,0,0,0|1,0,0]=4 10223 B11R1.83 COCc1ccc(cc1)CBr 34a_100012353999_200000210301 [1,2,0,0,0,0|1,0,0]=4 10224 B11R1.83 COCc1ccc(cc1)CBr 7a_100012353999_200000210301 [1,2,0,0,0,0|1,0,0]=4 10225 B11R1.83 COCc1ccc(cc1)CCl 34a_100000067286_200000210301 [1,2,0,0,0,0|1,0,0]=4 10226 B11R1.83 COCc1ccc(cc1)CCl 7a_100000067286_200000210301 [1,2,0,0,0,0|1,0,0]=4 10227 B11R1.83 COCc1ccc(cc1)CN 34a_100015189231_200000210301 [1,2,0,0,0,0|1,0,0]=4 10228 B11R1.83 COCc1ccc(cc1)CO 34a_100138415774_100000067286 [1,2,0,0,0,0|1,0,0]=4 10229 B11R1.83 COCc1ccc(cc1)N[13CH3] 34a_100000694113_200025704644 [1,2,0,0,0,0|1,0,0]=4 10230 B11R1.83 COCc1ccc(cc1)OC 34a_100000173359_200000210301 [1,2,0,0,0,0|1,0,0]=4 10231 B11R1.83 COCc1ccc(cc1)OC 34a_100138415774_100000742318 [1,2,0,0,0,0|1,0,0]=4 10232 B11R1.83 COCc1ccc(cc1)OC 34a_200011995677_200000210301 [1,2,0,0,0,0|1,0,0]=4 10233 B11R1.83 COCc1ccc(cc1)OC 7a_200011995677_200000210301 [1,2,0,0,0,0|1,0,0]=4 10234 B11R1.83 COCc1ccc(cc1)O[13CH3] 34a_200011995677_200025704644 [1,2,0,0,0,0|1,0,0]=4 10235 B11R1.83 COCc1ccc(cc1)O[13CH3] 7a_200011995677_200025704644 [1,2,0,0,0,0|1,0,0]=4 10236 B11R1.83 COCc1ccc(cc1)SC 34a_100011215404_200000210301 [1,2,0,0,0,0|1,0,0]=4 10237 B11R1.83 COCc1ccc(cc1)SC 34a_100138415774_100000181263 [1,2,0,0,0,0|1,0,0]=4 10238 B11R1.83 COCc1ccc(cc1)SC 62a_100011493685_200000210301 [1,2,0,0,0,0|1,0,0]=4 10239 B11R1.83 COCc1ccc(cc1)SC 62a_200000210301_100011493685 [1,2,0,0,0,0|1,0,0]=4 10240 B11R1.83 COCc1ccc(cc1)SC 7a_100011215404_200000210301 [1,2,0,0,0,0|1,0,0]=4 10241 B11R1.83 COCc1ccc(cc1)S[13CH3] 62a_100011493685_200025704644 [1,2,0,0,0,0|1,0,0]=4 10242 B11R1.83 COCc1ccc(cc1)S[13CH3] 62a_200025704644_100011493685 [1,2,0,0,0,0|1,0,0]=4 10243 B11R1.83 COc1ccc(cc1)CN[13CH3] 34a_100000185587_200025704644 [1,2,0,0,0,0|1,0,0]=4 10244 B11R1.83 COc1ccc(cc1)CO[13CH3] 34a_100000173359_200025704644 [1,2,0,0,0,0|1,0,0]=4 10245 B11R1.83 COc1ccc(cc1)CSC 62a_200000210301_100000742318 [1,2,0,0,0,0|1,0,0]=4 10246 B11R1.83 COc1ccc(cc1)CS[13CH3] 62a_200025704644_100000742318 [1,2,0,0,0,0|1,0,0]=4 10247 B11R1.83 CSCc1ccc(cc1)C#N 62a_200000210301_100000184898 [1,2,0,0,0,0|1,0,0]=4 10248 B11R1.83 CSCc1ccc(cc1)C=O 62a_100009816848_200000210301 [1,2,0,0,0,0|1,0,0]=4 10249 B11R1.83 CSCc1ccc(cc1)C=O 62a_200000210301_100009816848 [1,2,0,0,0,0|1,0,0]=4 10250 B11R1.83 CSCc1ccc(cc1)CO 62a_100000067286_200000210301 [1,2,0,0,0,0|1,0,0]=4 10251 B11R1.83 CSCc1ccc(cc1)CO 62a_200000210301_100000067286 [1,2,0,0,0,0|1,0,0]=4 10252 B11R1.83 CSCc1ccc(cc1)N[13CH3] 2230a_106726388226_200025704644 [1,2,0,0,0,0|1,0,0]=4 10253 B11R1.83 CSCc1ccc(cc1)N[13CH3] 34a_106726388226_200025704644 [1,2,0,0,0,0|1,0,0]=4 10254 B11R1.83 CSCc1ccc(cc1)N[13CH3] 7a_106726388226_200025704644 [1,2,0,0,0,0|1,0,0]=4 10255 B11R1.83 CSCc1ccc(cc1)SC 62a_100000181263_200000210301 [1,2,0,0,0,0|1,0,0]=4 10256 B11R1.83 CSCc1ccc(cc1)SC 62a_200000210301_100000181263 [1,2,0,0,0,0|1,0,0]=4 10257 B11R1.83 CSc1ccc(cc1)CC=O 62a_100011361690_200000210301 [1,2,0,0,0,0|1,0,0]=4 10258 B11R1.83 CSc1ccc(cc1)CC=O 62a_200000210301_100011361690 [1,2,0,0,0,0|1,0,0]=4 10259 B11R1.83 CSc1ccc(cc1)CN[13CH3] 2230a_100000174980_200025704644 [1,2,0,0,0,0|1,0,0]=4 10260 B11R1.83 CSc1ccc(cc1)CN[13CH3] 34a_100000174980_200025704644 [1,2,0,0,0,0|1,0,0]=4 10261 B11R1.83 CSc1ccc(cc1)CO[13CH3] 34a_100011215404_200025704644 [1,2,0,0,0,0|1,0,0]=4 10262 B11R1.83 CSc1ccc(cc1)CO[13CH3] 7a_100011215404_200025704644 [1,2,0,0,0,0|1,0,0]=4 10263 B11R1.83 CSc1ccc(cc1)CS[13CH3] 62a_100000181263_200025704644 [1,2,0,0,0,0|1,0,0]=4 10264 B11R1.83 CSc1ccc(cc1)CS[13CH3] 62a_200025704644_100000181263 [1,2,0,0,0,0|1,0,0]=4 10265 B11R1.83 [13CH3]NCc1ccc(cc1)C#N 34a_100015207190_200025704644 [1,2,0,0,0,0|1,0,0]=4 10266 B11R1.83 [13CH3]NCc1ccc(cc1)CO 2230a_100015189231_200025704644 [1,2,0,0,0,0|1,0,0]=4 10267 B11R1.83 [13CH3]NCc1ccc(cc1)CO 34a_100015189231_200025704644 [1,2,0,0,0,0|1,0,0]=4 10268 B11R1.83 [13CH3]OCc1ccc(cc1)C#N 34a_100000238739_200025704644 [1,2,0,0,0,0|1,0,0]=4 10269 B11R1.83 [13CH3]OCc1ccc(cc1)C#N 7a_100000238739_200025704644 [1,2,0,0,0,0|1,0,0]=4 10270 B11R1.83 [13CH3]OCc1ccc(cc1)CBr 34a_100012353999_200025704644 [1,2,0,0,0,0|1,0,0]=4 10271 B11R1.83 [13CH3]OCc1ccc(cc1)CBr 7a_100012353999_200025704644 [1,2,0,0,0,0|1,0,0]=4 10272 B11R1.83 [13CH3]OCc1ccc(cc1)CCl 34a_100000067286_200025704644 [1,2,0,0,0,0|1,0,0]=4 10273 B11R1.83 [13CH3]OCc1ccc(cc1)CCl 7a_100000067286_200025704644 [1,2,0,0,0,0|1,0,0]=4 10274 B11R1.83 [13CH3]OCc1ccc(cc1)CN 34a_100015189231_200025704644 [1,2,0,0,0,0|1,0,0]=4 10275 B11R1.83 [13CH3]SCc1ccc(cc1)C#N 62a_200025704644_100000184898 [1,2,0,0,0,0|1,0,0]=4 10276 B11R1.83 [13CH3]SCc1ccc(cc1)C=O 62a_100009816848_200025704644 [1,2,0,0,0,0|1,0,0]=4 10277 B11R1.83 [13CH3]SCc1ccc(cc1)C=O 62a_200025704644_100009816848 [1,2,0,0,0,0|1,0,0]=4 10278 B11R1.83 [13CH3]SCc1ccc(cc1)CO 62a_100000067286_200025704644 [1,2,0,0,0,0|1,0,0]=4 10279 B11R1.83 [13CH3]SCc1ccc(cc1)CO 62a_200025704644_100000067286 [1,2,0,0,0,0|1,0,0]=4 10280 B11R1.83 [13CH3]Sc1ccc(cc1)CC=O 62a_100011361690_200025704644 [1,2,0,0,0,0|1,0,0]=4 10281 B11R1.83 [13CH3]Sc1ccc(cc1)CC=O 62a_200025704644_100011361690 [1,2,0,0,0,0|1,0,0]=4 10282 B11R1.192 CC=Cc1ccc(c(c1)Br)Br 271570a_100016259895_100012356285 [1,2,0,0,0,0|0,0,1]=4 10283 B11R1.192 CC=Cc1ccc(c(c1)Br)C 271570a_100016259895_100011847877 [1,2,0,0,0,0|0,0,1]=4 10284 B11R1.192 CC=Cc1ccc(c(c1)Br)Cl 271570a_100016259895_100012353702 [1,2,0,0,0,0|0,0,1]=4 10285 B11R1.192 CC=Cc1ccc(c(c1)Br)F 271570a_100016259895_100012047266 [1,2,0,0,0,0|0,0,1]=4 10286 B11R1.192 CC=Cc1ccc(c(c1)Br)N 271570a_100016259895_100000750455 [1,2,0,0,0,0|0,0,1]=4 10287 B11R1.192 CC=Cc1ccc(c(c1)Br)O 271570a_100016259895_100012361655 [1,2,0,0,0,0|0,0,1]=4 10288 B11R1.192 CC=Cc1ccc(c(c1)C)Br 271570a_100016259895_100009813585 [1,2,0,0,0,0|0,0,1]=4 10289 B11R1.192 CC=Cc1ccc(c(c1)C)C 271570a_100016259895_100011215607 [1,2,0,0,0,0|0,0,1]=4 10290 B11R1.192 CC=Cc1ccc(c(c1)C)Cl 271570a_100016259895_100000049509 [1,2,0,0,0,0|0,0,1]=4 10291 B11R1.192 CC=Cc1ccc(c(c1)C)F 271570a_100016259895_100011218330 [1,2,0,0,0,0|0,0,1]=4 10292 B11R1.192 CC=Cc1ccc(c(c1)C)N 271570a_100016259895_100000211769 [1,2,0,0,0,0|0,0,1]=4 10293 B11R1.192 CC=Cc1ccc(c(c1)C)O 271570a_100016259895_100000186361 [1,2,0,0,0,0|0,0,1]=4 10294 B11R1.192 CC=Cc1ccc(c(c1)Cl)Br 271570a_100016259895_100012047281 [1,2,0,0,0,0|0,0,1]=4 10295 B11R1.192 CC=Cc1ccc(c(c1)Cl)C 271570a_100016259895_100011216363 [1,2,0,0,0,0|0,0,1]=4 10296 B11R1.192 CC=Cc1ccc(c(c1)Cl)Cl 271570a_100016259895_100011214914 [1,2,0,0,0,0|0,0,1]=4 10297 B11R1.192 CC=Cc1ccc(c(c1)Cl)F 271570a_100016259895_100011215976 [1,2,0,0,0,0|0,0,1]=4 10298 B11R1.192 CC=Cc1ccc(c(c1)Cl)N 271570a_100016259895_100011218065 [1,2,0,0,0,0|0,0,1]=4 10299 B11R1.192 CC=Cc1ccc(c(c1)Cl)O 271570a_100016259895_100012360047 [1,2,0,0,0,0|0,0,1]=4 10300 B11R1.192 CC=Cc1ccc(c(c1)F)Br 271570a_100016259895_100000685389 [1,2,0,0,0,0|0,0,1]=4 10301 B11R1.192 CC=Cc1ccc(c(c1)F)C 271570a_100016259895_100000720648 [1,2,0,0,0,0|0,0,1]=4 10302 B11R1.192 CC=Cc1ccc(c(c1)F)Cl 271570a_100016259895_100011216805 [1,2,0,0,0,0|0,0,1]=4 10303 B11R1.192 CC=Cc1ccc(c(c1)F)F 271570a_100016259895_100000750028 [1,2,0,0,0,0|0,0,1]=4 10304 B11R1.192 CC=Cc1ccc(c(c1)F)N 271570a_100016259895_100011215594 [1,2,0,0,0,0|0,0,1]=4 10305 B11R1.192 CC=Cc1ccc(c(c1)F)O 271570a_100016259895_100000185481 [1,2,0,0,0,0|0,0,1]=4 10306 B11R1.192 CC=Cc1ccc(c(c1)N)Br 271570a_100016259895_100000750456 [1,2,0,0,0,0|0,0,1]=4 10307 B11R1.192 CC=Cc1ccc(c(c1)N)C 271570a_100016259895_100000761890 [1,2,0,0,0,0|0,0,1]=4 10308 B11R1.192 CC=Cc1ccc(c(c1)N)Cl 271570a_100016259895_200000761891 [1,2,0,0,0,0|0,0,1]=4 10309 B11R1.192 CC=Cc1ccc(c(c1)N)F 271570a_100016259895_100000740924 [1,2,0,0,0,0|0,0,1]=4 10310 B11R1.192 CC=Cc1ccc(c(c1)N)N 271570a_100016259895_100000741789 [1,2,0,0,0,0|0,0,1]=4 10311 B11R1.192 CC=Cc1ccc(c(c1)N)O 271570a_100016259895_100000752626 [1,2,0,0,0,0|0,0,1]=4 10312 B11R1.192 CC=Cc1ccc(c(c1)O)Br 271570a_100016259895_100012356990 [1,2,0,0,0,0|0,0,1]=4 10313 B11R1.192 CC=Cc1ccc(c(c1)O)C 271570a_100016259895_100000766334 [1,2,0,0,0,0|0,0,1]=4 10314 B11R1.192 CC=Cc1ccc(c(c1)O)Cl 271570a_100016259895_100011356854 [1,2,0,0,0,0|0,0,1]=4 10315 B11R1.192 CC=Cc1ccc(c(c1)O)F 271570a_100016259895_100000686035 [1,2,0,0,0,0|0,0,1]=4 10316 B11R1.192 CC=Cc1ccc(c(c1)O)N 271570a_100016259895_100000739049 [1,2,0,0,0,0|0,0,1]=4 10317 B11R1.192 CC=Cc1ccc(c(c1)O)O 271570a_100016259895_100009813601 [1,2,0,0,0,0|0,0,1]=4 10318 B11R1.192 CCCc1ccc(c(c1)F)O 271570a_203496583355_200010686677 [1,2,0,0,0,0|0,0,1]=4 10319 B11R1.192 CNCc1ccc(c(c1)Br)Br 207a_100102657272_100011215943 [1,2,0,0,0,0|1,0,0]=4 10320 B11R1.192 CNCc1ccc(c(c1)Br)Br 2230a_100012351559_200000210301 [1,2,0,0,0,0|1,0,0]=4 10321 B11R1.192 CNCc1ccc(c(c1)Br)Br 2230a_106832991635_100012353900 [1,2,0,0,0,0|1,0,0]=4 10322 B11R1.192 CNCc1ccc(c(c1)Br)Br 270004a_106832991635_100011215943 [1,2,0,0,0,0|1,0,0]=4 10323 B11R1.192 CNCc1ccc(c(c1)Br)Br 34a_100012351559_200000210301 [1,2,0,0,0,0|1,0,0]=4 10324 B11R1.192 CNCc1ccc(c(c1)Br)Br 34a_100102657272_100012353900 [1,2,0,0,0,0|1,0,0]=4 10325 B11R1.192 CNCc1ccc(c(c1)Br)Br 7a_106832991635_100012353900 [1,2,0,0,0,0|1,0,0]=4 10326 B11R1.192 CNCc1ccc(c(c1)Br)C 207a_100102657272_100000695567 [1,2,0,0,0,0|1,0,0]=4 10327 B11R1.192 CNCc1ccc(c(c1)Br)C 2230a_106832991635_100012232412 [1,2,0,0,0,0|1,0,0]=4 10328 B11R1.192 CNCc1ccc(c(c1)Br)C 26a_100102657272_100011380479 [1,2,0,0,0,0|1,0,0]=4 10329 B11R1.192 CNCc1ccc(c(c1)Br)C 270004a_106832991635_100000695567 [1,2,0,0,0,0|1,0,0]=4 10330 B11R1.192 CNCc1ccc(c(c1)Br)C 34a_100102657272_100012232412 [1,2,0,0,0,0|1,0,0]=4 10331 B11R1.192 CNCc1ccc(c(c1)Br)C 7a_106832991635_100012232412 [1,2,0,0,0,0|1,0,0]=4 10332 B11R1.192 CNCc1ccc(c(c1)Br)Cl 207a_100102657272_100000693810 [1,2,0,0,0,0|1,0,0]=4 10333 B11R1.192 CNCc1ccc(c(c1)Br)Cl 2230a_100012349490_200000210301 [1,2,0,0,0,0|1,0,0]=4 10334 B11R1.192 CNCc1ccc(c(c1)Br)Cl 2230a_106832991635_100012353894 [1,2,0,0,0,0|1,0,0]=4 10335 B11R1.192 CNCc1ccc(c(c1)Br)Cl 26a_100102657272_100011933957 [1,2,0,0,0,0|1,0,0]=4 10336 B11R1.192 CNCc1ccc(c(c1)Br)Cl 270004a_106832991635_100000693810 [1,2,0,0,0,0|1,0,0]=4 10337 B11R1.192 CNCc1ccc(c(c1)Br)Cl 34a_100012349490_200000210301 [1,2,0,0,0,0|1,0,0]=4 10338 B11R1.192 CNCc1ccc(c(c1)Br)Cl 34a_100102657272_100012353894 [1,2,0,0,0,0|1,0,0]=4 10339 B11R1.192 CNCc1ccc(c(c1)Br)Cl 7a_106832991635_100012353894 [1,2,0,0,0,0|1,0,0]=4 10340 B11R1.192 CNCc1ccc(c(c1)Br)F 207a_100102657272_100000211747 [1,2,0,0,0,0|1,0,0]=4 10341 B11R1.192 CNCc1ccc(c(c1)Br)F 2230a_100015193890_200000210301 [1,2,0,0,0,0|1,0,0]=4 10342 B11R1.192 CNCc1ccc(c(c1)Br)F 2230a_106832991635_100011206884 [1,2,0,0,0,0|1,0,0]=4 10343 B11R1.192 CNCc1ccc(c(c1)Br)F 26a_100102657272_100000693481 [1,2,0,0,0,0|1,0,0]=4 10344 B11R1.192 CNCc1ccc(c(c1)Br)F 270004a_106832991635_100000211747 [1,2,0,0,0,0|1,0,0]=4 10345 B11R1.192 CNCc1ccc(c(c1)Br)F 34a_100015193890_200000210301 [1,2,0,0,0,0|1,0,0]=4 10346 B11R1.192 CNCc1ccc(c(c1)Br)F 34a_100102657272_100011206884 [1,2,0,0,0,0|1,0,0]=4 10347 B11R1.192 CNCc1ccc(c(c1)Br)F 7a_106832991635_100011206884 [1,2,0,0,0,0|1,0,0]=4 10348 B11R1.192 CNCc1ccc(c(c1)Br)I 26a_100102657272_100000701344 [1,2,0,0,0,0|1,0,0]=4 10349 B11R1.192 CNCc1ccc(c(c1)C)Br 207a_100102657272_100000765772 [1,2,0,0,0,0|1,0,0]=4 10350 B11R1.192 CNCc1ccc(c(c1)C)Br 2230a_100015205234_200000210301 [1,2,0,0,0,0|1,0,0]=4 10351 B11R1.192 CNCc1ccc(c(c1)C)Br 2230a_106832991635_100000727479 [1,2,0,0,0,0|1,0,0]=4 10352 B11R1.192 CNCc1ccc(c(c1)C)Br 26a_100102657272_100000690111 [1,2,0,0,0,0|1,0,0]=4 10353 B11R1.192 CNCc1ccc(c(c1)C)Br 270004a_106832991635_100000765772 [1,2,0,0,0,0|1,0,0]=4 10354 B11R1.192 CNCc1ccc(c(c1)C)Br 34a_100015205234_200000210301 [1,2,0,0,0,0|1,0,0]=4 10355 B11R1.192 CNCc1ccc(c(c1)C)Br 34a_100102657272_100000727479 [1,2,0,0,0,0|1,0,0]=4 10356 B11R1.192 CNCc1ccc(c(c1)C)Br 7a_106832991635_100000727479 [1,2,0,0,0,0|1,0,0]=4 10357 B11R1.192 CNCc1ccc(c(c1)C)C 207a_100102657272_100000229942 [1,2,0,0,0,0|1,0,0]=4 10358 B11R1.192 CNCc1ccc(c(c1)C)C 2230a_100025706692_200000210301 [1,2,0,0,0,0|1,0,0]=4 10359 B11R1.192 CNCc1ccc(c(c1)C)C 2230a_106832991635_100000742320 [1,2,0,0,0,0|1,0,0]=4 10360 B11R1.192 CNCc1ccc(c(c1)C)C 270004a_106832991635_100000229942 [1,2,0,0,0,0|1,0,0]=4 10361 B11R1.192 CNCc1ccc(c(c1)C)C 34a_100025706692_200000210301 [1,2,0,0,0,0|1,0,0]=4 10362 B11R1.192 CNCc1ccc(c(c1)C)C 34a_100102657272_100000742320 [1,2,0,0,0,0|1,0,0]=4 10363 B11R1.192 CNCc1ccc(c(c1)C)C 7a_106832991635_100000742320 [1,2,0,0,0,0|1,0,0]=4 10364 B11R1.192 CNCc1ccc(c(c1)C)Cl 207a_100102657272_100000698814 [1,2,0,0,0,0|1,0,0]=4 10365 B11R1.192 CNCc1ccc(c(c1)C)Cl 2230a_106832991635_100012184735 [1,2,0,0,0,0|1,0,0]=4 10366 B11R1.192 CNCc1ccc(c(c1)C)Cl 26a_100102657272_100000211092 [1,2,0,0,0,0|1,0,0]=4 10367 B11R1.192 CNCc1ccc(c(c1)C)Cl 270004a_106832991635_100000698814 [1,2,0,0,0,0|1,0,0]=4 10368 B11R1.192 CNCc1ccc(c(c1)C)Cl 34a_100102657272_100012184735 [1,2,0,0,0,0|1,0,0]=4 10369 B11R1.192 CNCc1ccc(c(c1)C)Cl 7a_106832991635_100012184735 [1,2,0,0,0,0|1,0,0]=4 10370 B11R1.192 CNCc1ccc(c(c1)C)F 207a_100102657272_100000748208 [1,2,0,0,0,0|1,0,0]=4 10371 B11R1.192 CNCc1ccc(c(c1)C)F 2230a_100000239911_200000210301 [1,2,0,0,0,0|1,0,0]=4 10372 B11R1.192 CNCc1ccc(c(c1)C)F 2230a_106832991635_100011216667 [1,2,0,0,0,0|1,0,0]=4 10373 B11R1.192 CNCc1ccc(c(c1)C)F 270004a_106832991635_100000748208 [1,2,0,0,0,0|1,0,0]=4 10374 B11R1.192 CNCc1ccc(c(c1)C)F 34a_100000239911_200000210301 [1,2,0,0,0,0|1,0,0]=4 10375 B11R1.192 CNCc1ccc(c(c1)C)F 34a_100102657272_100011216667 [1,2,0,0,0,0|1,0,0]=4 10376 B11R1.192 CNCc1ccc(c(c1)C)F 7a_106832991635_100011216667 [1,2,0,0,0,0|1,0,0]=4 10377 B11R1.192 CNCc1ccc(c(c1)Cl)Br 207a_100102657272_100000690054 [1,2,0,0,0,0|1,0,0]=4 10378 B11R1.192 CNCc1ccc(c(c1)Cl)Br 2230a_100012362553_200000210301 [1,2,0,0,0,0|1,0,0]=4 10379 B11R1.192 CNCc1ccc(c(c1)Cl)Br 2230a_106832991635_100012353895 [1,2,0,0,0,0|1,0,0]=4 10380 B11R1.192 CNCc1ccc(c(c1)Cl)Br 26a_100102657272_100011215161 [1,2,0,0,0,0|1,0,0]=4 10381 B11R1.192 CNCc1ccc(c(c1)Cl)Br 270004a_106832991635_100000690054 [1,2,0,0,0,0|1,0,0]=4 10382 B11R1.192 CNCc1ccc(c(c1)Cl)Br 34a_100012362553_200000210301 [1,2,0,0,0,0|1,0,0]=4 10383 B11R1.192 CNCc1ccc(c(c1)Cl)Br 34a_100102657272_100012353895 [1,2,0,0,0,0|1,0,0]=4 10384 B11R1.192 CNCc1ccc(c(c1)Cl)Br 7a_106832991635_100012353895 [1,2,0,0,0,0|1,0,0]=4 10385 B11R1.192 CNCc1ccc(c(c1)Cl)C 207a_100102657272_100000760539 [1,2,0,0,0,0|1,0,0]=4 10386 B11R1.192 CNCc1ccc(c(c1)Cl)C 2230a_102495364989_200000210301 [1,2,0,0,0,0|1,0,0]=4 10387 B11R1.192 CNCc1ccc(c(c1)Cl)C 2230a_106832991635_100011823929 [1,2,0,0,0,0|1,0,0]=4 10388 B11R1.192 CNCc1ccc(c(c1)Cl)C 26a_100102657272_100011265682 [1,2,0,0,0,0|1,0,0]=4 10389 B11R1.192 CNCc1ccc(c(c1)Cl)C 270004a_106832991635_100000760539 [1,2,0,0,0,0|1,0,0]=4 10390 B11R1.192 CNCc1ccc(c(c1)Cl)C 34a_100102657272_100011823929 [1,2,0,0,0,0|1,0,0]=4 10391 B11R1.192 CNCc1ccc(c(c1)Cl)C 34a_102495364989_200000210301 [1,2,0,0,0,0|1,0,0]=4 10392 B11R1.192 CNCc1ccc(c(c1)Cl)C 7a_106832991635_100011823929 [1,2,0,0,0,0|1,0,0]=4 10393 B11R1.192 CNCc1ccc(c(c1)Cl)Cl 207a_100102657272_100000188533 [1,2,0,0,0,0|1,0,0]=4 10394 B11R1.192 CNCc1ccc(c(c1)Cl)Cl 2230a_100000174881_200000210301 [1,2,0,0,0,0|1,0,0]=4 10395 B11R1.192 CNCc1ccc(c(c1)Cl)Cl 2230a_106832991635_100000184707 [1,2,0,0,0,0|1,0,0]=4 10396 B11R1.192 CNCc1ccc(c(c1)Cl)Cl 26a_100102657272_100000211054 [1,2,0,0,0,0|1,0,0]=4 10397 B11R1.192 CNCc1ccc(c(c1)Cl)Cl 270004a_106832991635_100000188533 [1,2,0,0,0,0|1,0,0]=4 10398 B11R1.192 CNCc1ccc(c(c1)Cl)Cl 34a_100000174881_200000210301 [1,2,0,0,0,0|1,0,0]=4 10399 B11R1.192 CNCc1ccc(c(c1)Cl)Cl 34a_100102657272_100000184707 [1,2,0,0,0,0|1,0,0]=4 10400 B11R1.192 CNCc1ccc(c(c1)Cl)Cl 7a_106832991635_100000184707 [1,2,0,0,0,0|1,0,0]=4 10401 B11R1.192 CNCc1ccc(c(c1)Cl)F 207a_100102657272_100000742290 [1,2,0,0,0,0|1,0,0]=4 10402 B11R1.192 CNCc1ccc(c(c1)Cl)F 2230a_100000749334_200000210301 [1,2,0,0,0,0|1,0,0]=4 10403 B11R1.192 CNCc1ccc(c(c1)Cl)F 2230a_106832991635_100000717365 [1,2,0,0,0,0|1,0,0]=4 10404 B11R1.192 CNCc1ccc(c(c1)Cl)F 26a_100102657272_100000211030 [1,2,0,0,0,0|1,0,0]=4 10405 B11R1.192 CNCc1ccc(c(c1)Cl)F 270004a_106832991635_100000742290 [1,2,0,0,0,0|1,0,0]=4 10406 B11R1.192 CNCc1ccc(c(c1)Cl)F 34a_100000749334_200000210301 [1,2,0,0,0,0|1,0,0]=4 10407 B11R1.192 CNCc1ccc(c(c1)Cl)F 34a_100102657272_100011934319 [1,2,0,0,0,0|1,0,0]=4 10408 B11R1.192 CNCc1ccc(c(c1)Cl)F 7a_106832991635_100000717365 [1,2,0,0,0,0|1,0,0]=4 10409 B11R1.192 CNCc1ccc(c(c1)Cl)I 2230a_106832991635_100012349665 [1,2,0,0,0,0|1,0,0]=4 10410 B11R1.192 CNCc1ccc(c(c1)Cl)I 26a_100102657272_100000047559 [1,2,0,0,0,0|1,0,0]=4 10411 B11R1.192 CNCc1ccc(c(c1)Cl)I 34a_100102657272_100012349665 [1,2,0,0,0,0|1,0,0]=4 10412 B11R1.192 CNCc1ccc(c(c1)Cl)I 7a_106832991635_100012349665 [1,2,0,0,0,0|1,0,0]=4 10413 B11R1.192 CNCc1ccc(c(c1)F)Br 207a_100102657272_100000686674 [1,2,0,0,0,0|1,0,0]=4 10414 B11R1.192 CNCc1ccc(c(c1)F)Br 2230a_100000755036_200000210301 [1,2,0,0,0,0|1,0,0]=4 10415 B11R1.192 CNCc1ccc(c(c1)F)Br 2230a_106832991635_100000767054 [1,2,0,0,0,0|1,0,0]=4 10416 B11R1.192 CNCc1ccc(c(c1)F)Br 26a_100102657272_100000755031 [1,2,0,0,0,0|1,0,0]=4 10417 B11R1.192 CNCc1ccc(c(c1)F)Br 270004a_106832991635_100000686674 [1,2,0,0,0,0|1,0,0]=4 10418 B11R1.192 CNCc1ccc(c(c1)F)Br 34a_100000755036_200000210301 [1,2,0,0,0,0|1,0,0]=4 10419 B11R1.192 CNCc1ccc(c(c1)F)Br 34a_100102657272_100000767054 [1,2,0,0,0,0|1,0,0]=4 10420 B11R1.192 CNCc1ccc(c(c1)F)Br 7a_106832991635_100000767054 [1,2,0,0,0,0|1,0,0]=4 10421 B11R1.192 CNCc1ccc(c(c1)F)C 207a_100102657272_100000753222 [1,2,0,0,0,0|1,0,0]=4 10422 B11R1.192 CNCc1ccc(c(c1)F)C 2230a_100102708794_200000210301 [1,2,0,0,0,0|1,0,0]=4 10423 B11R1.192 CNCc1ccc(c(c1)F)C 2230a_106832991635_100011217369 [1,2,0,0,0,0|1,0,0]=4 10424 B11R1.192 CNCc1ccc(c(c1)F)C 270004a_106832991635_100000753222 [1,2,0,0,0,0|1,0,0]=4 10425 B11R1.192 CNCc1ccc(c(c1)F)C 34a_100102657272_100011217369 [1,2,0,0,0,0|1,0,0]=4 10426 B11R1.192 CNCc1ccc(c(c1)F)C 34a_100102708794_200000210301 [1,2,0,0,0,0|1,0,0]=4 10427 B11R1.192 CNCc1ccc(c(c1)F)C 7a_106832991635_100011217369 [1,2,0,0,0,0|1,0,0]=4 10428 B11R1.192 CNCc1ccc(c(c1)F)Cl 207a_100102657272_100000745630 [1,2,0,0,0,0|1,0,0]=4 10429 B11R1.192 CNCc1ccc(c(c1)F)Cl 2230a_100011219866_200000210301 [1,2,0,0,0,0|1,0,0]=4 10430 B11R1.192 CNCc1ccc(c(c1)F)Cl 2230a_106832991635_100000716492 [1,2,0,0,0,0|1,0,0]=4 10431 B11R1.192 CNCc1ccc(c(c1)F)Cl 26a_100102657272_100000691581 [1,2,0,0,0,0|1,0,0]=4 10432 B11R1.192 CNCc1ccc(c(c1)F)Cl 270004a_106832991635_100000745630 [1,2,0,0,0,0|1,0,0]=4 10433 B11R1.192 CNCc1ccc(c(c1)F)Cl 34a_100011219866_200000210301 [1,2,0,0,0,0|1,0,0]=4 10434 B11R1.192 CNCc1ccc(c(c1)F)Cl 34a_100102657272_100011519011 [1,2,0,0,0,0|1,0,0]=4 10435 B11R1.192 CNCc1ccc(c(c1)F)Cl 7a_106832991635_100000716492 [1,2,0,0,0,0|1,0,0]=4 10436 B11R1.192 CNCc1ccc(c(c1)F)F 207a_100102657272_100000211062 [1,2,0,0,0,0|1,0,0]=4 10437 B11R1.192 CNCc1ccc(c(c1)F)F 2230a_100000737897_200000210301 [1,2,0,0,0,0|1,0,0]=4 10438 B11R1.192 CNCc1ccc(c(c1)F)F 2230a_106832991635_100000757363 [1,2,0,0,0,0|1,0,0]=4 10439 B11R1.192 CNCc1ccc(c(c1)F)F 270004a_106832991635_100000211062 [1,2,0,0,0,0|1,0,0]=4 10440 B11R1.192 CNCc1ccc(c(c1)F)F 34a_100000737897_200000210301 [1,2,0,0,0,0|1,0,0]=4 10441 B11R1.192 CNCc1ccc(c(c1)F)F 34a_100102657272_100000757363 [1,2,0,0,0,0|1,0,0]=4 10442 B11R1.192 CNCc1ccc(c(c1)F)F 7a_106832991635_100000757363 [1,2,0,0,0,0|1,0,0]=4 10443 B11R1.192 CNCc1ccc(c(c1)F)I 207a_100102657272_100000050832 [1,2,0,0,0,0|1,0,0]=4 10444 B11R1.192 CNCc1ccc(c(c1)F)I 2230a_106832991635_100010149604 [1,2,0,0,0,0|1,0,0]=4 10445 B11R1.192 CNCc1ccc(c(c1)F)I 270004a_106832991635_100000050832 [1,2,0,0,0,0|1,0,0]=4 10446 B11R1.192 CNCc1ccc(c(c1)F)I 34a_100102657272_100010149604 [1,2,0,0,0,0|1,0,0]=4 10447 B11R1.192 CNCc1ccc(c(c1)F)I 7a_106832991635_100010149604 [1,2,0,0,0,0|1,0,0]=4 10448 B11R1.192 CNCc1ccc(c(c1)F)O 34a_100000758358_200000210301 [1,2,0,0,0,0|1,0,0]=4 10449 B11R1.192 CNCc1ccc(c(c1)I)Br 207a_100102657272_100010146563 [1,2,0,0,0,0|1,0,0]=4 10450 B11R1.192 CNCc1ccc(c(c1)I)Br 2230a_106832991635_100010146616 [1,2,0,0,0,0|1,0,0]=4 10451 B11R1.192 CNCc1ccc(c(c1)I)Br 26a_100102657272_100012339312 [1,2,0,0,0,0|1,0,0]=4 10452 B11R1.192 CNCc1ccc(c(c1)I)Br 270004a_106832991635_100010146563 [1,2,0,0,0,0|1,0,0]=4 10453 B11R1.192 CNCc1ccc(c(c1)I)Br 34a_100102657272_100010146616 [1,2,0,0,0,0|1,0,0]=4 10454 B11R1.192 CNCc1ccc(c(c1)I)Br 7a_106832991635_100010146616 [1,2,0,0,0,0|1,0,0]=4 10455 B11R1.192 CNCc1ccc(c(c1)I)C 207a_100102657272_100010197721 [1,2,0,0,0,0|1,0,0]=4 10456 B11R1.192 CNCc1ccc(c(c1)I)C 2230a_106832991635_100010206137 [1,2,0,0,0,0|1,0,0]=4 10457 B11R1.192 CNCc1ccc(c(c1)I)C 270004a_106832991635_100010197721 [1,2,0,0,0,0|1,0,0]=4 10458 B11R1.192 CNCc1ccc(c(c1)I)C 34a_100102657272_100010206137 [1,2,0,0,0,0|1,0,0]=4 10459 B11R1.192 CNCc1ccc(c(c1)I)C 7a_106832991635_100010206137 [1,2,0,0,0,0|1,0,0]=4 10460 B11R1.192 CNCc1ccc(c(c1)I)Cl 207a_100102657272_100010209939 [1,2,0,0,0,0|1,0,0]=4 10461 B11R1.192 CNCc1ccc(c(c1)I)Cl 26a_100102657272_100000049588 [1,2,0,0,0,0|1,0,0]=4 10462 B11R1.192 CNCc1ccc(c(c1)I)Cl 270004a_106832991635_100010209939 [1,2,0,0,0,0|1,0,0]=4 10463 B11R1.192 CNCc1ccc(c(c1)I)F 207a_100102657272_100010188209 [1,2,0,0,0,0|1,0,0]=4 10464 B11R1.192 CNCc1ccc(c(c1)I)F 2230a_106832991635_100010188208 [1,2,0,0,0,0|1,0,0]=4 10465 B11R1.192 CNCc1ccc(c(c1)I)F 270004a_106832991635_100010188209 [1,2,0,0,0,0|1,0,0]=4 10466 B11R1.192 CNCc1ccc(c(c1)I)F 34a_100102657272_100010188208 [1,2,0,0,0,0|1,0,0]=4 10467 B11R1.192 CNCc1ccc(c(c1)I)F 7a_106832991635_100010188208 [1,2,0,0,0,0|1,0,0]=4 10468 B11R1.192 CNCc1ccc(c(c1)O)Cl 34a_100020636435_200000210301 [1,2,0,0,0,0|1,0,0]=4 10469 B11R1.192 CNCc1ccc(c(c1)O)F 34a_100160469508_200000210301 [1,2,0,0,0,0|1,0,0]=4 10470 B11R1.192 CNCc1ccc(c(c1)O)O 34a_100000010075_200000210301 [1,2,0,0,0,0|1,0,0]=4 10471 B11R1.192 COCc1ccc(c(c1)Br)Br 34a_100138415774_100012353900 [1,2,0,0,0,0|1,0,0]=4 10472 B11R1.192 COCc1ccc(c(c1)Br)C 34a_100000708995_200000210301 [1,2,0,0,0,0|1,0,0]=4 10473 B11R1.192 COCc1ccc(c(c1)Br)C 34a_100138415774_100012232412 [1,2,0,0,0,0|1,0,0]=4 10474 B11R1.192 COCc1ccc(c(c1)Br)C 7a_100000708995_200000210301 [1,2,0,0,0,0|1,0,0]=4 10475 B11R1.192 COCc1ccc(c(c1)Br)Cl 34a_100012353893_200000210301 [1,2,0,0,0,0|1,0,0]=4 10476 B11R1.192 COCc1ccc(c(c1)Br)Cl 34a_100138415774_100012353894 [1,2,0,0,0,0|1,0,0]=4 10477 B11R1.192 COCc1ccc(c(c1)Br)Cl 7a_100012353893_200000210301 [1,2,0,0,0,0|1,0,0]=4 10478 B11R1.192 COCc1ccc(c(c1)Br)F 34a_100000246287_200000210301 [1,2,0,0,0,0|1,0,0]=4 10479 B11R1.192 COCc1ccc(c(c1)Br)F 34a_100138415774_100011206884 [1,2,0,0,0,0|1,0,0]=4 10480 B11R1.192 COCc1ccc(c(c1)Br)F 7a_100000246287_200000210301 [1,2,0,0,0,0|1,0,0]=4 10481 B11R1.192 COCc1ccc(c(c1)C)Br 34a_100000718852_200000210301 [1,2,0,0,0,0|1,0,0]=4 10482 B11R1.192 COCc1ccc(c(c1)C)Br 34a_100138415774_100000727479 [1,2,0,0,0,0|1,0,0]=4 10483 B11R1.192 COCc1ccc(c(c1)C)Br 7a_100000718852_200000210301 [1,2,0,0,0,0|1,0,0]=4 10484 B11R1.192 COCc1ccc(c(c1)C)C 34a_100011215342_200000210301 [1,2,0,0,0,0|1,0,0]=4 10485 B11R1.192 COCc1ccc(c(c1)C)C 34a_100138415774_100000742320 [1,2,0,0,0,0|1,0,0]=4 10486 B11R1.192 COCc1ccc(c(c1)C)C 7a_100011215342_200000210301 [1,2,0,0,0,0|1,0,0]=4 10487 B11R1.192 COCc1ccc(c(c1)C)Cl 34a_100138415774_100012184735 [1,2,0,0,0,0|1,0,0]=4 10488 B11R1.192 COCc1ccc(c(c1)C)F 34a_100011219793_200000210301 [1,2,0,0,0,0|1,0,0]=4 10489 B11R1.192 COCc1ccc(c(c1)C)F 34a_100138415774_100011216667 [1,2,0,0,0,0|1,0,0]=4 10490 B11R1.192 COCc1ccc(c(c1)C)F 7a_100011219793_200000210301 [1,2,0,0,0,0|1,0,0]=4 10491 B11R1.192 COCc1ccc(c(c1)C)N 34a_200011997030_200000210301 [1,2,0,0,0,0|1,0,0]=4 10492 B11R1.192 COCc1ccc(c(c1)Cl)Br 34a_100000709168_200000210301 [1,2,0,0,0,0|1,0,0]=4 10493 B11R1.192 COCc1ccc(c(c1)Cl)Br 34a_100138415774_100012353895 [1,2,0,0,0,0|1,0,0]=4 10494 B11R1.192 COCc1ccc(c(c1)Cl)Br 7a_100000709168_200000210301 [1,2,0,0,0,0|1,0,0]=4 10495 B11R1.192 COCc1ccc(c(c1)Cl)C 34a_100011290783_200000210301 [1,2,0,0,0,0|1,0,0]=4 10496 B11R1.192 COCc1ccc(c(c1)Cl)C 34a_100138415774_100011823929 [1,2,0,0,0,0|1,0,0]=4 10497 B11R1.192 COCc1ccc(c(c1)Cl)C 7a_100011290783_200000210301 [1,2,0,0,0,0|1,0,0]=4 10498 B11R1.192 COCc1ccc(c(c1)Cl)Cl 34a_100000211588_200000210301 [1,2,0,0,0,0|1,0,0]=4 10499 B11R1.192 COCc1ccc(c(c1)Cl)Cl 34a_100138415774_100000184707 [1,2,0,0,0,0|1,0,0]=4 10500 B11R1.192 COCc1ccc(c(c1)Cl)Cl 7a_100000211588_200000210301 [1,2,0,0,0,0|1,0,0]=4 10501 B11R1.192 COCc1ccc(c(c1)Cl)F 34a_100011217911_200000210301 [1,2,0,0,0,0|1,0,0]=4 10502 B11R1.192 COCc1ccc(c(c1)Cl)F 34a_100138415774_100011934319 [1,2,0,0,0,0|1,0,0]=4 10503 B11R1.192 COCc1ccc(c(c1)Cl)F 7a_100011217911_200000210301 [1,2,0,0,0,0|1,0,0]=4 10504 B11R1.192 COCc1ccc(c(c1)Cl)I 34a_100000718186_200000210301 [1,2,0,0,0,0|1,0,0]=4 10505 B11R1.192 COCc1ccc(c(c1)Cl)I 34a_100138415774_100012349665 [1,2,0,0,0,0|1,0,0]=4 10506 B11R1.192 COCc1ccc(c(c1)Cl)I 7a_100000718186_200000210301 [1,2,0,0,0,0|1,0,0]=4 10507 B11R1.192 COCc1ccc(c(c1)F)Br 34a_100011533735_200000210301 [1,2,0,0,0,0|1,0,0]=4 10508 B11R1.192 COCc1ccc(c(c1)F)Br 34a_100138415774_100000767054 [1,2,0,0,0,0|1,0,0]=4 10509 B11R1.192 COCc1ccc(c(c1)F)Br 7a_100011533735_200000210301 [1,2,0,0,0,0|1,0,0]=4 10510 B11R1.192 COCc1ccc(c(c1)F)C 34a_100000702247_200000210301 [1,2,0,0,0,0|1,0,0]=4 10511 B11R1.192 COCc1ccc(c(c1)F)C 34a_100138415774_100011217369 [1,2,0,0,0,0|1,0,0]=4 10512 B11R1.192 COCc1ccc(c(c1)F)C 7a_100000702247_200000210301 [1,2,0,0,0,0|1,0,0]=4 10513 B11R1.192 COCc1ccc(c(c1)F)Cl 34a_100011218299_200000210301 [1,2,0,0,0,0|1,0,0]=4 10514 B11R1.192 COCc1ccc(c(c1)F)Cl 34a_100138415774_100011519011 [1,2,0,0,0,0|1,0,0]=4 10515 B11R1.192 COCc1ccc(c(c1)F)Cl 7a_100011218299_200000210301 [1,2,0,0,0,0|1,0,0]=4 10516 B11R1.192 COCc1ccc(c(c1)F)F 34a_100011215442_200000210301 [1,2,0,0,0,0|1,0,0]=4 10517 B11R1.192 COCc1ccc(c(c1)F)F 34a_100138415774_100000757363 [1,2,0,0,0,0|1,0,0]=4 10518 B11R1.192 COCc1ccc(c(c1)F)F 7a_100011215442_200000210301 [1,2,0,0,0,0|1,0,0]=4 10519 B11R1.192 COCc1ccc(c(c1)F)I 34a_100010149597_200000210301 [1,2,0,0,0,0|1,0,0]=4 10520 B11R1.192 COCc1ccc(c(c1)F)I 34a_100138415774_100010149604 [1,2,0,0,0,0|1,0,0]=4 10521 B11R1.192 COCc1ccc(c(c1)F)I 7a_100010149597_200000210301 [1,2,0,0,0,0|1,0,0]=4 10522 B11R1.192 COCc1ccc(c(c1)F)N 34a_100011217239_200000210301 [1,2,0,0,0,0|1,0,0]=4 10523 B11R1.192 COCc1ccc(c(c1)F)O 271570a_203496583355_100010177442 [1,2,0,0,0,0|1,0,0]=4 10524 B11R1.192 COCc1ccc(c(c1)I)Br 34a_100138415774_100010146616 [1,2,0,0,0,0|1,0,0]=4 10525 B11R1.192 COCc1ccc(c(c1)I)C 34a_100000050133_200000210301 [1,2,0,0,0,0|1,0,0]=4 10526 B11R1.192 COCc1ccc(c(c1)I)C 34a_100138415774_100010206137 [1,2,0,0,0,0|1,0,0]=4 10527 B11R1.192 COCc1ccc(c(c1)I)C 7a_100000050133_200000210301 [1,2,0,0,0,0|1,0,0]=4 10528 B11R1.192 COCc1ccc(c(c1)I)F 34a_100000049585_200000210301 [1,2,0,0,0,0|1,0,0]=4 10529 B11R1.192 COCc1ccc(c(c1)I)F 34a_100138415774_100010188208 [1,2,0,0,0,0|1,0,0]=4 10530 B11R1.192 COCc1ccc(c(c1)I)F 7a_100000049585_200000210301 [1,2,0,0,0,0|1,0,0]=4 10531 B11R1.192 COCc1ccc(c(c1)N)Br 34a_100012347568_200000210301 [1,2,0,0,0,0|1,0,0]=4 10532 B11R1.192 COCc1ccc(c(c1)N)C 34a_100000758420_200000210301 [1,2,0,0,0,0|1,0,0]=4 10533 B11R1.192 COCc1ccc(c(c1)N)Cl 34a_106256033963_200000210301 [1,2,0,0,0,0|1,0,0]=4 10534 B11R1.192 COCc1ccc(c(c1)N)F 34a_102125399562_200000210301 [1,2,0,0,0,0|1,0,0]=4 10535 B11R1.192 COCc1ccc(c(c1)N)O 271570a_203496583355_200013033220 [1,2,0,0,0,0|1,0,0]=4 10536 B11R1.192 COCc1ccc(c(c1)O)C 271570a_203496583355_200015395492 [1,2,0,0,0,0|1,0,0]=4 10537 B11R1.192 COCc1ccc(c(c1)O)F 271570a_203496583355_200011493689 [1,2,0,0,0,0|1,0,0]=4 10538 B11R1.192 CSCc1ccc(c(c1)Br)Br 62a_100012353900_200000210301 [1,2,0,0,0,0|1,0,0]=4 10539 B11R1.192 CSCc1ccc(c(c1)Br)Br 62a_200000210301_100012353900 [1,2,0,0,0,0|1,0,0]=4 10540 B11R1.192 CSCc1ccc(c(c1)Br)C 62a_100012232412_200000210301 [1,2,0,0,0,0|1,0,0]=4 10541 B11R1.192 CSCc1ccc(c(c1)Br)C 62a_200000210301_100012232412 [1,2,0,0,0,0|1,0,0]=4 10542 B11R1.192 CSCc1ccc(c(c1)Br)Cl 62a_100012353894_200000210301 [1,2,0,0,0,0|1,0,0]=4 10543 B11R1.192 CSCc1ccc(c(c1)Br)Cl 62a_200000210301_100012353894 [1,2,0,0,0,0|1,0,0]=4 10544 B11R1.192 CSCc1ccc(c(c1)Br)F 62a_100011206884_200000210301 [1,2,0,0,0,0|1,0,0]=4 10545 B11R1.192 CSCc1ccc(c(c1)Br)F 62a_200000210301_100011206884 [1,2,0,0,0,0|1,0,0]=4 10546 B11R1.192 CSCc1ccc(c(c1)C)Br 62a_100000727479_200000210301 [1,2,0,0,0,0|1,0,0]=4 10547 B11R1.192 CSCc1ccc(c(c1)C)Br 62a_200000210301_100000727479 [1,2,0,0,0,0|1,0,0]=4 10548 B11R1.192 CSCc1ccc(c(c1)C)C 62a_100000742320_200000210301 [1,2,0,0,0,0|1,0,0]=4 10549 B11R1.192 CSCc1ccc(c(c1)C)C 62a_200000210301_100000742320 [1,2,0,0,0,0|1,0,0]=4 10550 B11R1.192 CSCc1ccc(c(c1)C)Cl 62a_100012184735_200000210301 [1,2,0,0,0,0|1,0,0]=4 10551 B11R1.192 CSCc1ccc(c(c1)C)Cl 62a_200000210301_100012184735 [1,2,0,0,0,0|1,0,0]=4 10552 B11R1.192 CSCc1ccc(c(c1)C)F 62a_100011216667_200000210301 [1,2,0,0,0,0|1,0,0]=4 10553 B11R1.192 CSCc1ccc(c(c1)C)F 62a_200000210301_100011216667 [1,2,0,0,0,0|1,0,0]=4 10554 B11R1.192 CSCc1ccc(c(c1)Cl)Br 62a_100012353895_200000210301 [1,2,0,0,0,0|1,0,0]=4 10555 B11R1.192 CSCc1ccc(c(c1)Cl)Br 62a_200000210301_100012353895 [1,2,0,0,0,0|1,0,0]=4 10556 B11R1.192 CSCc1ccc(c(c1)Cl)C 62a_100011823929_200000210301 [1,2,0,0,0,0|1,0,0]=4 10557 B11R1.192 CSCc1ccc(c(c1)Cl)C 62a_200000210301_100011823929 [1,2,0,0,0,0|1,0,0]=4 10558 B11R1.192 CSCc1ccc(c(c1)Cl)Cl 62a_100000184707_200000210301 [1,2,0,0,0,0|1,0,0]=4 10559 B11R1.192 CSCc1ccc(c(c1)Cl)Cl 62a_200000210301_100000184707 [1,2,0,0,0,0|1,0,0]=4 10560 B11R1.192 CSCc1ccc(c(c1)Cl)F 62a_100000717365_200000210301 [1,2,0,0,0,0|1,0,0]=4 10561 B11R1.192 CSCc1ccc(c(c1)Cl)F 62a_200000210301_100011934319 [1,2,0,0,0,0|1,0,0]=4 10562 B11R1.192 CSCc1ccc(c(c1)Cl)I 62a_100012349665_200000210301 [1,2,0,0,0,0|1,0,0]=4 10563 B11R1.192 CSCc1ccc(c(c1)Cl)I 62a_200000210301_100012349665 [1,2,0,0,0,0|1,0,0]=4 10564 B11R1.192 CSCc1ccc(c(c1)F)Br 62a_100000767054_200000210301 [1,2,0,0,0,0|1,0,0]=4 10565 B11R1.192 CSCc1ccc(c(c1)F)Br 62a_200000210301_100000767054 [1,2,0,0,0,0|1,0,0]=4 10566 B11R1.192 CSCc1ccc(c(c1)F)C 62a_100011217369_200000210301 [1,2,0,0,0,0|1,0,0]=4 10567 B11R1.192 CSCc1ccc(c(c1)F)C 62a_200000210301_100011217369 [1,2,0,0,0,0|1,0,0]=4 10568 B11R1.192 CSCc1ccc(c(c1)F)Cl 62a_100000716492_200000210301 [1,2,0,0,0,0|1,0,0]=4 10569 B11R1.192 CSCc1ccc(c(c1)F)Cl 62a_200000210301_100000716492 [1,2,0,0,0,0|1,0,0]=4 10570 B11R1.192 CSCc1ccc(c(c1)F)F 62a_100000757363_200000210301 [1,2,0,0,0,0|1,0,0]=4 10571 B11R1.192 CSCc1ccc(c(c1)F)F 62a_200000210301_100000757363 [1,2,0,0,0,0|1,0,0]=4 10572 B11R1.192 CSCc1ccc(c(c1)F)I 62a_100010149604_200000210301 [1,2,0,0,0,0|1,0,0]=4 10573 B11R1.192 CSCc1ccc(c(c1)F)I 62a_200000210301_100010149604 [1,2,0,0,0,0|1,0,0]=4 10574 B11R1.192 CSCc1ccc(c(c1)I)Br 62a_100010146616_200000210301 [1,2,0,0,0,0|1,0,0]=4 10575 B11R1.192 CSCc1ccc(c(c1)I)Br 62a_200000210301_100010146616 [1,2,0,0,0,0|1,0,0]=4 10576 B11R1.192 CSCc1ccc(c(c1)I)C 62a_100010206137_200000210301 [1,2,0,0,0,0|1,0,0]=4 10577 B11R1.192 CSCc1ccc(c(c1)I)C 62a_200000210301_100010206137 [1,2,0,0,0,0|1,0,0]=4 10578 B11R1.192 CSCc1ccc(c(c1)I)F 62a_100010188208_200000210301 [1,2,0,0,0,0|1,0,0]=4 10579 B11R1.192 CSCc1ccc(c(c1)I)F 62a_200000210301_100010188208 [1,2,0,0,0,0|1,0,0]=4 10580 B11R1.192 Cc1cc(ccc1Br)CN[13CH3] 2230a_100015205234_200025704644 [1,2,0,0,0,0|1,0,0]=4 10581 B11R1.192 Cc1cc(ccc1Br)CN[13CH3] 34a_100015205234_200025704644 [1,2,0,0,0,0|1,0,0]=4 10582 B11R1.192 Cc1cc(ccc1Br)CO[13CH3] 34a_100000718852_200025704644 [1,2,0,0,0,0|1,0,0]=4 10583 B11R1.192 Cc1cc(ccc1Br)CO[13CH3] 7a_100000718852_200025704644 [1,2,0,0,0,0|1,0,0]=4 10584 B11R1.192 Cc1cc(ccc1Br)CS[13CH3] 62a_100000727479_200025704644 [1,2,0,0,0,0|1,0,0]=4 10585 B11R1.192 Cc1cc(ccc1Br)CS[13CH3] 62a_200025704644_100000727479 [1,2,0,0,0,0|1,0,0]=4 10586 B11R1.192 Cc1cc(ccc1Cl)CS[13CH3] 62a_100012184735_200025704644 [1,2,0,0,0,0|1,0,0]=4 10587 B11R1.192 Cc1cc(ccc1Cl)CS[13CH3] 62a_200025704644_100012184735 [1,2,0,0,0,0|1,0,0]=4 10588 B11R1.192 Cc1cc(ccc1F)CN[13CH3] 2230a_100000239911_200025704644 [1,2,0,0,0,0|1,0,0]=4 10589 B11R1.192 Cc1cc(ccc1F)CN[13CH3] 34a_100000239911_200025704644 [1,2,0,0,0,0|1,0,0]=4 10590 B11R1.192 Cc1cc(ccc1F)CO[13CH3] 34a_100011219793_200025704644 [1,2,0,0,0,0|1,0,0]=4 10591 B11R1.192 Cc1cc(ccc1F)CO[13CH3] 7a_100011219793_200025704644 [1,2,0,0,0,0|1,0,0]=4 10592 B11R1.192 Cc1cc(ccc1F)CS[13CH3] 62a_100011216667_200025704644 [1,2,0,0,0,0|1,0,0]=4 10593 B11R1.192 Cc1cc(ccc1F)CS[13CH3] 62a_200025704644_100011216667 [1,2,0,0,0,0|1,0,0]=4 10594 B11R1.192 Cc1cc(ccc1N)CO[13CH3] 34a_200011997030_200025704644 [1,2,0,0,0,0|1,0,0]=4 10595 B11R1.192 Cc1ccc(cc1Br)CO[13CH3] 34a_100000708995_200025704644 [1,2,0,0,0,0|1,0,0]=4 10596 B11R1.192 Cc1ccc(cc1Br)CO[13CH3] 7a_100000708995_200025704644 [1,2,0,0,0,0|1,0,0]=4 10597 B11R1.192 Cc1ccc(cc1Br)CS[13CH3] 62a_100012232412_200025704644 [1,2,0,0,0,0|1,0,0]=4 10598 B11R1.192 Cc1ccc(cc1Br)CS[13CH3] 62a_200025704644_100012232412 [1,2,0,0,0,0|1,0,0]=4 10599 B11R1.192 Cc1ccc(cc1C)CN[13CH3] 2230a_100025706692_200025704644 [1,2,0,0,0,0|1,0,0]=4 10600 B11R1.192 Cc1ccc(cc1C)CN[13CH3] 34a_100025706692_200025704644 [1,2,0,0,0,0|1,0,0]=4 10601 B11R1.192 Cc1ccc(cc1C)CO[13CH3] 34a_100011215342_200025704644 [1,2,0,0,0,0|1,0,0]=4 10602 B11R1.192 Cc1ccc(cc1C)CO[13CH3] 7a_100011215342_200025704644 [1,2,0,0,0,0|1,0,0]=4 10603 B11R1.192 Cc1ccc(cc1C)CS[13CH3] 62a_100000742320_200025704644 [1,2,0,0,0,0|1,0,0]=4 10604 B11R1.192 Cc1ccc(cc1C)CS[13CH3] 62a_200025704644_100000742320 [1,2,0,0,0,0|1,0,0]=4 10605 B11R1.192 Cc1ccc(cc1Cl)CN[13CH3] 2230a_102495364989_200025704644 [1,2,0,0,0,0|1,0,0]=4 10606 B11R1.192 Cc1ccc(cc1Cl)CN[13CH3] 34a_102495364989_200025704644 [1,2,0,0,0,0|1,0,0]=4 10607 B11R1.192 Cc1ccc(cc1Cl)CO[13CH3] 34a_100011290783_200025704644 [1,2,0,0,0,0|1,0,0]=4 10608 B11R1.192 Cc1ccc(cc1Cl)CO[13CH3] 7a_100011290783_200025704644 [1,2,0,0,0,0|1,0,0]=4 10609 B11R1.192 Cc1ccc(cc1Cl)CS[13CH3] 62a_100011823929_200025704644 [1,2,0,0,0,0|1,0,0]=4 10610 B11R1.192 Cc1ccc(cc1Cl)CS[13CH3] 62a_200025704644_100011823929 [1,2,0,0,0,0|1,0,0]=4 10611 B11R1.192 Cc1ccc(cc1F)CN[13CH3] 2230a_100102708794_200025704644 [1,2,0,0,0,0|1,0,0]=4 10612 B11R1.192 Cc1ccc(cc1F)CN[13CH3] 34a_100102708794_200025704644 [1,2,0,0,0,0|1,0,0]=4 10613 B11R1.192 Cc1ccc(cc1F)CO[13CH3] 34a_100000702247_200025704644 [1,2,0,0,0,0|1,0,0]=4 10614 B11R1.192 Cc1ccc(cc1F)CO[13CH3] 7a_100000702247_200025704644 [1,2,0,0,0,0|1,0,0]=4 10615 B11R1.192 Cc1ccc(cc1F)CS[13CH3] 62a_100011217369_200025704644 [1,2,0,0,0,0|1,0,0]=4 10616 B11R1.192 Cc1ccc(cc1F)CS[13CH3] 62a_200025704644_100011217369 [1,2,0,0,0,0|1,0,0]=4 10617 B11R1.192 Cc1ccc(cc1I)CO[13CH3] 34a_100000050133_200025704644 [1,2,0,0,0,0|1,0,0]=4 10618 B11R1.192 Cc1ccc(cc1I)CO[13CH3] 7a_100000050133_200025704644 [1,2,0,0,0,0|1,0,0]=4 10619 B11R1.192 Cc1ccc(cc1I)CS[13CH3] 62a_100010206137_200025704644 [1,2,0,0,0,0|1,0,0]=4 10620 B11R1.192 Cc1ccc(cc1I)CS[13CH3] 62a_200025704644_100010206137 [1,2,0,0,0,0|1,0,0]=4 10621 B11R1.192 Cc1ccc(cc1N)CO[13CH3] 34a_100000758420_200025704644 [1,2,0,0,0,0|1,0,0]=4 10622 B11R1.192 [13CH3]NCc1ccc(c(c1)Br)Br 2230a_100012351559_200025704644 [1,2,0,0,0,0|1,0,0]=4 10623 B11R1.192 [13CH3]NCc1ccc(c(c1)Br)Br 34a_100012351559_200025704644 [1,2,0,0,0,0|1,0,0]=4 10624 B11R1.192 [13CH3]NCc1ccc(c(c1)Br)Cl 2230a_100012349490_200025704644 [1,2,0,0,0,0|1,0,0]=4 10625 B11R1.192 [13CH3]NCc1ccc(c(c1)Br)Cl 34a_100012349490_200025704644 [1,2,0,0,0,0|1,0,0]=4 10626 B11R1.192 [13CH3]NCc1ccc(c(c1)Br)F 2230a_100015193890_200025704644 [1,2,0,0,0,0|1,0,0]=4 10627 B11R1.192 [13CH3]NCc1ccc(c(c1)Br)F 34a_100015193890_200025704644 [1,2,0,0,0,0|1,0,0]=4 10628 B11R1.192 [13CH3]NCc1ccc(c(c1)Cl)Br 2230a_100012362553_200025704644 [1,2,0,0,0,0|1,0,0]=4 10629 B11R1.192 [13CH3]NCc1ccc(c(c1)Cl)Br 34a_100012362553_200025704644 [1,2,0,0,0,0|1,0,0]=4 10630 B11R1.192 [13CH3]NCc1ccc(c(c1)Cl)Cl 2230a_100000174881_200025704644 [1,2,0,0,0,0|1,0,0]=4 10631 B11R1.192 [13CH3]NCc1ccc(c(c1)Cl)Cl 34a_100000174881_200025704644 [1,2,0,0,0,0|1,0,0]=4 10632 B11R1.192 [13CH3]NCc1ccc(c(c1)Cl)F 2230a_100000749334_200025704644 [1,2,0,0,0,0|1,0,0]=4 10633 B11R1.192 [13CH3]NCc1ccc(c(c1)Cl)F 34a_100000749334_200025704644 [1,2,0,0,0,0|1,0,0]=4 10634 B11R1.192 [13CH3]NCc1ccc(c(c1)F)Br 2230a_100000755036_200025704644 [1,2,0,0,0,0|1,0,0]=4 10635 B11R1.192 [13CH3]NCc1ccc(c(c1)F)Br 34a_100000755036_200025704644 [1,2,0,0,0,0|1,0,0]=4 10636 B11R1.192 [13CH3]NCc1ccc(c(c1)F)Cl 2230a_100011219866_200025704644 [1,2,0,0,0,0|1,0,0]=4 10637 B11R1.192 [13CH3]NCc1ccc(c(c1)F)Cl 34a_100011219866_200025704644 [1,2,0,0,0,0|1,0,0]=4 10638 B11R1.192 [13CH3]NCc1ccc(c(c1)F)F 2230a_100000737897_200025704644 [1,2,0,0,0,0|1,0,0]=4 10639 B11R1.192 [13CH3]NCc1ccc(c(c1)F)F 34a_100000737897_200025704644 [1,2,0,0,0,0|1,0,0]=4 10640 B11R1.192 [13CH3]NCc1ccc(c(c1)F)O 34a_100000758358_200025704644 [1,2,0,0,0,0|1,0,0]=4 10641 B11R1.192 [13CH3]NCc1ccc(c(c1)O)Cl 34a_100020636435_200025704644 [1,2,0,0,0,0|1,0,0]=4 10642 B11R1.192 [13CH3]NCc1ccc(c(c1)O)F 34a_100160469508_200025704644 [1,2,0,0,0,0|1,0,0]=4 10643 B11R1.192 [13CH3]NCc1ccc(c(c1)O)O 34a_100000010075_200025704644 [1,2,0,0,0,0|1,0,0]=4 10644 B11R1.192 [13CH3]OCc1ccc(c(c1)Br)Cl 34a_100012353893_200025704644 [1,2,0,0,0,0|1,0,0]=4 10645 B11R1.192 [13CH3]OCc1ccc(c(c1)Br)Cl 7a_100012353893_200025704644 [1,2,0,0,0,0|1,0,0]=4 10646 B11R1.192 [13CH3]OCc1ccc(c(c1)Br)F 34a_100000246287_200025704644 [1,2,0,0,0,0|1,0,0]=4 10647 B11R1.192 [13CH3]OCc1ccc(c(c1)Br)F 7a_100000246287_200025704644 [1,2,0,0,0,0|1,0,0]=4 10648 B11R1.192 [13CH3]OCc1ccc(c(c1)Cl)Br 34a_100000709168_200025704644 [1,2,0,0,0,0|1,0,0]=4 10649 B11R1.192 [13CH3]OCc1ccc(c(c1)Cl)Br 7a_100000709168_200025704644 [1,2,0,0,0,0|1,0,0]=4 10650 B11R1.192 [13CH3]OCc1ccc(c(c1)Cl)Cl 34a_100000211588_200025704644 [1,2,0,0,0,0|1,0,0]=4 10651 B11R1.192 [13CH3]OCc1ccc(c(c1)Cl)Cl 7a_100000211588_200025704644 [1,2,0,0,0,0|1,0,0]=4 10652 B11R1.192 [13CH3]OCc1ccc(c(c1)Cl)F 34a_100011217911_200025704644 [1,2,0,0,0,0|1,0,0]=4 10653 B11R1.192 [13CH3]OCc1ccc(c(c1)Cl)F 7a_100011217911_200025704644 [1,2,0,0,0,0|1,0,0]=4 10654 B11R1.192 [13CH3]OCc1ccc(c(c1)Cl)I 34a_100000718186_200025704644 [1,2,0,0,0,0|1,0,0]=4 10655 B11R1.192 [13CH3]OCc1ccc(c(c1)Cl)I 7a_100000718186_200025704644 [1,2,0,0,0,0|1,0,0]=4 10656 B11R1.192 [13CH3]OCc1ccc(c(c1)F)Br 34a_100011533735_200025704644 [1,2,0,0,0,0|1,0,0]=4 10657 B11R1.192 [13CH3]OCc1ccc(c(c1)F)Br 7a_100011533735_200025704644 [1,2,0,0,0,0|1,0,0]=4 10658 B11R1.192 [13CH3]OCc1ccc(c(c1)F)Cl 34a_100011218299_200025704644 [1,2,0,0,0,0|1,0,0]=4 10659 B11R1.192 [13CH3]OCc1ccc(c(c1)F)Cl 7a_100011218299_200025704644 [1,2,0,0,0,0|1,0,0]=4 10660 B11R1.192 [13CH3]OCc1ccc(c(c1)F)F 34a_100011215442_200025704644 [1,2,0,0,0,0|1,0,0]=4 10661 B11R1.192 [13CH3]OCc1ccc(c(c1)F)F 7a_100011215442_200025704644 [1,2,0,0,0,0|1,0,0]=4 10662 B11R1.192 [13CH3]OCc1ccc(c(c1)F)I 34a_100010149597_200025704644 [1,2,0,0,0,0|1,0,0]=4 10663 B11R1.192 [13CH3]OCc1ccc(c(c1)F)I 7a_100010149597_200025704644 [1,2,0,0,0,0|1,0,0]=4 10664 B11R1.192 [13CH3]OCc1ccc(c(c1)F)N 34a_100011217239_200025704644 [1,2,0,0,0,0|1,0,0]=4 10665 B11R1.192 [13CH3]OCc1ccc(c(c1)I)F 34a_100000049585_200025704644 [1,2,0,0,0,0|1,0,0]=4 10666 B11R1.192 [13CH3]OCc1ccc(c(c1)I)F 7a_100000049585_200025704644 [1,2,0,0,0,0|1,0,0]=4 10667 B11R1.192 [13CH3]OCc1ccc(c(c1)N)Br 34a_100012347568_200025704644 [1,2,0,0,0,0|1,0,0]=4 10668 B11R1.192 [13CH3]OCc1ccc(c(c1)N)Cl 34a_106256033963_200025704644 [1,2,0,0,0,0|1,0,0]=4 10669 B11R1.192 [13CH3]OCc1ccc(c(c1)N)F 34a_102125399562_200025704644 [1,2,0,0,0,0|1,0,0]=4 10670 B11R1.192 [13CH3]SCc1ccc(c(c1)Br)Br 62a_100012353900_200025704644 [1,2,0,0,0,0|1,0,0]=4 10671 B11R1.192 [13CH3]SCc1ccc(c(c1)Br)Br 62a_200025704644_100012353900 [1,2,0,0,0,0|1,0,0]=4 10672 B11R1.192 [13CH3]SCc1ccc(c(c1)Br)Cl 62a_100012353894_200025704644 [1,2,0,0,0,0|1,0,0]=4 10673 B11R1.192 [13CH3]SCc1ccc(c(c1)Br)Cl 62a_200025704644_100012353894 [1,2,0,0,0,0|1,0,0]=4 10674 B11R1.192 [13CH3]SCc1ccc(c(c1)Br)F 62a_100011206884_200025704644 [1,2,0,0,0,0|1,0,0]=4 10675 B11R1.192 [13CH3]SCc1ccc(c(c1)Br)F 62a_200025704644_100011206884 [1,2,0,0,0,0|1,0,0]=4 10676 B11R1.192 [13CH3]SCc1ccc(c(c1)Cl)Br 62a_100012353895_200025704644 [1,2,0,0,0,0|1,0,0]=4 10677 B11R1.192 [13CH3]SCc1ccc(c(c1)Cl)Br 62a_200025704644_100012353895 [1,2,0,0,0,0|1,0,0]=4 10678 B11R1.192 [13CH3]SCc1ccc(c(c1)Cl)Cl 62a_100000184707_200025704644 [1,2,0,0,0,0|1,0,0]=4 10679 B11R1.192 [13CH3]SCc1ccc(c(c1)Cl)Cl 62a_200025704644_100000184707 [1,2,0,0,0,0|1,0,0]=4 10680 B11R1.192 [13CH3]SCc1ccc(c(c1)Cl)F 62a_100000717365_200025704644 [1,2,0,0,0,0|1,0,0]=4 10681 B11R1.192 [13CH3]SCc1ccc(c(c1)Cl)F 62a_200025704644_100011934319 [1,2,0,0,0,0|1,0,0]=4 10682 B11R1.192 [13CH3]SCc1ccc(c(c1)Cl)I 62a_100012349665_200025704644 [1,2,0,0,0,0|1,0,0]=4 10683 B11R1.192 [13CH3]SCc1ccc(c(c1)Cl)I 62a_200025704644_100012349665 [1,2,0,0,0,0|1,0,0]=4 10684 B11R1.192 [13CH3]SCc1ccc(c(c1)F)Br 62a_100000767054_200025704644 [1,2,0,0,0,0|1,0,0]=4 10685 B11R1.192 [13CH3]SCc1ccc(c(c1)F)Br 62a_200025704644_100000767054 [1,2,0,0,0,0|1,0,0]=4 10686 B11R1.192 [13CH3]SCc1ccc(c(c1)F)Cl 62a_100000716492_200025704644 [1,2,0,0,0,0|1,0,0]=4 10687 B11R1.192 [13CH3]SCc1ccc(c(c1)F)Cl 62a_200025704644_100000716492 [1,2,0,0,0,0|1,0,0]=4 10688 B11R1.192 [13CH3]SCc1ccc(c(c1)F)F 62a_100000757363_200025704644 [1,2,0,0,0,0|1,0,0]=4 10689 B11R1.192 [13CH3]SCc1ccc(c(c1)F)F 62a_200025704644_100000757363 [1,2,0,0,0,0|1,0,0]=4 10690 B11R1.192 [13CH3]SCc1ccc(c(c1)F)I 62a_100010149604_200025704644 [1,2,0,0,0,0|1,0,0]=4 10691 B11R1.192 [13CH3]SCc1ccc(c(c1)F)I 62a_200025704644_100010149604 [1,2,0,0,0,0|1,0,0]=4 10692 B11R1.192 [13CH3]SCc1ccc(c(c1)I)Br 62a_100010146616_200025704644 [1,2,0,0,0,0|1,0,0]=4 10693 B11R1.192 [13CH3]SCc1ccc(c(c1)I)Br 62a_200025704644_100010146616 [1,2,0,0,0,0|1,0,0]=4 10694 B11R1.192 [13CH3]SCc1ccc(c(c1)I)F 62a_100010188208_200025704644 [1,2,0,0,0,0|1,0,0]=4 10695 B11R1.192 [13CH3]SCc1ccc(c(c1)I)F 62a_200025704644_100010188208 [1,2,0,0,0,0|1,0,0]=4 10696 B11R1.13 CC=Cc1cccc(c1Br)O 271570a_100016259895_100010187914 [1,2,0,0,0,0|0,0,1]=4 10697 B11R1.13 CC=Cc1cccc(c1C)Br 271570a_100016259895_100012353703 [1,2,0,0,0,0|0,0,1]=4 10698 B11R1.13 CC=Cc1cccc(c1C)C 271570a_100016259895_100011214922 [1,2,0,0,0,0|0,0,1]=4 10699 B11R1.13 CC=Cc1cccc(c1C)Cl 271570a_100016259895_100000726075 [1,2,0,0,0,0|0,0,1]=4 10700 B11R1.13 CC=Cc1cccc(c1C)F 271570a_100016259895_100011216893 [1,2,0,0,0,0|0,0,1]=4 10701 B11R1.13 CC=Cc1cccc(c1C)N 271570a_100016259895_100000761887 [1,2,0,0,0,0|0,0,1]=4 10702 B11R1.13 CC=Cc1cccc(c1C)O 271570a_100016259895_100012002258 [1,2,0,0,0,0|0,0,1]=4 10703 B11R1.13 CC=Cc1cccc(c1Cl)Br 271570a_100016259895_100010142854 [1,2,0,0,0,0|0,0,1]=4 10704 B11R1.13 CC=Cc1cccc(c1Cl)C 271570a_100016259895_200012352035 [1,2,0,0,0,0|0,0,1]=4 10705 B11R1.13 CC=Cc1cccc(c1Cl)Cl 271570a_100016259895_100011215384 [1,2,0,0,0,0|0,0,1]=4 10706 B11R1.13 CC=Cc1cccc(c1Cl)F 271570a_100016259895_200010234923 [1,2,0,0,0,0|0,0,1]=4 10707 B11R1.13 CC=Cc1cccc(c1Cl)O 271570a_100016259895_100000049636 [1,2,0,0,0,0|0,0,1]=4 10708 B11R1.13 CC=Cc1cccc(c1F)Br 271570a_100016259895_100000702267 [1,2,0,0,0,0|0,0,1]=4 10709 B11R1.13 CC=Cc1cccc(c1F)C 271570a_100016259895_100000717567 [1,2,0,0,0,0|0,0,1]=4 10710 B11R1.13 CC=Cc1cccc(c1F)Cl 271570a_100016259895_100011217346 [1,2,0,0,0,0|0,0,1]=4 10711 B11R1.13 CC=Cc1cccc(c1F)F 271570a_100016259895_100000694657 [1,2,0,0,0,0|0,0,1]=4 10712 B11R1.13 CC=Cc1cccc(c1F)N 271570a_100016259895_100011935091 [1,2,0,0,0,0|0,0,1]=4 10713 B11R1.13 CC=Cc1cccc(c1F)O 271570a_100016259895_100009817021 [1,2,0,0,0,0|0,0,1]=4 10714 B11R1.13 CC=Cc1cccc(c1N)Br 271570a_100016259895_100010146558 [1,2,0,0,0,0|0,0,1]=4 10715 B11R1.13 CC=Cc1cccc(c1N)C 271570a_100016259895_100011834072 [1,2,0,0,0,0|0,0,1]=4 10716 B11R1.13 CC=Cc1cccc(c1N)Cl 271570a_100016259895_100010190421 [1,2,0,0,0,0|0,0,1]=4 10717 B11R1.13 CC=Cc1cccc(c1N)F 271570a_100016259895_100000042321 [1,2,0,0,0,0|0,0,1]=4 10718 B11R1.13 CC=Cc1cccc(c1N)N 271570a_100016259895_100015191791 [1,2,0,0,0,0|0,0,1]=4 10719 B11R1.13 CC=Cc1cccc(c1N)O 271570a_100016259895_100011934926 [1,2,0,0,0,0|0,0,1]=4 10720 B11R1.13 CC=Cc1cccc(c1O)Br 271570a_100016259895_100010084509 [1,2,0,0,0,0|0,0,1]=4 10721 B11R1.13 CC=Cc1cccc(c1O)C 271570a_100016259895_100009817157 [1,2,0,0,0,0|0,0,1]=4 10722 B11R1.13 CC=Cc1cccc(c1O)Cl 271570a_100016259895_100010202889 [1,2,0,0,0,0|0,0,1]=4 10723 B11R1.13 CC=Cc1cccc(c1O)F 271570a_100016259895_100009813666 [1,2,0,0,0,0|0,0,1]=4 10724 B11R1.13 CC=Cc1cccc(c1O)N 271570a_100016259895_100011934915 [1,2,0,0,0,0|0,0,1]=4 10725 B11R1.13 CC=Cc1cccc(c1O)O 271570a_100016259895_100009815950 [1,2,0,0,0,0|0,0,1]=4 10726 B11R1.13 CNCc1cccc(c1Br)Br 207a_100102657272_100010240334 [1,2,0,0,0,0|1,0,0]=4 10727 B11R1.13 CNCc1cccc(c1Br)Br 26a_100102657272_100010187966 [1,2,0,0,0,0|1,0,0]=4 10728 B11R1.13 CNCc1cccc(c1Br)Br 270004a_106832991635_100010240334 [1,2,0,0,0,0|1,0,0]=4 10729 B11R1.13 CNCc1cccc(c1Br)C 207a_100102657272_100012186367 [1,2,0,0,0,0|1,0,0]=4 10730 B11R1.13 CNCc1cccc(c1Br)C 2230a_106832991635_200012349612 [1,2,0,0,0,0|1,0,0]=4 10731 B11R1.13 CNCc1cccc(c1Br)C 26a_100102657272_100000686692 [1,2,0,0,0,0|1,0,0]=4 10732 B11R1.13 CNCc1cccc(c1Br)C 270004a_106832991635_100012186367 [1,2,0,0,0,0|1,0,0]=4 10733 B11R1.13 CNCc1cccc(c1Br)C 34a_100102657272_200012349612 [1,2,0,0,0,0|1,0,0]=4 10734 B11R1.13 CNCc1cccc(c1Br)C 7a_106832991635_200012349612 [1,2,0,0,0,0|1,0,0]=4 10735 B11R1.13 CNCc1cccc(c1Br)Cl 207a_100102657272_100010232083 [1,2,0,0,0,0|1,0,0]=4 10736 B11R1.13 CNCc1cccc(c1Br)Cl 2230a_106832991635_100010145525 [1,2,0,0,0,0|1,0,0]=4 10737 B11R1.13 CNCc1cccc(c1Br)Cl 26a_100102657272_100012348804 [1,2,0,0,0,0|1,0,0]=4 10738 B11R1.13 CNCc1cccc(c1Br)Cl 270004a_106832991635_100010232083 [1,2,0,0,0,0|1,0,0]=4 10739 B11R1.13 CNCc1cccc(c1Br)Cl 34a_100102657272_100010145525 [1,2,0,0,0,0|1,0,0]=4 10740 B11R1.13 CNCc1cccc(c1Br)Cl 7a_106832991635_100010145525 [1,2,0,0,0,0|1,0,0]=4 10741 B11R1.13 CNCc1cccc(c1Br)F 207a_100102657272_100011934749 [1,2,0,0,0,0|1,0,0]=4 10742 B11R1.13 CNCc1cccc(c1Br)F 2230a_100020638964_200000210301 [1,2,0,0,0,0|1,0,0]=4 10743 B11R1.13 CNCc1cccc(c1Br)F 2230a_106832991635_100012351116 [1,2,0,0,0,0|1,0,0]=4 10744 B11R1.13 CNCc1cccc(c1Br)F 26a_100102657272_100009820682 [1,2,0,0,0,0|1,0,0]=4 10745 B11R1.13 CNCc1cccc(c1Br)F 270004a_106832991635_100011934749 [1,2,0,0,0,0|1,0,0]=4 10746 B11R1.13 CNCc1cccc(c1Br)F 34a_100020638964_200000210301 [1,2,0,0,0,0|1,0,0]=4 10747 B11R1.13 CNCc1cccc(c1Br)F 34a_100102657272_100012351116 [1,2,0,0,0,0|1,0,0]=4 10748 B11R1.13 CNCc1cccc(c1Br)F 7a_106832991635_100012351116 [1,2,0,0,0,0|1,0,0]=4 10749 B11R1.13 CNCc1cccc(c1Br)I 2230a_106832991635_100010254545 [1,2,0,0,0,0|1,0,0]=4 10750 B11R1.13 CNCc1cccc(c1Br)I 26a_100102657272_100010187914 [1,2,0,0,0,0|1,0,0]=4 10751 B11R1.13 CNCc1cccc(c1Br)I 34a_100102657272_100010254545 [1,2,0,0,0,0|1,0,0]=4 10752 B11R1.13 CNCc1cccc(c1Br)I 7a_106832991635_100010254545 [1,2,0,0,0,0|1,0,0]=4 10753 B11R1.13 CNCc1cccc(c1C)Br 207a_100102657272_100012179384 [1,2,0,0,0,0|1,0,0]=4 10754 B11R1.13 CNCc1cccc(c1C)Br 2230a_106832991635_100000694682 [1,2,0,0,0,0|1,0,0]=4 10755 B11R1.13 CNCc1cccc(c1C)Br 26a_100102657272_100012002258 [1,2,0,0,0,0|1,0,0]=4 10756 B11R1.13 CNCc1cccc(c1C)Br 270004a_106832991635_100012179384 [1,2,0,0,0,0|1,0,0]=4 10757 B11R1.13 CNCc1cccc(c1C)Br 34a_100000724210_200000210301 [1,2,0,0,0,0|1,0,0]=4 10758 B11R1.13 CNCc1cccc(c1C)Br 34a_100102657272_100000694682 [1,2,0,0,0,0|1,0,0]=4 10759 B11R1.13 CNCc1cccc(c1C)Br 7a_106832991635_100000694682 [1,2,0,0,0,0|1,0,0]=4 10760 B11R1.13 CNCc1cccc(c1C)C 207a_100102657272_100000229941 [1,2,0,0,0,0|1,0,0]=4 10761 B11R1.13 CNCc1cccc(c1C)C 2230a_100011211637_200000210301 [1,2,0,0,0,0|1,0,0]=4 10762 B11R1.13 CNCc1cccc(c1C)C 2230a_106832991635_100011515928 [1,2,0,0,0,0|1,0,0]=4 10763 B11R1.13 CNCc1cccc(c1C)C 270004a_106832991635_100000229941 [1,2,0,0,0,0|1,0,0]=4 10764 B11R1.13 CNCc1cccc(c1C)C 34a_100011211637_200000210301 [1,2,0,0,0,0|1,0,0]=4 10765 B11R1.13 CNCc1cccc(c1C)C 34a_100102657272_100011273979 [1,2,0,0,0,0|1,0,0]=4 10766 B11R1.13 CNCc1cccc(c1C)C 7a_106832991635_100011515928 [1,2,0,0,0,0|1,0,0]=4 10767 B11R1.13 CNCc1cccc(c1C)Cl 207a_100102657272_100012002129 [1,2,0,0,0,0|1,0,0]=4 10768 B11R1.13 CNCc1cccc(c1C)Cl 2230a_100020639605_200000210301 [1,2,0,0,0,0|1,0,0]=4 10769 B11R1.13 CNCc1cccc(c1C)Cl 2230a_106832991635_100012186920 [1,2,0,0,0,0|1,0,0]=4 10770 B11R1.13 CNCc1cccc(c1C)Cl 270004a_106832991635_100012002129 [1,2,0,0,0,0|1,0,0]=4 10771 B11R1.13 CNCc1cccc(c1C)Cl 34a_100020639605_200000210301 [1,2,0,0,0,0|1,0,0]=4 10772 B11R1.13 CNCc1cccc(c1C)Cl 34a_100102657272_100012186920 [1,2,0,0,0,0|1,0,0]=4 10773 B11R1.13 CNCc1cccc(c1C)Cl 7a_106832991635_100012186920 [1,2,0,0,0,0|1,0,0]=4 10774 B11R1.13 CNCc1cccc(c1C)F 207a_100102657272_100000037668 [1,2,0,0,0,0|1,0,0]=4 10775 B11R1.13 CNCc1cccc(c1C)F 2230a_100132306986_200000210301 [1,2,0,0,0,0|1,0,0]=4 10776 B11R1.13 CNCc1cccc(c1C)F 2230a_106832991635_100009813626 [1,2,0,0,0,0|1,0,0]=4 10777 B11R1.13 CNCc1cccc(c1C)F 270004a_106832991635_100000037668 [1,2,0,0,0,0|1,0,0]=4 10778 B11R1.13 CNCc1cccc(c1C)F 34a_100102657272_100009813626 [1,2,0,0,0,0|1,0,0]=4 10779 B11R1.13 CNCc1cccc(c1C)F 34a_100132306986_200000210301 [1,2,0,0,0,0|1,0,0]=4 10780 B11R1.13 CNCc1cccc(c1C)F 7a_106832991635_100009813626 [1,2,0,0,0,0|1,0,0]=4 10781 B11R1.13 CNCc1cccc(c1C)I 2230a_106832991635_100010150147 [1,2,0,0,0,0|1,0,0]=4 10782 B11R1.13 CNCc1cccc(c1C)I 34a_100102657272_100010150147 [1,2,0,0,0,0|1,0,0]=4 10783 B11R1.13 CNCc1cccc(c1C)I 7a_106832991635_100010150147 [1,2,0,0,0,0|1,0,0]=4 10784 B11R1.13 CNCc1cccc(c1C)O 270004a_106832991635_100009868165 [1,2,0,0,0,0|1,0,0]=4 10785 B11R1.13 CNCc1cccc(c1Cl)Br 207a_100102657272_100012362481 [1,2,0,0,0,0|1,0,0]=4 10786 B11R1.13 CNCc1cccc(c1Cl)Br 2230a_106832991635_100012349491 [1,2,0,0,0,0|1,0,0]=4 10787 B11R1.13 CNCc1cccc(c1Cl)Br 26a_100102657272_100010187913 [1,2,0,0,0,0|1,0,0]=4 10788 B11R1.13 CNCc1cccc(c1Cl)Br 270004a_106832991635_100012362481 [1,2,0,0,0,0|1,0,0]=4 10789 B11R1.13 CNCc1cccc(c1Cl)Br 34a_100102657272_100012349491 [1,2,0,0,0,0|1,0,0]=4 10790 B11R1.13 CNCc1cccc(c1Cl)Br 7a_106832991635_100012349491 [1,2,0,0,0,0|1,0,0]=4 10791 B11R1.13 CNCc1cccc(c1Cl)C 207a_100102657272_100012017286 [1,2,0,0,0,0|1,0,0]=4 10792 B11R1.13 CNCc1cccc(c1Cl)C 2230a_100025705714_200000210301 [1,2,0,0,0,0|1,0,0]=4 10793 B11R1.13 CNCc1cccc(c1Cl)C 26a_100102657272_100000695629 [1,2,0,0,0,0|1,0,0]=4 10794 B11R1.13 CNCc1cccc(c1Cl)C 270004a_106832991635_100012017286 [1,2,0,0,0,0|1,0,0]=4 10795 B11R1.13 CNCc1cccc(c1Cl)C 34a_100025705714_200000210301 [1,2,0,0,0,0|1,0,0]=4 10796 B11R1.13 CNCc1cccc(c1Cl)Cl 207a_100102657272_100000210504 [1,2,0,0,0,0|1,0,0]=4 10797 B11R1.13 CNCc1cccc(c1Cl)Cl 2230a_100011211633_200000210301 [1,2,0,0,0,0|1,0,0]=4 10798 B11R1.13 CNCc1cccc(c1Cl)Cl 2230a_106832991635_100000723366 [1,2,0,0,0,0|1,0,0]=4 10799 B11R1.13 CNCc1cccc(c1Cl)Cl 26a_100102657272_100000211076 [1,2,0,0,0,0|1,0,0]=4 10800 B11R1.13 CNCc1cccc(c1Cl)Cl 270004a_106832991635_100000210504 [1,2,0,0,0,0|1,0,0]=4 10801 B11R1.13 CNCc1cccc(c1Cl)Cl 34a_100011211633_200000210301 [1,2,0,0,0,0|1,0,0]=4 10802 B11R1.13 CNCc1cccc(c1Cl)Cl 34a_100102657272_100000723366 [1,2,0,0,0,0|1,0,0]=4 10803 B11R1.13 CNCc1cccc(c1Cl)Cl 7a_106832991635_100000723366 [1,2,0,0,0,0|1,0,0]=4 10804 B11R1.13 CNCc1cccc(c1Cl)F 207a_100102657272_100011998484 [1,2,0,0,0,0|1,0,0]=4 10805 B11R1.13 CNCc1cccc(c1Cl)F 2230a_100012001614_200000210301 [1,2,0,0,0,0|1,0,0]=4 10806 B11R1.13 CNCc1cccc(c1Cl)F 2230a_106832991635_100000696688 [1,2,0,0,0,0|1,0,0]=4 10807 B11R1.13 CNCc1cccc(c1Cl)F 26a_100102657272_100000087408 [1,2,0,0,0,0|1,0,0]=4 10808 B11R1.13 CNCc1cccc(c1Cl)F 270004a_106832991635_100011998484 [1,2,0,0,0,0|1,0,0]=4 10809 B11R1.13 CNCc1cccc(c1Cl)F 34a_100012001614_200000210301 [1,2,0,0,0,0|1,0,0]=4 10810 B11R1.13 CNCc1cccc(c1Cl)F 34a_100102657272_100000696688 [1,2,0,0,0,0|1,0,0]=4 10811 B11R1.13 CNCc1cccc(c1Cl)F 7a_106832991635_100000696688 [1,2,0,0,0,0|1,0,0]=4 10812 B11R1.13 CNCc1cccc(c1Cl)I 26a_100102657272_100000049636 [1,2,0,0,0,0|1,0,0]=4 10813 B11R1.13 CNCc1cccc(c1Cl)O 270004a_106832991635_100000050521 [1,2,0,0,0,0|1,0,0]=4 10814 B11R1.13 CNCc1cccc(c1F)Br 207a_100102657272_100011361543 [1,2,0,0,0,0|1,0,0]=4 10815 B11R1.13 CNCc1cccc(c1F)Br 2230a_100015189953_200000210301 [1,2,0,0,0,0|1,0,0]=4 10816 B11R1.13 CNCc1cccc(c1F)Br 2230a_106832991635_100012356506 [1,2,0,0,0,0|1,0,0]=4 10817 B11R1.13 CNCc1cccc(c1F)Br 26a_100102657272_100009817021 [1,2,0,0,0,0|1,0,0]=4 10818 B11R1.13 CNCc1cccc(c1F)Br 270004a_106832991635_100011361543 [1,2,0,0,0,0|1,0,0]=4 10819 B11R1.13 CNCc1cccc(c1F)Br 34a_100015189953_200000210301 [1,2,0,0,0,0|1,0,0]=4 10820 B11R1.13 CNCc1cccc(c1F)Br 34a_100102657272_100012356506 [1,2,0,0,0,0|1,0,0]=4 10821 B11R1.13 CNCc1cccc(c1F)Br 7a_106832991635_100012356506 [1,2,0,0,0,0|1,0,0]=4 10822 B11R1.13 CNCc1cccc(c1F)C 207a_100102657272_100011219516 [1,2,0,0,0,0|1,0,0]=4 10823 B11R1.13 CNCc1cccc(c1F)C 2230a_100012002060_200000210301 [1,2,0,0,0,0|1,0,0]=4 10824 B11R1.13 CNCc1cccc(c1F)C 2230a_106832991635_100011216058 [1,2,0,0,0,0|1,0,0]=4 10825 B11R1.13 CNCc1cccc(c1F)C 270004a_106832991635_100011219516 [1,2,0,0,0,0|1,0,0]=4 10826 B11R1.13 CNCc1cccc(c1F)C 34a_100012002060_200000210301 [1,2,0,0,0,0|1,0,0]=4 10827 B11R1.13 CNCc1cccc(c1F)C 34a_100102657272_100011216058 [1,2,0,0,0,0|1,0,0]=4 10828 B11R1.13 CNCc1cccc(c1F)C 7a_106832991635_100011216058 [1,2,0,0,0,0|1,0,0]=4 10829 B11R1.13 CNCc1cccc(c1F)Cl 207a_100102657272_100000766533 [1,2,0,0,0,0|1,0,0]=4 10830 B11R1.13 CNCc1cccc(c1F)Cl 2230a_100000764326_200000210301 [1,2,0,0,0,0|1,0,0]=4 10831 B11R1.13 CNCc1cccc(c1F)Cl 2230a_106832991635_100000716733 [1,2,0,0,0,0|1,0,0]=4 10832 B11R1.13 CNCc1cccc(c1F)Cl 26a_100102657272_100000687438 [1,2,0,0,0,0|1,0,0]=4 10833 B11R1.13 CNCc1cccc(c1F)Cl 270004a_106832991635_100000766533 [1,2,0,0,0,0|1,0,0]=4 10834 B11R1.13 CNCc1cccc(c1F)Cl 34a_100000764326_200000210301 [1,2,0,0,0,0|1,0,0]=4 10835 B11R1.13 CNCc1cccc(c1F)Cl 34a_100102657272_100000716733 [1,2,0,0,0,0|1,0,0]=4 10836 B11R1.13 CNCc1cccc(c1F)Cl 7a_106832991635_100000716733 [1,2,0,0,0,0|1,0,0]=4 10837 B11R1.13 CNCc1cccc(c1F)F 207a_100102657272_100000753312 [1,2,0,0,0,0|1,0,0]=4 10838 B11R1.13 CNCc1cccc(c1F)F 2230a_100011199105_200000210301 [1,2,0,0,0,0|1,0,0]=4 10839 B11R1.13 CNCc1cccc(c1F)F 2230a_106832991635_100000217499 [1,2,0,0,0,0|1,0,0]=4 10840 B11R1.13 CNCc1cccc(c1F)F 270004a_106832991635_100000753312 [1,2,0,0,0,0|1,0,0]=4 10841 B11R1.13 CNCc1cccc(c1F)F 34a_100011199105_200000210301 [1,2,0,0,0,0|1,0,0]=4 10842 B11R1.13 CNCc1cccc(c1F)F 34a_100102657272_100000217499 [1,2,0,0,0,0|1,0,0]=4 10843 B11R1.13 CNCc1cccc(c1F)F 7a_106832991635_100000217499 [1,2,0,0,0,0|1,0,0]=4 10844 B11R1.13 CNCc1cccc(c1F)I 207a_100102657272_100010202174 [1,2,0,0,0,0|1,0,0]=4 10845 B11R1.13 CNCc1cccc(c1F)I 270004a_106832991635_100010202174 [1,2,0,0,0,0|1,0,0]=4 10846 B11R1.13 CNCc1cccc(c1F)O 271570a_203496583355_114873767014 [1,2,0,0,0,0|1,0,0]=4 10847 B11R1.13 CNCc1cccc(c1F)O 34a_100025773512_200000210301 [1,2,0,0,0,0|1,0,0]=4 10848 B11R1.13 CNCc1cccc(c1I)Br 26a_100102657272_100010187912 [1,2,0,0,0,0|1,0,0]=4 10849 B11R1.13 CNCc1cccc(c1I)F 207a_100102657272_100010186293 [1,2,0,0,0,0|1,0,0]=4 10850 B11R1.13 CNCc1cccc(c1I)F 2230a_106832991635_100010149603 [1,2,0,0,0,0|1,0,0]=4 10851 B11R1.13 CNCc1cccc(c1I)F 270004a_106832991635_100010186293 [1,2,0,0,0,0|1,0,0]=4 10852 B11R1.13 CNCc1cccc(c1I)F 34a_100102657272_100010149603 [1,2,0,0,0,0|1,0,0]=4 10853 B11R1.13 CNCc1cccc(c1I)F 7a_106832991635_100010149603 [1,2,0,0,0,0|1,0,0]=4 10854 B11R1.13 CNCc1cccc(c1O)C 34a_100020639391_200000210301 [1,2,0,0,0,0|1,0,0]=4 10855 B11R1.13 COCc1cccc(c1Br)C 34a_100011659289_200000210301 [1,2,0,0,0,0|1,0,0]=4 10856 B11R1.13 COCc1cccc(c1Br)C 34a_100138415774_200012349612 [1,2,0,0,0,0|1,0,0]=4 10857 B11R1.13 COCc1cccc(c1Br)C 7a_100011659289_200000210301 [1,2,0,0,0,0|1,0,0]=4 10858 B11R1.13 COCc1cccc(c1Br)Cl 34a_100010168166_200000210301 [1,2,0,0,0,0|1,0,0]=4 10859 B11R1.13 COCc1cccc(c1Br)Cl 34a_100138415774_100010145525 [1,2,0,0,0,0|1,0,0]=4 10860 B11R1.13 COCc1cccc(c1Br)Cl 7a_100010168166_200000210301 [1,2,0,0,0,0|1,0,0]=4 10861 B11R1.13 COCc1cccc(c1Br)F 34a_100012351117_200000210301 [1,2,0,0,0,0|1,0,0]=4 10862 B11R1.13 COCc1cccc(c1Br)F 34a_100138415774_100012351116 [1,2,0,0,0,0|1,0,0]=4 10863 B11R1.13 COCc1cccc(c1Br)F 7a_100012351117_200000210301 [1,2,0,0,0,0|1,0,0]=4 10864 B11R1.13 COCc1cccc(c1Br)I 34a_100010240205_200000210301 [1,2,0,0,0,0|1,0,0]=4 10865 B11R1.13 COCc1cccc(c1Br)I 34a_100138415774_100010254545 [1,2,0,0,0,0|1,0,0]=4 10866 B11R1.13 COCc1cccc(c1Br)I 7a_100010240205_200000210301 [1,2,0,0,0,0|1,0,0]=4 10867 B11R1.13 COCc1cccc(c1C)Br 34a_100000694458_200000210301 [1,2,0,0,0,0|1,0,0]=4 10868 B11R1.13 COCc1cccc(c1C)Br 34a_100138415774_100000694682 [1,2,0,0,0,0|1,0,0]=4 10869 B11R1.13 COCc1cccc(c1C)Br 7a_100000694458_200000210301 [1,2,0,0,0,0|1,0,0]=4 10870 B11R1.13 COCc1cccc(c1C)C 34a_100011219135_200000210301 [1,2,0,0,0,0|1,0,0]=4 10871 B11R1.13 COCc1cccc(c1C)C 34a_100138415774_100011273979 [1,2,0,0,0,0|1,0,0]=4 10872 B11R1.13 COCc1cccc(c1C)C 7a_100011219135_200000210301 [1,2,0,0,0,0|1,0,0]=4 10873 B11R1.13 COCc1cccc(c1C)Cl 34a_100012000165_200000210301 [1,2,0,0,0,0|1,0,0]=4 10874 B11R1.13 COCc1cccc(c1C)Cl 34a_100138415774_100012186920 [1,2,0,0,0,0|1,0,0]=4 10875 B11R1.13 COCc1cccc(c1C)Cl 7a_100012000165_200000210301 [1,2,0,0,0,0|1,0,0]=4 10876 B11R1.13 COCc1cccc(c1C)F 34a_100000042775_200000210301 [1,2,0,0,0,0|1,0,0]=4 10877 B11R1.13 COCc1cccc(c1C)F 34a_100138415774_100009813626 [1,2,0,0,0,0|1,0,0]=4 10878 B11R1.13 COCc1cccc(c1C)F 7a_100000042775_200000210301 [1,2,0,0,0,0|1,0,0]=4 10879 B11R1.13 COCc1cccc(c1C)I 34a_100010150139_200000210301 [1,2,0,0,0,0|1,0,0]=4 10880 B11R1.13 COCc1cccc(c1C)I 34a_100138415774_100010150147 [1,2,0,0,0,0|1,0,0]=4 10881 B11R1.13 COCc1cccc(c1C)I 7a_100010150139_200000210301 [1,2,0,0,0,0|1,0,0]=4 10882 B11R1.13 COCc1cccc(c1C)N 34a_102495339961_200000210301 [1,2,0,0,0,0|1,0,0]=4 10883 B11R1.13 COCc1cccc(c1C)N 7a_102495339961_200000210301 [1,2,0,0,0,0|1,0,0]=4 10884 B11R1.13 COCc1cccc(c1C)O 271570a_203496583355_100102485947 [1,2,0,0,0,0|1,0,0]=4 10885 B11R1.13 COCc1cccc(c1Cl)Br 34a_100012351182_200000210301 [1,2,0,0,0,0|1,0,0]=4 10886 B11R1.13 COCc1cccc(c1Cl)Br 34a_100138415774_100012349491 [1,2,0,0,0,0|1,0,0]=4 10887 B11R1.13 COCc1cccc(c1Cl)Br 7a_100012351182_200000210301 [1,2,0,0,0,0|1,0,0]=4 10888 B11R1.13 COCc1cccc(c1Cl)C 34a_100000710031_200000210301 [1,2,0,0,0,0|1,0,0]=4 10889 B11R1.13 COCc1cccc(c1Cl)C 7a_100000710031_200000210301 [1,2,0,0,0,0|1,0,0]=4 10890 B11R1.13 COCc1cccc(c1Cl)Cl 34a_100000720469_200000210301 [1,2,0,0,0,0|1,0,0]=4 10891 B11R1.13 COCc1cccc(c1Cl)Cl 34a_100138415774_100000723366 [1,2,0,0,0,0|1,0,0]=4 10892 B11R1.13 COCc1cccc(c1Cl)Cl 7a_100000720469_200000210301 [1,2,0,0,0,0|1,0,0]=4 10893 B11R1.13 COCc1cccc(c1Cl)F 34a_100000696319_200000210301 [1,2,0,0,0,0|1,0,0]=4 10894 B11R1.13 COCc1cccc(c1Cl)F 34a_100138415774_100000696688 [1,2,0,0,0,0|1,0,0]=4 10895 B11R1.13 COCc1cccc(c1Cl)F 7a_100000696319_200000210301 [1,2,0,0,0,0|1,0,0]=4 10896 B11R1.13 COCc1cccc(c1F)Br 34a_100011935076_200000210301 [1,2,0,0,0,0|1,0,0]=4 10897 B11R1.13 COCc1cccc(c1F)Br 34a_100138415774_100012356506 [1,2,0,0,0,0|1,0,0]=4 10898 B11R1.13 COCc1cccc(c1F)Br 7a_100011935076_200000210301 [1,2,0,0,0,0|1,0,0]=4 10899 B11R1.13 COCc1cccc(c1F)C 34a_100138415774_100011216058 [1,2,0,0,0,0|1,0,0]=4 10900 B11R1.13 COCc1cccc(c1F)C 34a_200011219517_200000210301 [1,2,0,0,0,0|1,0,0]=4 10901 B11R1.13 COCc1cccc(c1F)C 7a_200011219517_200000210301 [1,2,0,0,0,0|1,0,0]=4 10902 B11R1.13 COCc1cccc(c1F)Cl 34a_100011216988_200000210301 [1,2,0,0,0,0|1,0,0]=4 10903 B11R1.13 COCc1cccc(c1F)Cl 34a_100138415774_100000716733 [1,2,0,0,0,0|1,0,0]=4 10904 B11R1.13 COCc1cccc(c1F)Cl 7a_100011216988_200000210301 [1,2,0,0,0,0|1,0,0]=4 10905 B11R1.13 COCc1cccc(c1F)F 34a_100011218644_200000210301 [1,2,0,0,0,0|1,0,0]=4 10906 B11R1.13 COCc1cccc(c1F)F 34a_100138415774_100000217499 [1,2,0,0,0,0|1,0,0]=4 10907 B11R1.13 COCc1cccc(c1F)F 7a_100011218644_200000210301 [1,2,0,0,0,0|1,0,0]=4 10908 B11R1.13 COCc1cccc(c1F)I 34a_200010235739_200000210301 [1,2,0,0,0,0|1,0,0]=4 10909 B11R1.13 COCc1cccc(c1F)I 7a_200010235739_200000210301 [1,2,0,0,0,0|1,0,0]=4 10910 B11R1.13 COCc1cccc(c1F)N 34a_100012023829_200000210301 [1,2,0,0,0,0|1,0,0]=4 10911 B11R1.13 COCc1cccc(c1I)Br 34a_100010146604_200000210301 [1,2,0,0,0,0|1,0,0]=4 10912 B11R1.13 COCc1cccc(c1I)Br 7a_100010146604_200000210301 [1,2,0,0,0,0|1,0,0]=4 10913 B11R1.13 COCc1cccc(c1I)C 34a_100012349780_200000210301 [1,2,0,0,0,0|1,0,0]=4 10914 B11R1.13 COCc1cccc(c1I)C 7a_100012349780_200000210301 [1,2,0,0,0,0|1,0,0]=4 10915 B11R1.13 COCc1cccc(c1I)F 34a_100000692438_200000210301 [1,2,0,0,0,0|1,0,0]=4 10916 B11R1.13 COCc1cccc(c1I)F 34a_100138415774_100010149603 [1,2,0,0,0,0|1,0,0]=4 10917 B11R1.13 COCc1cccc(c1I)F 7a_100000692438_200000210301 [1,2,0,0,0,0|1,0,0]=4 10918 B11R1.13 COCc1cccc(c1N)Br 34a_100012349457_200000210301 [1,2,0,0,0,0|1,0,0]=4 10919 B11R1.13 COCc1cccc(c1N)C 34a_100011215590_200000210301 [1,2,0,0,0,0|1,0,0]=4 10920 B11R1.13 COCc1cccc(c1N)Cl 34a_100012182729_200000210301 [1,2,0,0,0,0|1,0,0]=4 10921 B11R1.13 COCc1cccc(c1N)F 34a_100000692437_200000210301 [1,2,0,0,0,0|1,0,0]=4 10922 B11R1.13 CSCc1cccc(c1Br)C 62a_200000210301_200012349612 [1,2,0,0,0,0|1,0,0]=4 10923 B11R1.13 CSCc1cccc(c1Br)C 62a_200012349612_200000210301 [1,2,0,0,0,0|1,0,0]=4 10924 B11R1.13 CSCc1cccc(c1Br)Cl 62a_100010145525_200000210301 [1,2,0,0,0,0|1,0,0]=4 10925 B11R1.13 CSCc1cccc(c1Br)Cl 62a_200000210301_100010145525 [1,2,0,0,0,0|1,0,0]=4 10926 B11R1.13 CSCc1cccc(c1Br)F 62a_100012351116_200000210301 [1,2,0,0,0,0|1,0,0]=4 10927 B11R1.13 CSCc1cccc(c1Br)F 62a_200000210301_100012351116 [1,2,0,0,0,0|1,0,0]=4 10928 B11R1.13 CSCc1cccc(c1Br)I 62a_100010254545_200000210301 [1,2,0,0,0,0|1,0,0]=4 10929 B11R1.13 CSCc1cccc(c1Br)I 62a_200000210301_100010254545 [1,2,0,0,0,0|1,0,0]=4 10930 B11R1.13 CSCc1cccc(c1C)Br 62a_100000694682_200000210301 [1,2,0,0,0,0|1,0,0]=4 10931 B11R1.13 CSCc1cccc(c1C)Br 62a_200000210301_100000694682 [1,2,0,0,0,0|1,0,0]=4 10932 B11R1.13 CSCc1cccc(c1C)C 62a_100011515928_200000210301 [1,2,0,0,0,0|1,0,0]=4 10933 B11R1.13 CSCc1cccc(c1C)C 62a_200000210301_100011515928 [1,2,0,0,0,0|1,0,0]=4 10934 B11R1.13 CSCc1cccc(c1C)Cl 62a_100012186920_200000210301 [1,2,0,0,0,0|1,0,0]=4 10935 B11R1.13 CSCc1cccc(c1C)Cl 62a_200000210301_100012186920 [1,2,0,0,0,0|1,0,0]=4 10936 B11R1.13 CSCc1cccc(c1C)F 62a_100009813626_200000210301 [1,2,0,0,0,0|1,0,0]=4 10937 B11R1.13 CSCc1cccc(c1C)F 62a_200000210301_100009813626 [1,2,0,0,0,0|1,0,0]=4 10938 B11R1.13 CSCc1cccc(c1C)I 62a_100010150147_200000210301 [1,2,0,0,0,0|1,0,0]=4 10939 B11R1.13 CSCc1cccc(c1C)I 62a_200000210301_100010150147 [1,2,0,0,0,0|1,0,0]=4 10940 B11R1.13 CSCc1cccc(c1Cl)Br 62a_100012349491_200000210301 [1,2,0,0,0,0|1,0,0]=4 10941 B11R1.13 CSCc1cccc(c1Cl)Br 62a_200000210301_100012349491 [1,2,0,0,0,0|1,0,0]=4 10942 B11R1.13 CSCc1cccc(c1Cl)Cl 62a_100000720918_200000210301 [1,2,0,0,0,0|1,0,0]=4 10943 B11R1.13 CSCc1cccc(c1Cl)Cl 62a_200000210301_100000723366 [1,2,0,0,0,0|1,0,0]=4 10944 B11R1.13 CSCc1cccc(c1Cl)F 62a_100000696688_200000210301 [1,2,0,0,0,0|1,0,0]=4 10945 B11R1.13 CSCc1cccc(c1Cl)F 62a_200000210301_100000696688 [1,2,0,0,0,0|1,0,0]=4 10946 B11R1.13 CSCc1cccc(c1F)Br 62a_100012356506_200000210301 [1,2,0,0,0,0|1,0,0]=4 10947 B11R1.13 CSCc1cccc(c1F)Br 62a_200000210301_100012356506 [1,2,0,0,0,0|1,0,0]=4 10948 B11R1.13 CSCc1cccc(c1F)C 62a_100011216058_200000210301 [1,2,0,0,0,0|1,0,0]=4 10949 B11R1.13 CSCc1cccc(c1F)C 62a_200000210301_100011216058 [1,2,0,0,0,0|1,0,0]=4 10950 B11R1.13 CSCc1cccc(c1F)Cl 62a_100000716733_200000210301 [1,2,0,0,0,0|1,0,0]=4 10951 B11R1.13 CSCc1cccc(c1F)Cl 62a_200000210301_100000716733 [1,2,0,0,0,0|1,0,0]=4 10952 B11R1.13 CSCc1cccc(c1F)F 62a_100000217499_200000210301 [1,2,0,0,0,0|1,0,0]=4 10953 B11R1.13 CSCc1cccc(c1F)F 62a_200000210301_100000217499 [1,2,0,0,0,0|1,0,0]=4 10954 B11R1.13 CSCc1cccc(c1I)F 62a_100010149603_200000210301 [1,2,0,0,0,0|1,0,0]=4 10955 B11R1.13 CSCc1cccc(c1I)F 62a_200000210301_100010149603 [1,2,0,0,0,0|1,0,0]=4 10956 B11R1.13 Cc1c(cccc1CN[13CH3])Br 34a_100000724210_200025704644 [1,2,0,0,0,0|1,0,0]=4 10957 B11R1.13 Cc1c(cccc1CN[13CH3])Cl 2230a_100020639605_200025704644 [1,2,0,0,0,0|1,0,0]=4 10958 B11R1.13 Cc1c(cccc1CN[13CH3])Cl 34a_100020639605_200025704644 [1,2,0,0,0,0|1,0,0]=4 10959 B11R1.13 Cc1c(cccc1CN[13CH3])F 2230a_100132306986_200025704644 [1,2,0,0,0,0|1,0,0]=4 10960 B11R1.13 Cc1c(cccc1CN[13CH3])F 34a_100132306986_200025704644 [1,2,0,0,0,0|1,0,0]=4 10961 B11R1.13 Cc1c(cccc1CO[13CH3])Br 34a_100000694458_200025704644 [1,2,0,0,0,0|1,0,0]=4 10962 B11R1.13 Cc1c(cccc1CO[13CH3])Br 7a_100000694458_200025704644 [1,2,0,0,0,0|1,0,0]=4 10963 B11R1.13 Cc1c(cccc1CO[13CH3])Cl 34a_100012000165_200025704644 [1,2,0,0,0,0|1,0,0]=4 10964 B11R1.13 Cc1c(cccc1CO[13CH3])Cl 7a_100012000165_200025704644 [1,2,0,0,0,0|1,0,0]=4 10965 B11R1.13 Cc1c(cccc1CO[13CH3])F 34a_100000042775_200025704644 [1,2,0,0,0,0|1,0,0]=4 10966 B11R1.13 Cc1c(cccc1CO[13CH3])F 7a_100000042775_200025704644 [1,2,0,0,0,0|1,0,0]=4 10967 B11R1.13 Cc1c(cccc1CO[13CH3])I 34a_100010150139_200025704644 [1,2,0,0,0,0|1,0,0]=4 10968 B11R1.13 Cc1c(cccc1CO[13CH3])I 7a_100010150139_200025704644 [1,2,0,0,0,0|1,0,0]=4 10969 B11R1.13 Cc1c(cccc1CO[13CH3])N 34a_102495339961_200025704644 [1,2,0,0,0,0|1,0,0]=4 10970 B11R1.13 Cc1c(cccc1CO[13CH3])N 7a_102495339961_200025704644 [1,2,0,0,0,0|1,0,0]=4 10971 B11R1.13 Cc1c(cccc1CS[13CH3])Br 62a_100000694682_200025704644 [1,2,0,0,0,0|1,0,0]=4 10972 B11R1.13 Cc1c(cccc1CS[13CH3])Br 62a_200025704644_100000694682 [1,2,0,0,0,0|1,0,0]=4 10973 B11R1.13 Cc1c(cccc1CS[13CH3])Cl 62a_100012186920_200025704644 [1,2,0,0,0,0|1,0,0]=4 10974 B11R1.13 Cc1c(cccc1CS[13CH3])Cl 62a_200025704644_100012186920 [1,2,0,0,0,0|1,0,0]=4 10975 B11R1.13 Cc1c(cccc1CS[13CH3])F 62a_100009813626_200025704644 [1,2,0,0,0,0|1,0,0]=4 10976 B11R1.13 Cc1c(cccc1CS[13CH3])F 62a_200025704644_100009813626 [1,2,0,0,0,0|1,0,0]=4 10977 B11R1.13 Cc1c(cccc1CS[13CH3])I 62a_100010150147_200025704644 [1,2,0,0,0,0|1,0,0]=4 10978 B11R1.13 Cc1c(cccc1CS[13CH3])I 62a_200025704644_100010150147 [1,2,0,0,0,0|1,0,0]=4 10979 B11R1.13 Cc1cccc(c1Br)CO[13CH3] 34a_100011659289_200025704644 [1,2,0,0,0,0|1,0,0]=4 10980 B11R1.13 Cc1cccc(c1Br)CO[13CH3] 7a_100011659289_200025704644 [1,2,0,0,0,0|1,0,0]=4 10981 B11R1.13 Cc1cccc(c1Br)CS[13CH3] 62a_200012349612_200025704644 [1,2,0,0,0,0|1,0,0]=4 10982 B11R1.13 Cc1cccc(c1Br)CS[13CH3] 62a_200025704644_200012349612 [1,2,0,0,0,0|1,0,0]=4 10983 B11R1.13 Cc1cccc(c1C)CN[13CH3] 2230a_100011211637_200025704644 [1,2,0,0,0,0|1,0,0]=4 10984 B11R1.13 Cc1cccc(c1C)CN[13CH3] 34a_100011211637_200025704644 [1,2,0,0,0,0|1,0,0]=4 10985 B11R1.13 Cc1cccc(c1C)CO[13CH3] 34a_100011219135_200025704644 [1,2,0,0,0,0|1,0,0]=4 10986 B11R1.13 Cc1cccc(c1C)CO[13CH3] 7a_100011219135_200025704644 [1,2,0,0,0,0|1,0,0]=4 10987 B11R1.13 Cc1cccc(c1C)CS[13CH3] 62a_100011515928_200025704644 [1,2,0,0,0,0|1,0,0]=4 10988 B11R1.13 Cc1cccc(c1C)CS[13CH3] 62a_200025704644_100011515928 [1,2,0,0,0,0|1,0,0]=4 10989 B11R1.13 Cc1cccc(c1Cl)CN[13CH3] 2230a_100025705714_200025704644 [1,2,0,0,0,0|1,0,0]=4 10990 B11R1.13 Cc1cccc(c1Cl)CN[13CH3] 34a_100025705714_200025704644 [1,2,0,0,0,0|1,0,0]=4 10991 B11R1.13 Cc1cccc(c1Cl)CO[13CH3] 34a_100000710031_200025704644 [1,2,0,0,0,0|1,0,0]=4 10992 B11R1.13 Cc1cccc(c1Cl)CO[13CH3] 7a_100000710031_200025704644 [1,2,0,0,0,0|1,0,0]=4 10993 B11R1.13 Cc1cccc(c1F)CN[13CH3] 2230a_100012002060_200025704644 [1,2,0,0,0,0|1,0,0]=4 10994 B11R1.13 Cc1cccc(c1F)CN[13CH3] 34a_100012002060_200025704644 [1,2,0,0,0,0|1,0,0]=4 10995 B11R1.13 Cc1cccc(c1F)CO[13CH3] 34a_200011219517_200025704644 [1,2,0,0,0,0|1,0,0]=4 10996 B11R1.13 Cc1cccc(c1F)CO[13CH3] 7a_200011219517_200025704644 [1,2,0,0,0,0|1,0,0]=4 10997 B11R1.13 Cc1cccc(c1F)CS[13CH3] 62a_100011216058_200025704644 [1,2,0,0,0,0|1,0,0]=4 10998 B11R1.13 Cc1cccc(c1F)CS[13CH3] 62a_200025704644_100011216058 [1,2,0,0,0,0|1,0,0]=4 10999 B11R1.13 Cc1cccc(c1I)CO[13CH3] 34a_100012349780_200025704644 [1,2,0,0,0,0|1,0,0]=4 11000 B11R1.13 Cc1cccc(c1I)CO[13CH3] 7a_100012349780_200025704644 [1,2,0,0,0,0|1,0,0]=4 11001 B11R1.13 Cc1cccc(c1N)CO[13CH3] 34a_100011215590_200025704644 [1,2,0,0,0,0|1,0,0]=4 11002 B11R1.13 Cc1cccc(c1O)CN[13CH3] 34a_100020639391_200025704644 [1,2,0,0,0,0|1,0,0]=4 11003 B11R1.13 [13CH3]NCc1cccc(c1Br)F 2230a_100020638964_200025704644 [1,2,0,0,0,0|1,0,0]=4 11004 B11R1.13 [13CH3]NCc1cccc(c1Br)F 34a_100020638964_200025704644 [1,2,0,0,0,0|1,0,0]=4 11005 B11R1.13 [13CH3]NCc1cccc(c1Cl)Cl 2230a_100011211633_200025704644 [1,2,0,0,0,0|1,0,0]=4 11006 B11R1.13 [13CH3]NCc1cccc(c1Cl)Cl 34a_100011211633_200025704644 [1,2,0,0,0,0|1,0,0]=4 11007 B11R1.13 [13CH3]NCc1cccc(c1Cl)F 2230a_100012001614_200025704644 [1,2,0,0,0,0|1,0,0]=4 11008 B11R1.13 [13CH3]NCc1cccc(c1Cl)F 34a_100012001614_200025704644 [1,2,0,0,0,0|1,0,0]=4 11009 B11R1.13 [13CH3]NCc1cccc(c1F)Br 2230a_100015189953_200025704644 [1,2,0,0,0,0|1,0,0]=4 11010 B11R1.13 [13CH3]NCc1cccc(c1F)Br 34a_100015189953_200025704644 [1,2,0,0,0,0|1,0,0]=4 11011 B11R1.13 [13CH3]NCc1cccc(c1F)Cl 2230a_100000764326_200025704644 [1,2,0,0,0,0|1,0,0]=4 11012 B11R1.13 [13CH3]NCc1cccc(c1F)Cl 34a_100000764326_200025704644 [1,2,0,0,0,0|1,0,0]=4 11013 B11R1.13 [13CH3]NCc1cccc(c1F)F 2230a_100011199105_200025704644 [1,2,0,0,0,0|1,0,0]=4 11014 B11R1.13 [13CH3]NCc1cccc(c1F)F 34a_100011199105_200025704644 [1,2,0,0,0,0|1,0,0]=4 11015 B11R1.13 [13CH3]NCc1cccc(c1F)O 34a_100025773512_200025704644 [1,2,0,0,0,0|1,0,0]=4 11016 B11R1.13 [13CH3]OCc1cccc(c1Br)Cl 34a_100010168166_200025704644 [1,2,0,0,0,0|1,0,0]=4 11017 B11R1.13 [13CH3]OCc1cccc(c1Br)Cl 7a_100010168166_200025704644 [1,2,0,0,0,0|1,0,0]=4 11018 B11R1.13 [13CH3]OCc1cccc(c1Br)F 34a_100012351117_200025704644 [1,2,0,0,0,0|1,0,0]=4 11019 B11R1.13 [13CH3]OCc1cccc(c1Br)F 7a_100012351117_200025704644 [1,2,0,0,0,0|1,0,0]=4 11020 B11R1.13 [13CH3]OCc1cccc(c1Br)I 34a_100010240205_200025704644 [1,2,0,0,0,0|1,0,0]=4 11021 B11R1.13 [13CH3]OCc1cccc(c1Br)I 7a_100010240205_200025704644 [1,2,0,0,0,0|1,0,0]=4 11022 B11R1.13 [13CH3]OCc1cccc(c1Cl)Br 34a_100012351182_200025704644 [1,2,0,0,0,0|1,0,0]=4 11023 B11R1.13 [13CH3]OCc1cccc(c1Cl)Br 7a_100012351182_200025704644 [1,2,0,0,0,0|1,0,0]=4 11024 B11R1.13 [13CH3]OCc1cccc(c1Cl)Cl 34a_100000720469_200025704644 [1,2,0,0,0,0|1,0,0]=4 11025 B11R1.13 [13CH3]OCc1cccc(c1Cl)Cl 7a_100000720469_200025704644 [1,2,0,0,0,0|1,0,0]=4 11026 B11R1.13 [13CH3]OCc1cccc(c1Cl)F 34a_100000696319_200025704644 [1,2,0,0,0,0|1,0,0]=4 11027 B11R1.13 [13CH3]OCc1cccc(c1Cl)F 7a_100000696319_200025704644 [1,2,0,0,0,0|1,0,0]=4 11028 B11R1.13 [13CH3]OCc1cccc(c1F)Br 34a_100011935076_200025704644 [1,2,0,0,0,0|1,0,0]=4 11029 B11R1.13 [13CH3]OCc1cccc(c1F)Br 7a_100011935076_200025704644 [1,2,0,0,0,0|1,0,0]=4 11030 B11R1.13 [13CH3]OCc1cccc(c1F)Cl 34a_100011216988_200025704644 [1,2,0,0,0,0|1,0,0]=4 11031 B11R1.13 [13CH3]OCc1cccc(c1F)Cl 7a_100011216988_200025704644 [1,2,0,0,0,0|1,0,0]=4 11032 B11R1.13 [13CH3]OCc1cccc(c1F)F 34a_100011218644_200025704644 [1,2,0,0,0,0|1,0,0]=4 11033 B11R1.13 [13CH3]OCc1cccc(c1F)F 7a_100011218644_200025704644 [1,2,0,0,0,0|1,0,0]=4 11034 B11R1.13 [13CH3]OCc1cccc(c1F)I 34a_200010235739_200025704644 [1,2,0,0,0,0|1,0,0]=4 11035 B11R1.13 [13CH3]OCc1cccc(c1F)I 7a_200010235739_200025704644 [1,2,0,0,0,0|1,0,0]=4 11036 B11R1.13 [13CH3]OCc1cccc(c1F)N 34a_100012023829_200025704644 [1,2,0,0,0,0|1,0,0]=4 11037 B11R1.13 [13CH3]OCc1cccc(c1I)Br 34a_100010146604_200025704644 [1,2,0,0,0,0|1,0,0]=4 11038 B11R1.13 [13CH3]OCc1cccc(c1I)Br 7a_100010146604_200025704644 [1,2,0,0,0,0|1,0,0]=4 11039 B11R1.13 [13CH3]OCc1cccc(c1I)F 34a_100000692438_200025704644 [1,2,0,0,0,0|1,0,0]=4 11040 B11R1.13 [13CH3]OCc1cccc(c1I)F 7a_100000692438_200025704644 [1,2,0,0,0,0|1,0,0]=4 11041 B11R1.13 [13CH3]OCc1cccc(c1N)Br 34a_100012349457_200025704644 [1,2,0,0,0,0|1,0,0]=4 11042 B11R1.13 [13CH3]OCc1cccc(c1N)Cl 34a_100012182729_200025704644 [1,2,0,0,0,0|1,0,0]=4 11043 B11R1.13 [13CH3]OCc1cccc(c1N)F 34a_100000692437_200025704644 [1,2,0,0,0,0|1,0,0]=4 11044 B11R1.13 [13CH3]SCc1cccc(c1Br)Cl 62a_100010145525_200025704644 [1,2,0,0,0,0|1,0,0]=4 11045 B11R1.13 [13CH3]SCc1cccc(c1Br)Cl 62a_200025704644_100010145525 [1,2,0,0,0,0|1,0,0]=4 11046 B11R1.13 [13CH3]SCc1cccc(c1Br)F 62a_100012351116_200025704644 [1,2,0,0,0,0|1,0,0]=4 11047 B11R1.13 [13CH3]SCc1cccc(c1Br)F 62a_200025704644_100012351116 [1,2,0,0,0,0|1,0,0]=4 11048 B11R1.13 [13CH3]SCc1cccc(c1Br)I 62a_100010254545_200025704644 [1,2,0,0,0,0|1,0,0]=4 11049 B11R1.13 [13CH3]SCc1cccc(c1Br)I 62a_200025704644_100010254545 [1,2,0,0,0,0|1,0,0]=4 11050 B11R1.13 [13CH3]SCc1cccc(c1Cl)Br 62a_100012349491_200025704644 [1,2,0,0,0,0|1,0,0]=4 11051 B11R1.13 [13CH3]SCc1cccc(c1Cl)Br 62a_200025704644_100012349491 [1,2,0,0,0,0|1,0,0]=4 11052 B11R1.13 [13CH3]SCc1cccc(c1Cl)Cl 62a_100000720918_200025704644 [1,2,0,0,0,0|1,0,0]=4 11053 B11R1.13 [13CH3]SCc1cccc(c1Cl)Cl 62a_200025704644_100000723366 [1,2,0,0,0,0|1,0,0]=4 11054 B11R1.13 [13CH3]SCc1cccc(c1Cl)F 62a_100000696688_200025704644 [1,2,0,0,0,0|1,0,0]=4 11055 B11R1.13 [13CH3]SCc1cccc(c1Cl)F 62a_200025704644_100000696688 [1,2,0,0,0,0|1,0,0]=4 11056 B11R1.13 [13CH3]SCc1cccc(c1F)Br 62a_100012356506_200025704644 [1,2,0,0,0,0|1,0,0]=4 11057 B11R1.13 [13CH3]SCc1cccc(c1F)Br 62a_200025704644_100012356506 [1,2,0,0,0,0|1,0,0]=4 11058 B11R1.13 [13CH3]SCc1cccc(c1F)Cl 62a_100000716733_200025704644 [1,2,0,0,0,0|1,0,0]=4 11059 B11R1.13 [13CH3]SCc1cccc(c1F)Cl 62a_200025704644_100000716733 [1,2,0,0,0,0|1,0,0]=4 11060 B11R1.13 [13CH3]SCc1cccc(c1F)F 62a_100000217499_200025704644 [1,2,0,0,0,0|1,0,0]=4 11061 B11R1.13 [13CH3]SCc1cccc(c1F)F 62a_200025704644_100000217499 [1,2,0,0,0,0|1,0,0]=4 11062 B11R1.13 [13CH3]SCc1cccc(c1I)F 62a_100010149603_200025704644 [1,2,0,0,0,0|1,0,0]=4 11063 B11R1.13 [13CH3]SCc1cccc(c1I)F 62a_200025704644_100010149603 [1,2,0,0,0,0|1,0,0]=4 11064 B11R1.17 C=CCNc1ccccc1Br 34a_100000210017_100015514636 [1,2,0,0,0,0|0,0,0]=3 11065 B11R1.17 C=CCNc1ccccc1C 34a_100015192222_100015514636 [1,2,0,0,0,0|0,0,0]=3 11066 B11R1.17 C=CCNc1ccccc1Cl 34a_100000185783_100015514636 [1,2,0,0,0,0|0,0,0]=3 11067 B11R1.17 C=CCNc1ccccc1F 34a_100000210422_100015514636 [1,2,0,0,0,0|0,0,0]=3 11068 B11R1.17 C=CCNc1ccccc1I 34a_100000210053_100015514636 [1,2,0,0,0,0|0,0,0]=3 11069 B11R1.17 C=CCNc1ccccc1O 34a_100000185747_100015514636 [1,2,0,0,0,0|0,0,0]=3 11070 B11R1.17 C=CCNc1ccncc1Br 27a_100020586998_100000726257 [1,2,0,0,0,0|1,0,0]=4 11071 B11R1.17 C=CCNc1ccncc1C 27a_100020586998_100000765111 [1,2,0,0,0,0|1,0,0]=4 11072 B11R1.17 C=CCNc1ccncc1F 27a_100020586998_100000035921 [1,2,0,0,0,0|1,0,0]=4 11073 B11R1.17 C=CCNc1ncccc1Br 27a_100020586998_100000696092 [1,2,0,0,0,0|1,0,0]=4 11074 B11R1.17 C=CCOc1cccc[n+]1[O-] 7a_100000211761_100015514636 [1,2,0,0,0,0|1,0,0]=4 11075 B11R1.17 C=CCOc1ccccc1Br 34a_100000181306_100015514636 [1,2,0,0,0,0|0,0,0]=3 11076 B11R1.17 C=CCOc1ccccc1Br 7a_100000181306_100015514636 [1,2,0,0,0,0|0,0,0]=3 11077 B11R1.17 C=CCOc1ccccc1C 34a_100000210338_100015514636 [1,2,0,0,0,0|0,0,0]=3 11078 B11R1.17 C=CCOc1ccccc1C 7a_100000210338_100015514636 [1,2,0,0,0,0|0,0,0]=3 11079 B11R1.17 C=CCOc1ccccc1Cl 34a_100000210172_100015514636 [1,2,0,0,0,0|0,0,0]=3 11080 B11R1.17 C=CCOc1ccccc1Cl 7a_100000210172_100015514636 [1,2,0,0,0,0|0,0,0]=3 11081 B11R1.17 C=CCOc1ccccc1F 34a_100000210171_100015514636 [1,2,0,0,0,0|0,0,0]=3 11082 B11R1.17 C=CCOc1ccccc1F 7a_100000210171_100015514636 [1,2,0,0,0,0|0,0,0]=3 11083 B11R1.17 C=CCOc1ccccc1I 34a_100000739446_100015514636 [1,2,0,0,0,0|0,0,0]=3 11084 B11R1.17 C=CCOc1ccccc1I 7a_100000739446_100015514636 [1,2,0,0,0,0|0,0,0]=3 11085 B11R1.17 C=CCOc1ccccc1N 34a_100000185747_100015514636 [1,2,0,0,0,0|0,0,0]=3 11086 B11R1.17 C=CCOc1ccccc1N 7a_100000185747_100015514636 [1,2,0,0,0,0|0,0,0]=3 11087 B11R1.17 C=CCOc1cccnc1Br 34a_100000744436_100015514636 [1,2,0,0,0,0|1,0,0]=4 11088 B11R1.17 C=CCOc1cccnc1Br 7a_100000744436_100015514636 [1,2,0,0,0,0|1,0,0]=4 11089 B11R1.17 C=CCOc1cccnc1C 34a_100000745507_100015514636 [1,2,0,0,0,0|1,0,0]=4 11090 B11R1.17 C=CCOc1cccnc1C 7a_100000745507_100015514636 [1,2,0,0,0,0|1,0,0]=4 11091 B11R1.17 C=CCOc1cccnc1Cl 34a_100000757616_100015514636 [1,2,0,0,0,0|1,0,0]=4 11092 B11R1.17 C=CCOc1cccnc1Cl 7a_100000757616_100015514636 [1,2,0,0,0,0|1,0,0]=4 11093 B11R1.17 C=CCOc1cccnc1F 34a_100000061740_100015514636 [1,2,0,0,0,0|1,0,0]=4 11094 B11R1.17 C=CCOc1cccnc1F 7a_100000061740_100015514636 [1,2,0,0,0,0|1,0,0]=4 11095 B11R1.17 C=CCOc1cccnc1I 34a_100000034122_100015514636 [1,2,0,0,0,0|1,0,0]=4 11096 B11R1.17 C=CCOc1cccnc1I 7a_100000034122_100015514636 [1,2,0,0,0,0|1,0,0]=4 11097 B11R1.17 C=CCOc1cccnc1N 34a_100000211975_100015514636 [1,2,0,0,0,0|1,0,0]=4 11098 B11R1.17 C=CCOc1cccnc1N 7a_100000211975_100015514636 [1,2,0,0,0,0|1,0,0]=4 11099 B11R1.17 C=CCOc1cccoc1=O 34a_100000077404_100015514636 [1,2,0,0,0,0|1,0,0]=4 11100 B11R1.17 C=CCOc1cccoc1=O 7a_100000077404_100015514636 [1,2,0,0,0,0|1,0,0]=4 11101 B11R1.17 C=CCOc1ccncc1Br 34a_100011996408_100015514636 [1,2,0,0,0,0|1,0,0]=4 11102 B11R1.17 C=CCOc1ccncc1C 34a_100000694293_100015514636 [1,2,0,0,0,0|1,0,0]=4 11103 B11R1.17 C=CCOc1ccncc1Cl 34a_100011997054_100015514636 [1,2,0,0,0,0|1,0,0]=4 11104 B11R1.17 C=CCOc1ccncc1F 34a_200000081243_100015514636 [1,2,0,0,0,0|1,0,0]=4 11105 B11R1.17 C=CCOc1cnccc1C 34a_100011997053_100015514636 [1,2,0,0,0,0|1,0,0]=4 11106 B11R1.17 C=CCOc1cnccc1C 7a_100011997053_100015514636 [1,2,0,0,0,0|1,0,0]=4 11107 B11R1.17 C=CCOc1cnccc1Cl 34a_100011996695_100015514636 [1,2,0,0,0,0|1,0,0]=4 11108 B11R1.17 C=CCOc1cnccc1I 34a_100000050107_100015514636 [1,2,0,0,0,0|1,0,0]=4 11109 B11R1.17 C=CCOc1cnccc1N 34a_100000753702_100015514636 [1,2,0,0,0,0|1,0,0]=4 11110 B11R1.17 C=CCOc1coccc1=O 34a_100000060831_100015514636 [1,2,0,0,0,0|1,0,0]=4 11111 B11R1.17 C=CCOc1ncccc1Cl 34a_100011290957_100015514636 [1,2,0,0,0,0|1,0,0]=4 11112 B11R1.17 C=CCOc1ncccc1F 34a_100011219419_100015514636 [1,2,0,0,0,0|1,0,0]=4 11113 B11R1.17 C=CCOc1ncccc1N 34a_100000746358_100015514636 [1,2,0,0,0,0|1,0,0]=4 11114 B11R1.17 C=CCSc1c[nH]ccc1=O 62a_100000210623_100009998708 [1,2,0,0,0,0|1,0,0]=4 11115 B11R1.17 C=CCSc1c[nH]ccc1=O 62a_100009998708_100000210623 [1,2,0,0,0,0|1,0,0]=4 11116 B11R1.17 C=CCSc1c[nH]ccc1=S 62a_100000210623_200012280681 [1,2,0,0,0,0|1,0,0]=4 11117 B11R1.17 C=CCSc1c[nH]ccc1=S 62a_200012280681_100000210623 [1,2,0,0,0,0|1,0,0]=4 11118 B11R1.17 C=CCSc1cccc[n+]1C 62a_100000210623_100000212160 [1,2,0,0,0,0|1,0,0]=4 11119 B11R1.17 C=CCSc1cccc[n+]1[O-] 62a_100000210623_200000042595 [1,2,0,0,0,0|1,0,0]=4 11120 B11R1.17 C=CCSc1ccccc1Br 62a_100000210623_100000695589 [1,2,0,0,0,0|0,0,0]=3 11121 B11R1.17 C=CCSc1ccccc1Br 62a_100000695589_100000210623 [1,2,0,0,0,0|0,0,0]=3 11122 B11R1.17 C=CCSc1ccccc1C 62a_100000210623_100000210755 [1,2,0,0,0,0|0,0,0]=3 11123 B11R1.17 C=CCSc1ccccc1C 62a_100000210755_100000210623 [1,2,0,0,0,0|0,0,0]=3 11124 B11R1.17 C=CCSc1ccccc1Cl 62a_100000210623_100000764095 [1,2,0,0,0,0|0,0,0]=3 11125 B11R1.17 C=CCSc1ccccc1Cl 62a_100000764095_100000210623 [1,2,0,0,0,0|0,0,0]=3 11126 B11R1.17 C=CCSc1ccccc1F 62a_100000210623_100011215700 [1,2,0,0,0,0|0,0,0]=3 11127 B11R1.17 C=CCSc1ccccc1F 62a_100011215700_100000210623 [1,2,0,0,0,0|0,0,0]=3 11128 B11R1.17 C=CCSc1ccccc1N 62a_100000210017_100000210623 [1,2,0,0,0,0|0,0,0]=3 11129 B11R1.17 C=CCSc1ccccc1N 62a_100000210623_100000210017 [1,2,0,0,0,0|0,0,0]=3 11130 B11R1.17 C=CCSc1ccccc1O 62a_100000210623_100000739446 [1,2,0,0,0,0|0,0,0]=3 11131 B11R1.17 C=CCSc1ccccc1O 62a_100000739446_100000210623 [1,2,0,0,0,0|0,0,0]=3 11132 B11R1.17 C=CCSc1cccnc1Br 62a_100000210623_100010202626 [1,2,0,0,0,0|1,0,0]=4 11133 B11R1.17 C=CCSc1cccnc1Br 62a_100010202626_100000210623 [1,2,0,0,0,0|1,0,0]=4 11134 B11R1.17 C=CCSc1cccnc1C 62a_100000210623_100000751574 [1,2,0,0,0,0|1,0,0]=4 11135 B11R1.17 C=CCSc1cccnc1C 62a_100000751574_100000210623 [1,2,0,0,0,0|1,0,0]=4 11136 B11R1.17 C=CCSc1cccnc1Cl 62a_100000036424_100000210623 [1,2,0,0,0,0|1,0,0]=4 11137 B11R1.17 C=CCSc1cccnc1Cl 62a_100000210623_100000036424 [1,2,0,0,0,0|1,0,0]=4 11138 B11R1.17 C=CCSc1cccnc1F 62a_100000210623_100009816115 [1,2,0,0,0,0|1,0,0]=4 11139 B11R1.17 C=CCSc1cccnc1F 62a_100009816115_100000210623 [1,2,0,0,0,0|1,0,0]=4 11140 B11R1.17 C=CCSc1cccnc1N 62a_100000045569_100000210623 [1,2,0,0,0,0|1,0,0]=4 11141 B11R1.17 C=CCSc1cccnc1N 62a_100000210623_100000045569 [1,2,0,0,0,0|1,0,0]=4 11142 B11R1.17 C=CCSc1cccnc1O 62a_100000210623_100000760158 [1,2,0,0,0,0|1,0,0]=4 11143 B11R1.17 C=CCSc1cccnc1O 62a_100000760158_100000210623 [1,2,0,0,0,0|1,0,0]=4 11144 B11R1.17 C=CCSc1ccncc1Br 62a_100000210623_100000726257 [1,2,0,0,0,0|1,0,0]=4 11145 B11R1.17 C=CCSc1ccncc1Br 62a_100000726257_100000210623 [1,2,0,0,0,0|1,0,0]=4 11146 B11R1.17 C=CCSc1ccncc1C 62a_100000210623_100000765111 [1,2,0,0,0,0|1,0,0]=4 11147 B11R1.17 C=CCSc1ccncc1C 62a_100000765111_100000210623 [1,2,0,0,0,0|1,0,0]=4 11148 B11R1.17 C=CCSc1ccncc1Cl 62a_100000210623_100000708259 [1,2,0,0,0,0|1,0,0]=4 11149 B11R1.17 C=CCSc1ccncc1Cl 62a_100000708259_100000210623 [1,2,0,0,0,0|1,0,0]=4 11150 B11R1.17 C=CCSc1ccncc1F 62a_100000047030_100000210623 [1,2,0,0,0,0|1,0,0]=4 11151 B11R1.17 C=CCSc1ccncc1F 62a_100000210623_100000047030 [1,2,0,0,0,0|1,0,0]=4 11152 B11R1.17 C=CCSc1ccncc1N 62a_100000210623_100000756074 [1,2,0,0,0,0|1,0,0]=4 11153 B11R1.17 C=CCSc1ccncc1N 62a_100000756074_100000210623 [1,2,0,0,0,0|1,0,0]=4 11154 B11R1.17 C=CCSc1ccncc1O 62a_100000210623_100009817591 [1,2,0,0,0,0|1,0,0]=4 11155 B11R1.17 C=CCSc1ccncc1O 62a_100009817591_100000210623 [1,2,0,0,0,0|1,0,0]=4 11156 B11R1.17 C=CCSc1cnccc1Br 62a_100000210623_100010138639 [1,2,0,0,0,0|1,0,0]=4 11157 B11R1.17 C=CCSc1cnccc1Br 62a_100010138639_100000210623 [1,2,0,0,0,0|1,0,0]=4 11158 B11R1.17 C=CCSc1cnccc1C 62a_100000210623_100000761580 [1,2,0,0,0,0|1,0,0]=4 11159 B11R1.17 C=CCSc1cnccc1C 62a_100000761580_100000210623 [1,2,0,0,0,0|1,0,0]=4 11160 B11R1.17 C=CCSc1cnccc1Cl 62a_100000210623_100009995489 [1,2,0,0,0,0|1,0,0]=4 11161 B11R1.17 C=CCSc1cnccc1Cl 62a_100009995489_100000210623 [1,2,0,0,0,0|1,0,0]=4 11162 B11R1.17 C=CCSc1cnccc1F 62a_100000210623_100009820683 [1,2,0,0,0,0|1,0,0]=4 11163 B11R1.17 C=CCSc1cnccc1F 62a_100009820683_100000210623 [1,2,0,0,0,0|1,0,0]=4 11164 B11R1.17 C=CCSc1cnccc1N 62a_100000047001_100000210623 [1,2,0,0,0,0|1,0,0]=4 11165 B11R1.17 C=CCSc1cnccc1N 62a_100000210623_100000047001 [1,2,0,0,0,0|1,0,0]=4 11166 B11R1.17 C=CCSc1ncccc1Br 62a_100000210623_100000696092 [1,2,0,0,0,0|1,0,0]=4 11167 B11R1.17 C=CCSc1ncccc1Br 62a_100000696092_100000210623 [1,2,0,0,0,0|1,0,0]=4 11168 B11R1.17 C=CCSc1ncccc1C 62a_100000210623_100000751373 [1,2,0,0,0,0|1,0,0]=4 11169 B11R1.17 C=CCSc1ncccc1C 62a_100000751373_100000210623 [1,2,0,0,0,0|1,0,0]=4 11170 B11R1.17 C=CCSc1ncccc1Cl 62a_100000210623_100011356963 [1,2,0,0,0,0|1,0,0]=4 11171 B11R1.17 C=CCSc1ncccc1Cl 62a_100011356963_100000210623 [1,2,0,0,0,0|1,0,0]=4 11172 B11R1.17 C=CCSc1ncccc1F 62a_100000210623_100000685392 [1,2,0,0,0,0|1,0,0]=4 11173 B11R1.17 C=CCSc1ncccc1F 62a_100000685392_100000210623 [1,2,0,0,0,0|1,0,0]=4 11174 B11R1.17 C=CCSc1ncccc1N 62a_100000210623_100000688686 [1,2,0,0,0,0|1,0,0]=4 11175 B11R1.17 C=CCSc1ncccc1N 62a_100000688686_100000210623 [1,2,0,0,0,0|1,0,0]=4 11176 B11R1.17 C=CCSc1ncccc1O 62a_100000034122_100000210623 [1,2,0,0,0,0|1,0,0]=4 11177 B11R1.17 C=CCSc1ncccc1O 62a_100000210623_100000034122 [1,2,0,0,0,0|1,0,0]=4 11178 B11R1.17 CC=NNc1ccccc1Br 4a_100000241748_200000210099 [1,2,0,0,0,0|1,0,0]=4 11179 B11R1.17 CC=NNc1ccccc1C 4a_100000184220_200000210099 [1,2,0,0,0,0|1,0,0]=4 11180 B11R1.17 CC=NNc1ccccc1Cl 4a_100000683529_200000210099 [1,2,0,0,0,0|1,0,0]=4 11181 B11R1.17 CC=NNc1ccccc1F 4a_100000239246_200000210099 [1,2,0,0,0,0|1,0,0]=4 11182 B11R1.17 CC=NNc1ccccc1I 4a_100011218156_200000210099 [1,2,0,0,0,0|1,0,0]=4 11183 B11R1.17 CCCCc1ccccc1Br 271570a_100020621405_100000695589 [1,2,0,0,0,0|0,0,1]=4 11184 B11R1.17 CCCCc1ccccc1C 271570a_100020621405_100000210755 [1,2,0,0,0,0|0,0,1]=4 11185 B11R1.17 CCCCc1ccccc1Cl 271570a_100020621405_100000764095 [1,2,0,0,0,0|0,0,1]=4 11186 B11R1.17 CCCCc1ccccc1F 271570a_100020621405_100011215700 [1,2,0,0,0,0|0,0,1]=4 11187 B11R1.17 CCCCc1ccccc1N 271570a_100020621405_100000210017 [1,2,0,0,0,0|0,0,1]=4 11188 B11R1.17 CCCCc1ccccc1O 271570a_100020621405_100000739446 [1,2,0,0,0,0|0,0,1]=4 11189 B11R1.17 CCCNc1ccccc1Br 34a_100000210017_100000210303 [1,2,0,0,0,0|0,0,1]=4 11190 B11R1.17 CCCNc1ccccc1C 34a_100015192222_100000210303 [1,2,0,0,0,0|0,0,1]=4 11191 B11R1.17 CCCNc1ccccc1Cl 34a_100000185783_100000210303 [1,2,0,0,0,0|0,0,1]=4 11192 B11R1.17 CCCNc1ccccc1F 34a_100000210422_100000210303 [1,2,0,0,0,0|0,0,1]=4 11193 B11R1.17 CCCNc1ccccc1I 34a_100000210053_100000210303 [1,2,0,0,0,0|0,0,1]=4 11194 B11R1.17 CCCNc1ccccc1O 34a_100000185747_100000210303 [1,2,0,0,0,0|0,0,1]=4 11195 B11R1.17 CCCOc1ccccc1Br 34a_100000181306_100000210303 [1,2,0,0,0,0|0,0,1]=4 11196 B11R1.17 CCCOc1ccccc1Br 7a_100000181306_100000210303 [1,2,0,0,0,0|0,0,1]=4 11197 B11R1.17 CCCOc1ccccc1C 34a_100000210338_100000210303 [1,2,0,0,0,0|0,0,1]=4 11198 B11R1.17 CCCOc1ccccc1C 7a_100000210338_100000210303 [1,2,0,0,0,0|0,0,1]=4 11199 B11R1.17 CCCOc1ccccc1Cl 34a_100000210172_100000210303 [1,2,0,0,0,0|0,0,1]=4 11200 B11R1.17 CCCOc1ccccc1Cl 7a_100000210172_100000210303 [1,2,0,0,0,0|0,0,1]=4 11201 B11R1.17 CCCOc1ccccc1F 34a_100000210171_100000210303 [1,2,0,0,0,0|0,0,1]=4 11202 B11R1.17 CCCOc1ccccc1F 7a_100000210171_100000210303 [1,2,0,0,0,0|0,0,1]=4 11203 B11R1.17 CCCOc1ccccc1I 34a_100000739446_100000210303 [1,2,0,0,0,0|0,0,1]=4 11204 B11R1.17 CCCOc1ccccc1I 7a_100000739446_100000210303 [1,2,0,0,0,0|0,0,1]=4 11205 B11R1.17 CCCOc1ccccc1N 34a_100000185747_100000210303 [1,2,0,0,0,0|0,0,1]=4 11206 B11R1.17 CCCOc1ccccc1N 7a_100000185747_100000210303 [1,2,0,0,0,0|0,0,1]=4 11207 B11R1.17 CCCOc1ccccc1O 271570a_203496583355_100000174042 [1,2,0,0,0,0|0,0,1]=4 11208 B11R1.17 CCCSc1ccccc1Br 62a_100000210303_100000695589 [1,2,0,0,0,0|0,0,1]=4 11209 B11R1.17 CCCSc1ccccc1Br 62a_100000695589_100000210303 [1,2,0,0,0,0|0,0,1]=4 11210 B11R1.17 CCCSc1ccccc1C 62a_100000210303_100000210755 [1,2,0,0,0,0|0,0,1]=4 11211 B11R1.17 CCCSc1ccccc1C 62a_100000210755_100000210303 [1,2,0,0,0,0|0,0,1]=4 11212 B11R1.17 CCCSc1ccccc1Cl 62a_100000210303_100000764095 [1,2,0,0,0,0|0,0,1]=4 11213 B11R1.17 CCCSc1ccccc1Cl 62a_100000764095_100000210303 [1,2,0,0,0,0|0,0,1]=4 11214 B11R1.17 CCCSc1ccccc1F 62a_100000210303_100011215700 [1,2,0,0,0,0|0,0,1]=4 11215 B11R1.17 CCCSc1ccccc1F 62a_100011215700_100000210303 [1,2,0,0,0,0|0,0,1]=4 11216 B11R1.17 CCCSc1ccccc1N 62a_100000210017_100000210303 [1,2,0,0,0,0|0,0,1]=4 11217 B11R1.17 CCCSc1ccccc1N 62a_100000210303_100000210017 [1,2,0,0,0,0|0,0,1]=4 11218 B11R1.17 CCCSc1ccccc1O 62a_100000210303_100000739446 [1,2,0,0,0,0|0,0,1]=4 11219 B11R1.17 CCCSc1ccccc1O 62a_100000739446_100000210303 [1,2,0,0,0,0|0,0,1]=4 11220 B11R1.17 CCNCc1ccccc1Br 207a_100015525214_100000211189 [1,2,0,0,0,0|0,0,1]=4 11221 B11R1.17 CCNCc1ccccc1Br 2230a_100000689332_100000210202 [1,2,0,0,0,0|0,0,1]=4 11222 B11R1.17 CCNCc1ccccc1Br 2230a_100015525214_100000184730 [1,2,0,0,0,0|0,0,1]=4 11223 B11R1.17 CCNCc1ccccc1Br 270004a_100015525214_100000211189 [1,2,0,0,0,0|0,0,1]=4 11224 B11R1.17 CCNCc1ccccc1Br 34a_100000689332_100000210202 [1,2,0,0,0,0|0,0,1]=4 11225 B11R1.17 CCNCc1ccccc1C 207a_100015525214_100000211143 [1,2,0,0,0,0|0,0,1]=4 11226 B11R1.17 CCNCc1ccccc1C 2230a_100015525214_100000211839 [1,2,0,0,0,0|0,0,1]=4 11227 B11R1.17 CCNCc1ccccc1C 270004a_100015525214_100000211143 [1,2,0,0,0,0|0,0,1]=4 11228 B11R1.17 CCNCc1ccccc1C 34a_100000174972_100000210202 [1,2,0,0,0,0|0,0,1]=4 11229 B11R1.17 CCNCc1ccccc1Cl 207a_100015525214_100000210073 [1,2,0,0,0,0|0,0,1]=4 11230 B11R1.17 CCNCc1ccccc1Cl 2230a_100000174879_100000210202 [1,2,0,0,0,0|0,0,1]=4 11231 B11R1.17 CCNCc1ccccc1Cl 2230a_100015525214_100000187162 [1,2,0,0,0,0|0,0,1]=4 11232 B11R1.17 CCNCc1ccccc1Cl 270004a_100015525214_100000210073 [1,2,0,0,0,0|0,0,1]=4 11233 B11R1.17 CCNCc1ccccc1Cl 34a_100000174879_100000210202 [1,2,0,0,0,0|0,0,1]=4 11234 B11R1.17 CCNCc1ccccc1F 207a_100015525214_100000210811 [1,2,0,0,0,0|0,0,1]=4 11235 B11R1.17 CCNCc1ccccc1F 2230a_100015525214_100000211605 [1,2,0,0,0,0|0,0,1]=4 11236 B11R1.17 CCNCc1ccccc1F 270004a_100015525214_100000210811 [1,2,0,0,0,0|0,0,1]=4 11237 B11R1.17 CCNCc1ccccc1F 34a_100000174869_100000210202 [1,2,0,0,0,0|0,0,1]=4 11238 B11R1.17 CCNCc1ccccc1I 207a_100015525214_100000010305 [1,2,0,0,0,0|0,0,1]=4 11239 B11R1.17 CCNCc1ccccc1I 2230a_100015525214_100011215278 [1,2,0,0,0,0|0,0,1]=4 11240 B11R1.17 CCNCc1ccccc1I 270004a_100015525214_100000010305 [1,2,0,0,0,0|0,0,1]=4 11241 B11R1.17 CCNCc1ccccc1O 34a_100000185550_100000210202 [1,2,0,0,0,0|0,0,1]=4 11242 B11R1.17 CCOCc1ccccc1Br 34a_100000756307_100000210202 [1,2,0,0,0,0|0,0,1]=4 11243 B11R1.17 CCOCc1ccccc1Br 34a_100121572206_100000184730 [1,2,0,0,0,0|0,0,1]=4 11244 B11R1.17 CCOCc1ccccc1Br 7a_100000756307_100000210202 [1,2,0,0,0,0|0,0,1]=4 11245 B11R1.17 CCOCc1ccccc1C 34a_100000698903_100000210202 [1,2,0,0,0,0|0,0,1]=4 11246 B11R1.17 CCOCc1ccccc1C 34a_100121572206_100000211839 [1,2,0,0,0,0|0,0,1]=4 11247 B11R1.17 CCOCc1ccccc1C 7a_100000698903_100000210202 [1,2,0,0,0,0|0,0,1]=4 11248 B11R1.17 CCOCc1ccccc1Cl 34a_100000210847_100000210202 [1,2,0,0,0,0|0,0,1]=4 11249 B11R1.17 CCOCc1ccccc1Cl 34a_100121572206_100000187162 [1,2,0,0,0,0|0,0,1]=4 11250 B11R1.17 CCOCc1ccccc1Cl 7a_100000210847_100000210202 [1,2,0,0,0,0|0,0,1]=4 11251 B11R1.17 CCOCc1ccccc1F 34a_100000211962_100000210202 [1,2,0,0,0,0|0,0,1]=4 11252 B11R1.17 CCOCc1ccccc1F 34a_100121572206_100000211605 [1,2,0,0,0,0|0,0,1]=4 11253 B11R1.17 CCOCc1ccccc1F 7a_100000211962_100000210202 [1,2,0,0,0,0|0,0,1]=4 11254 B11R1.17 CCOCc1ccccc1I 34a_100000187465_100000210202 [1,2,0,0,0,0|0,0,1]=4 11255 B11R1.17 CCOCc1ccccc1I 34a_100121572206_100011215278 [1,2,0,0,0,0|0,0,1]=4 11256 B11R1.17 CCOCc1ccccc1I 7a_100000187465_100000210202 [1,2,0,0,0,0|0,0,1]=4 11257 B11R1.17 CCOCc1ccccc1N 34a_100000212039_100000210202 [1,2,0,0,0,0|0,0,1]=4 11258 B11R1.17 CCOCc1ccccc1O 271570a_203496583355_200011493690 [1,2,0,0,0,0|0,0,1]=4 11259 B11R1.17 CCSCc1ccccc1Br 62a_100000184730_100000210202 [1,2,0,0,0,0|0,0,1]=4 11260 B11R1.17 CCSCc1ccccc1Br 62a_100000210202_100000184730 [1,2,0,0,0,0|0,0,1]=4 11261 B11R1.17 CCSCc1ccccc1C 62a_100000210202_100000211839 [1,2,0,0,0,0|0,0,1]=4 11262 B11R1.17 CCSCc1ccccc1C 62a_100000211839_100000210202 [1,2,0,0,0,0|0,0,1]=4 11263 B11R1.17 CCSCc1ccccc1Cl 62a_100000187162_100000210202 [1,2,0,0,0,0|0,0,1]=4 11264 B11R1.17 CCSCc1ccccc1Cl 62a_100000210202_100000187162 [1,2,0,0,0,0|0,0,1]=4 11265 B11R1.17 CCSCc1ccccc1F 62a_100000210202_100000211605 [1,2,0,0,0,0|0,0,1]=4 11266 B11R1.17 CCSCc1ccccc1F 62a_100000211605_100000210202 [1,2,0,0,0,0|0,0,1]=4 11267 B11R1.17 CCSCc1ccccc1I 62a_100000210202_100011216222 [1,2,0,0,0,0|0,0,1]=4 11268 B11R1.17 CCSCc1ccccc1I 62a_100011216222_100000210202 [1,2,0,0,0,0|0,0,1]=4 11269 B11R1.17 CCSCc1ccccc1O 271570a_203496583355_200000173030 [1,2,0,0,0,0|0,0,1]=4 11270 B11R1.17 CNCCc1ccccc1Br 2230a_100000747383_200000210301 [1,2,0,0,0,0|0,0,1]=4 11271 B11R1.17 CNCCc1ccccc1Br 2230a_106832991635_100012161201 [1,2,0,0,0,0|0,0,1]=4 11272 B11R1.17 CNCCc1ccccc1Br 34a_100000747383_200000210301 [1,2,0,0,0,0|0,0,1]=4 11273 B11R1.17 CNCCc1ccccc1Br 34a_100102657272_100012161201 [1,2,0,0,0,0|0,0,1]=4 11274 B11R1.17 CNCCc1ccccc1Br 7a_106832991635_100012161201 [1,2,0,0,0,0|0,0,1]=4 11275 B11R1.17 CNCCc1ccccc1C 2230a_100000685071_200000210301 [1,2,0,0,0,0|0,0,1]=4 11276 B11R1.17 CNCCc1ccccc1C 2230a_106832991635_100011713688 [1,2,0,0,0,0|0,0,1]=4 11277 B11R1.17 CNCCc1ccccc1C 34a_100000685071_200000210301 [1,2,0,0,0,0|0,0,1]=4 11278 B11R1.17 CNCCc1ccccc1C 34a_100102657272_100011713688 [1,2,0,0,0,0|0,0,1]=4 11279 B11R1.17 CNCCc1ccccc1C 7a_106832991635_100011713688 [1,2,0,0,0,0|0,0,1]=4 11280 B11R1.17 CNCCc1ccccc1Cl 2230a_100011207228_200000210301 [1,2,0,0,0,0|0,0,1]=4 11281 B11R1.17 CNCCc1ccccc1Cl 2230a_106832991635_100011713703 [1,2,0,0,0,0|0,0,1]=4 11282 B11R1.17 CNCCc1ccccc1Cl 270004a_106832991635_200011713468 [1,2,0,0,0,0|0,0,1]=4 11283 B11R1.17 CNCCc1ccccc1Cl 34a_100011207228_200000210301 [1,2,0,0,0,0|0,0,1]=4 11284 B11R1.17 CNCCc1ccccc1Cl 34a_100102657272_100011713703 [1,2,0,0,0,0|0,0,1]=4 11285 B11R1.17 CNCCc1ccccc1Cl 7a_106832991635_100011713703 [1,2,0,0,0,0|0,0,1]=4 11286 B11R1.17 CNCCc1ccccc1F 2230a_100000185272_200000210301 [1,2,0,0,0,0|0,0,1]=4 11287 B11R1.17 CNCCc1ccccc1F 2230a_106832991635_100011713696 [1,2,0,0,0,0|0,0,1]=4 11288 B11R1.17 CNCCc1ccccc1F 34a_100000185272_200000210301 [1,2,0,0,0,0|0,0,1]=4 11289 B11R1.17 CNCCc1ccccc1F 34a_100102657272_100000720011 [1,2,0,0,0,0|0,0,1]=4 11290 B11R1.17 CNCCc1ccccc1F 7a_106832991635_100000720011 [1,2,0,0,0,0|0,0,1]=4 11291 B11R1.17 CNCCc1ccccc1O 34a_100011207237_200000210301 [1,2,0,0,0,0|0,0,1]=4 11292 B11R1.17 CNCCc1ccccc1O 34a_100102657272_100000722297 [1,2,0,0,0,0|0,0,1]=4 11293 B11R1.17 CNCCc1ccccc1O 7a_106832991635_100000722297 [1,2,0,0,0,0|0,0,1]=4 11294 B11R1.17 COCCc1ccccc1Br 34a_100000731337_200000210301 [1,2,0,0,0,0|0,0,1]=4 11295 B11R1.17 COCCc1ccccc1Br 34a_100138415774_100012161201 [1,2,0,0,0,0|0,0,1]=4 11296 B11R1.17 COCCc1ccccc1Br 7a_100000731337_200000210301 [1,2,0,0,0,0|0,0,1]=4 11297 B11R1.17 COCCc1ccccc1C 34a_100011220023_200000210301 [1,2,0,0,0,0|0,0,1]=4 11298 B11R1.17 COCCc1ccccc1C 34a_100138415774_100011713688 [1,2,0,0,0,0|0,0,1]=4 11299 B11R1.17 COCCc1ccccc1C 7a_100011220023_200000210301 [1,2,0,0,0,0|0,0,1]=4 11300 B11R1.17 COCCc1ccccc1Cl 34a_100011215284_200000210301 [1,2,0,0,0,0|0,0,1]=4 11301 B11R1.17 COCCc1ccccc1Cl 34a_100138415774_100011713703 [1,2,0,0,0,0|0,0,1]=4 11302 B11R1.17 COCCc1ccccc1Cl 7a_100011215284_200000210301 [1,2,0,0,0,0|0,0,1]=4 11303 B11R1.17 COCCc1ccccc1F 34a_100000753711_200000210301 [1,2,0,0,0,0|0,0,1]=4 11304 B11R1.17 COCCc1ccccc1F 34a_100138415774_100000720011 [1,2,0,0,0,0|0,0,1]=4 11305 B11R1.17 COCCc1ccccc1F 7a_100000753711_200000210301 [1,2,0,0,0,0|0,0,1]=4 11306 B11R1.17 COCCc1ccccc1I 34a_100010255290_200000210301 [1,2,0,0,0,0|0,0,1]=4 11307 B11R1.17 COCCc1ccccc1I 7a_100010255290_200000210301 [1,2,0,0,0,0|0,0,1]=4 11308 B11R1.17 COCCc1ccccc1N 34a_100011215289_200000210301 [1,2,0,0,0,0|0,0,1]=4 11309 B11R1.17 COCCc1ccccc1O 34a_100138415774_100000722297 [1,2,0,0,0,0|0,0,1]=4 11310 B11R1.17 COCOc1ccccc1O 271570a_203496583355_200000230759 [1,2,0,0,0,0|1,0,0]=4 11311 B11R1.17 COCSc1ccccc1Br 62a_100000695589_100000766300 [1,2,0,0,0,0|1,0,0]=4 11312 B11R1.17 COCSc1ccccc1Br 62a_100000766300_100000695589 [1,2,0,0,0,0|1,0,0]=4 11313 B11R1.17 COCSc1ccccc1C 62a_100000210755_100000766300 [1,2,0,0,0,0|1,0,0]=4 11314 B11R1.17 COCSc1ccccc1C 62a_100000766300_100000210755 [1,2,0,0,0,0|1,0,0]=4 11315 B11R1.17 COCSc1ccccc1Cl 62a_100000764095_100000766300 [1,2,0,0,0,0|1,0,0]=4 11316 B11R1.17 COCSc1ccccc1Cl 62a_100000766300_100000764095 [1,2,0,0,0,0|1,0,0]=4 11317 B11R1.17 COCSc1ccccc1F 62a_100000766300_100011215700 [1,2,0,0,0,0|1,0,0]=4 11318 B11R1.17 COCSc1ccccc1F 62a_100011215700_100000766300 [1,2,0,0,0,0|1,0,0]=4 11319 B11R1.17 COCSc1ccccc1N 62a_100000210017_100000766300 [1,2,0,0,0,0|1,0,0]=4 11320 B11R1.17 COCSc1ccccc1N 62a_100000766300_100000210017 [1,2,0,0,0,0|1,0,0]=4 11321 B11R1.17 COCSc1ccccc1O 62a_100000739446_100000766300 [1,2,0,0,0,0|1,0,0]=4 11322 B11R1.17 COCSc1ccccc1O 62a_100000766300_100000739446 [1,2,0,0,0,0|1,0,0]=4 11323 B11R1.17 CSCCc1ccccc1Br 62a_100012161201_200000210301 [1,2,0,0,0,0|0,0,1]=4 11324 B11R1.17 CSCCc1ccccc1Br 62a_200000210301_100012161201 [1,2,0,0,0,0|0,0,1]=4 11325 B11R1.17 CSCCc1ccccc1C 62a_100011713688_200000210301 [1,2,0,0,0,0|0,0,1]=4 11326 B11R1.17 CSCCc1ccccc1C 62a_200000210301_100011713688 [1,2,0,0,0,0|0,0,1]=4 11327 B11R1.17 CSCCc1ccccc1Cl 62a_100011713703_200000210301 [1,2,0,0,0,0|0,0,1]=4 11328 B11R1.17 CSCCc1ccccc1Cl 62a_200000210301_100011713703 [1,2,0,0,0,0|0,0,1]=4 11329 B11R1.17 CSCCc1ccccc1F 62a_100011713696_200000210301 [1,2,0,0,0,0|0,0,1]=4 11330 B11R1.17 CSCCc1ccccc1F 62a_200000210301_100011713696 [1,2,0,0,0,0|0,0,1]=4 11331 B11R1.17 CSCCc1ccccc1O 62a_100000722297_200000210301 [1,2,0,0,0,0|0,0,1]=4 11332 B11R1.17 CSCCc1ccccc1O 62a_200000210301_100000722297 [1,2,0,0,0,0|0,0,1]=4 11333 B11R1.17 CSCNc1ccccc1Br 34a_100000210017_100011218213 [1,2,0,0,0,0|1,0,0]=4 11334 B11R1.17 CSCNc1ccccc1C 34a_100015192222_100011218213 [1,2,0,0,0,0|1,0,0]=4 11335 B11R1.17 CSCNc1ccccc1Cl 34a_100000185783_100011218213 [1,2,0,0,0,0|1,0,0]=4 11336 B11R1.17 CSCNc1ccccc1F 34a_100000210422_100011218213 [1,2,0,0,0,0|1,0,0]=4 11337 B11R1.17 CSCNc1ccccc1I 34a_100000210053_100011218213 [1,2,0,0,0,0|1,0,0]=4 11338 B11R1.17 CSCNc1ccccc1O 34a_100000185747_100011218213 [1,2,0,0,0,0|1,0,0]=4 11339 B11R1.17 CSCOc1ccccc1Br 34a_100000181306_100011218213 [1,2,0,0,0,0|1,0,0]=4 11340 B11R1.17 CSCOc1ccccc1C 34a_100000210338_100011218213 [1,2,0,0,0,0|1,0,0]=4 11341 B11R1.17 CSCOc1ccccc1Cl 34a_100000210172_100011218213 [1,2,0,0,0,0|1,0,0]=4 11342 B11R1.17 CSCOc1ccccc1F 34a_100000210171_100011218213 [1,2,0,0,0,0|1,0,0]=4 11343 B11R1.17 CSCOc1ccccc1I 34a_100000739446_100011218213 [1,2,0,0,0,0|1,0,0]=4 11344 B11R1.17 CSCOc1ccccc1N 34a_100000185747_100011218213 [1,2,0,0,0,0|1,0,0]=4 11345 B11R1.17 CSCSc1ccccc1Br 62a_100000695589_100011218213 [1,2,0,0,0,0|1,0,0]=4 11346 B11R1.17 CSCSc1ccccc1Br 62a_100011218213_100000695589 [1,2,0,0,0,0|1,0,0]=4 11347 B11R1.17 CSCSc1ccccc1C 62a_100000210755_100011218213 [1,2,0,0,0,0|1,0,0]=4 11348 B11R1.17 CSCSc1ccccc1C 62a_100011218213_100000210755 [1,2,0,0,0,0|1,0,0]=4 11349 B11R1.17 CSCSc1ccccc1Cl 62a_100000764095_100011218213 [1,2,0,0,0,0|1,0,0]=4 11350 B11R1.17 CSCSc1ccccc1Cl 62a_100011218213_100000764095 [1,2,0,0,0,0|1,0,0]=4 11351 B11R1.17 CSCSc1ccccc1F 62a_100011215700_100011218213 [1,2,0,0,0,0|1,0,0]=4 11352 B11R1.17 CSCSc1ccccc1F 62a_100011218213_100011215700 [1,2,0,0,0,0|1,0,0]=4 11353 B11R1.17 CSCSc1ccccc1N 62a_100000210017_100011218213 [1,2,0,0,0,0|1,0,0]=4 11354 B11R1.17 CSCSc1ccccc1N 62a_100011218213_100000210017 [1,2,0,0,0,0|1,0,0]=4 11355 B11R1.17 CSCSc1ccccc1O 62a_100000739446_100011218213 [1,2,0,0,0,0|1,0,0]=4 11356 B11R1.17 CSCSc1ccccc1O 62a_100011218213_100000739446 [1,2,0,0,0,0|1,0,0]=4 11357 B11R1.17 Cc1ccccc1CCN[13CH3] 2230a_100000685071_200025704644 [1,2,0,0,0,0|0,0,1]=4 11358 B11R1.17 Cc1ccccc1CCN[13CH3] 34a_100000685071_200025704644 [1,2,0,0,0,0|0,0,1]=4 11359 B11R1.17 Cc1ccccc1CCO[13CH3] 34a_100011220023_200025704644 [1,2,0,0,0,0|0,0,1]=4 11360 B11R1.17 Cc1ccccc1CCO[13CH3] 7a_100011220023_200025704644 [1,2,0,0,0,0|0,0,1]=4 11361 B11R1.17 Cc1ccccc1CCS[13CH3] 62a_100011713688_200025704644 [1,2,0,0,0,0|0,0,1]=4 11362 B11R1.17 Cc1ccccc1CCS[13CH3] 62a_200025704644_100011713688 [1,2,0,0,0,0|0,0,1]=4 11363 B11R1.17 Cc1ccccc1CNCF 34a_100000174972_100015361967 [1,2,0,0,0,0|1,0,0]=4 11364 B11R1.17 Cc1ccccc1COCF 34a_100000698903_100015361967 [1,2,0,0,0,0|1,0,0]=4 11365 B11R1.17 Cc1ccccc1COCF 7a_100000698903_100015361967 [1,2,0,0,0,0|1,0,0]=4 11366 B11R1.17 Cc1ccccc1CSCF 62a_100000211839_100015361967 [1,2,0,0,0,0|1,0,0]=4 11367 B11R1.17 Cc1ccccc1CSCF 62a_100015361967_100000211839 [1,2,0,0,0,0|1,0,0]=4 11368 B11R1.17 Cc1ccccc1NCC=O 34a_100015192222_200009817547 [1,2,0,0,0,0|1,0,0]=4 11369 B11R1.17 Cc1ccccc1OCC=O 34a_100000210338_200009817547 [1,2,0,0,0,0|1,0,0]=4 11370 B11R1.17 Cc1ccccc1OCC=O 7a_100000210338_200015260668 [1,2,0,0,0,0|1,0,0]=4 11371 B11R1.17 Cc1ccccc1SCC=O 62a_100000210755_200015260668 [1,2,0,0,0,0|1,0,0]=4 11372 B11R1.17 Cc1ccccc1SCC=O 62a_200015260668_100000210755 [1,2,0,0,0,0|1,0,0]=4 11373 B11R1.17 FCNCc1ccccc1Br 34a_100000689332_100015361967 [1,2,0,0,0,0|1,0,0]=4 11374 B11R1.17 FCNCc1ccccc1Cl 34a_100000174879_100015361967 [1,2,0,0,0,0|1,0,0]=4 11375 B11R1.17 FCNCc1ccccc1F 34a_100000174869_100015361967 [1,2,0,0,0,0|1,0,0]=4 11376 B11R1.17 FCOCc1ccccc1Br 34a_100000756307_100015361967 [1,2,0,0,0,0|1,0,0]=4 11377 B11R1.17 FCOCc1ccccc1Br 7a_100000756307_100015361967 [1,2,0,0,0,0|1,0,0]=4 11378 B11R1.17 FCOCc1ccccc1Cl 34a_100000210847_100015361967 [1,2,0,0,0,0|1,0,0]=4 11379 B11R1.17 FCOCc1ccccc1Cl 7a_100000210847_100015361967 [1,2,0,0,0,0|1,0,0]=4 11380 B11R1.17 FCOCc1ccccc1F 34a_100000211962_100015361967 [1,2,0,0,0,0|1,0,0]=4 11381 B11R1.17 FCOCc1ccccc1F 7a_100000211962_100015361967 [1,2,0,0,0,0|1,0,0]=4 11382 B11R1.17 FCOCc1ccccc1I 34a_100000187465_100015361967 [1,2,0,0,0,0|1,0,0]=4 11383 B11R1.17 FCOCc1ccccc1I 7a_100000187465_100015361967 [1,2,0,0,0,0|1,0,0]=4 11384 B11R1.17 FCSCc1ccccc1Br 62a_100000184730_100015361967 [1,2,0,0,0,0|1,0,0]=4 11385 B11R1.17 FCSCc1ccccc1Br 62a_100015361967_100000184730 [1,2,0,0,0,0|1,0,0]=4 11386 B11R1.17 FCSCc1ccccc1Cl 62a_100000187162_100015361967 [1,2,0,0,0,0|1,0,0]=4 11387 B11R1.17 FCSCc1ccccc1Cl 62a_100015361967_100000187162 [1,2,0,0,0,0|1,0,0]=4 11388 B11R1.17 FCSCc1ccccc1F 62a_100000211605_100015361967 [1,2,0,0,0,0|1,0,0]=4 11389 B11R1.17 FCSCc1ccccc1F 62a_100015361967_100000211605 [1,2,0,0,0,0|1,0,0]=4 11390 B11R1.17 FCSCc1ccccc1I 62a_100011216222_100015361967 [1,2,0,0,0,0|1,0,0]=4 11391 B11R1.17 FCSCc1ccccc1I 62a_100015361967_100011216222 [1,2,0,0,0,0|1,0,0]=4 11392 B11R1.17 Nc1ccccc1COCF 34a_100000212039_100015361967 [1,2,0,0,0,0|1,0,0]=4 11393 B11R1.17 Nc1ccccc1OCC=O 34a_100000185747_200009817547 [1,2,0,0,0,0|1,0,0]=4 11394 B11R1.17 Nc1ccccc1OCC=O 7a_100000185747_200015260668 [1,2,0,0,0,0|1,0,0]=4 11395 B11R1.17 Nc1ccccc1SCC=O 62a_100000210017_200015260668 [1,2,0,0,0,0|1,0,0]=4 11396 B11R1.17 Nc1ccccc1SCC=O 62a_200015260668_100000210017 [1,2,0,0,0,0|1,0,0]=4 11397 B11R1.17 O=CCCc1ccccc1O 271570a_203496583355_100011713448 [1,2,0,0,0,0|0,0,1]=4 11398 B11R1.17 O=CCNc1ccccc1Br 34a_100000210017_200009817547 [1,2,0,0,0,0|1,0,0]=4 11399 B11R1.17 O=CCNc1ccccc1Cl 34a_100000185783_200009817547 [1,2,0,0,0,0|1,0,0]=4 11400 B11R1.17 O=CCNc1ccccc1F 34a_100000210422_200009817547 [1,2,0,0,0,0|1,0,0]=4 11401 B11R1.17 O=CCNc1ccccc1I 34a_100000210053_200009817547 [1,2,0,0,0,0|1,0,0]=4 11402 B11R1.17 O=CCNc1ccccc1O 34a_100000185747_200009817547 [1,2,0,0,0,0|1,0,0]=4 11403 B11R1.17 O=CCOc1ccccc1Br 34a_100000181306_200009817547 [1,2,0,0,0,0|1,0,0]=4 11404 B11R1.17 O=CCOc1ccccc1Br 7a_100000181306_200015260668 [1,2,0,0,0,0|1,0,0]=4 11405 B11R1.17 O=CCOc1ccccc1Cl 34a_100000210172_200009817547 [1,2,0,0,0,0|1,0,0]=4 11406 B11R1.17 O=CCOc1ccccc1Cl 7a_100000210172_200015260668 [1,2,0,0,0,0|1,0,0]=4 11407 B11R1.17 O=CCOc1ccccc1F 34a_100000210171_200009817547 [1,2,0,0,0,0|1,0,0]=4 11408 B11R1.17 O=CCOc1ccccc1F 7a_100000210171_200015260668 [1,2,0,0,0,0|1,0,0]=4 11409 B11R1.17 O=CCOc1ccccc1I 34a_100000739446_200009817547 [1,2,0,0,0,0|1,0,0]=4 11410 B11R1.17 O=CCOc1ccccc1I 7a_100000739446_200015260668 [1,2,0,0,0,0|1,0,0]=4 11411 B11R1.17 O=CCSc1ccccc1Br 62a_100000695589_200015260668 [1,2,0,0,0,0|1,0,0]=4 11412 B11R1.17 O=CCSc1ccccc1Br 62a_200015260668_100000695589 [1,2,0,0,0,0|1,0,0]=4 11413 B11R1.17 O=CCSc1ccccc1Cl 62a_100000764095_200015260668 [1,2,0,0,0,0|1,0,0]=4 11414 B11R1.17 O=CCSc1ccccc1Cl 62a_200015260668_100000764095 [1,2,0,0,0,0|1,0,0]=4 11415 B11R1.17 O=CCSc1ccccc1F 62a_100011215700_200015260668 [1,2,0,0,0,0|1,0,0]=4 11416 B11R1.17 O=CCSc1ccccc1F 62a_200015260668_100011215700 [1,2,0,0,0,0|1,0,0]=4 11417 B11R1.17 O=CCSc1ccccc1O 62a_100000739446_200015260668 [1,2,0,0,0,0|1,0,0]=4 11418 B11R1.17 O=CCSc1ccccc1O 62a_200015260668_100000739446 [1,2,0,0,0,0|1,0,0]=4 11419 B11R1.17 OCCCc1ccccc1O 271570a_203496583355_100000699526 [1,2,0,0,0,0|0,0,1]=4 11420 B11R1.17 Oc1ccccc1CNCF 34a_100000185550_100015361967 [1,2,0,0,0,0|1,0,0]=4 11421 B11R1.17 [13CH3]NCCc1ccccc1Br 2230a_100000747383_200025704644 [1,2,0,0,0,0|0,0,1]=4 11422 B11R1.17 [13CH3]NCCc1ccccc1Br 34a_100000747383_200025704644 [1,2,0,0,0,0|0,0,1]=4 11423 B11R1.17 [13CH3]NCCc1ccccc1Cl 2230a_100011207228_200025704644 [1,2,0,0,0,0|0,0,1]=4 11424 B11R1.17 [13CH3]NCCc1ccccc1Cl 34a_100011207228_200025704644 [1,2,0,0,0,0|0,0,1]=4 11425 B11R1.17 [13CH3]NCCc1ccccc1F 2230a_100000185272_200025704644 [1,2,0,0,0,0|0,0,1]=4 11426 B11R1.17 [13CH3]NCCc1ccccc1F 34a_100000185272_200025704644 [1,2,0,0,0,0|0,0,1]=4 11427 B11R1.17 [13CH3]NCCc1ccccc1O 34a_100011207237_200025704644 [1,2,0,0,0,0|0,0,1]=4 11428 B11R1.17 [13CH3]OCCc1ccccc1Br 34a_100000731337_200025704644 [1,2,0,0,0,0|0,0,1]=4 11429 B11R1.17 [13CH3]OCCc1ccccc1Br 7a_100000731337_200025704644 [1,2,0,0,0,0|0,0,1]=4 11430 B11R1.17 [13CH3]OCCc1ccccc1Cl 34a_100011215284_200025704644 [1,2,0,0,0,0|0,0,1]=4 11431 B11R1.17 [13CH3]OCCc1ccccc1Cl 7a_100011215284_200025704644 [1,2,0,0,0,0|0,0,1]=4 11432 B11R1.17 [13CH3]OCCc1ccccc1F 34a_100000753711_200025704644 [1,2,0,0,0,0|0,0,1]=4 11433 B11R1.17 [13CH3]OCCc1ccccc1F 7a_100000753711_200025704644 [1,2,0,0,0,0|0,0,1]=4 11434 B11R1.17 [13CH3]OCCc1ccccc1I 34a_100010255290_200025704644 [1,2,0,0,0,0|0,0,1]=4 11435 B11R1.17 [13CH3]OCCc1ccccc1I 7a_100010255290_200025704644 [1,2,0,0,0,0|0,0,1]=4 11436 B11R1.17 [13CH3]OCCc1ccccc1N 34a_100011215289_200025704644 [1,2,0,0,0,0|0,0,1]=4 11437 B11R1.17 [13CH3]SCCc1ccccc1Br 62a_100012161201_200025704644 [1,2,0,0,0,0|0,0,1]=4 11438 B11R1.17 [13CH3]SCCc1ccccc1Br 62a_200025704644_100012161201 [1,2,0,0,0,0|0,0,1]=4 11439 B11R1.17 [13CH3]SCCc1ccccc1Cl 62a_100011713703_200025704644 [1,2,0,0,0,0|0,0,1]=4 11440 B11R1.17 [13CH3]SCCc1ccccc1Cl 62a_200025704644_100011713703 [1,2,0,0,0,0|0,0,1]=4 11441 B11R1.17 [13CH3]SCCc1ccccc1F 62a_100011713696_200025704644 [1,2,0,0,0,0|0,0,1]=4 11442 B11R1.17 [13CH3]SCCc1ccccc1F 62a_200025704644_100011713696 [1,2,0,0,0,0|0,0,1]=4 11443 B11R1.17 [13CH3]SCCc1ccccc1O 62a_100000722297_200025704644 [1,2,0,0,0,0|0,0,1]=4 11444 B11R1.17 [13CH3]SCCc1ccccc1O 62a_200025704644_100000722297 [1,2,0,0,0,0|0,0,1]=4 11445 B11R1.41 C#Cc1ccccc1CNC 34a_100020634229_200000210301 [1,2,0,0,0,0|1,0,0]=4 11446 B11R1.41 C#Cc1ccccc1CN[13CH3] 34a_100020634229_200025704644 [1,2,0,0,0,0|1,0,0]=4 11447 B11R1.41 C#Cc1ccccc1COC 34a_100000054652_200000210301 [1,2,0,0,0,0|1,0,0]=4 11448 B11R1.41 C#Cc1ccccc1COC 7a_100000054652_200000210301 [1,2,0,0,0,0|1,0,0]=4 11449 B11R1.41 C#Cc1ccccc1CO[13CH3] 34a_100000054652_200025704644 [1,2,0,0,0,0|1,0,0]=4 11450 B11R1.41 C#Cc1ccccc1CO[13CH3] 7a_100000054652_200025704644 [1,2,0,0,0,0|1,0,0]=4 11451 B11R1.41 C/C=C/c1ccccc1OC 34a_200000189419_200000210301 [1,2,0,0,0,0|0,0,1]=4 11452 B11R1.41 C/C=C/c1ccccc1OC 7a_200000189419_200000210301 [1,2,0,0,0,0|0,0,1]=4 11453 B11R1.41 C/C=C/c1ccccc1O[13CH3] 34a_200000189419_200025704644 [1,2,0,0,0,0|0,0,1]=4 11454 B11R1.41 C/C=C/c1ccccc1O[13CH3] 7a_200000189419_200025704644 [1,2,0,0,0,0|0,0,1]=4 11455 B11R1.41 C=CCc1ccccc1C=C 271570a_100011290941_100009828059 [1,2,0,0,0,0|0,0,0]=3 11456 B11R1.41 C=CCc1ccccc1NC 2230a_200138433279_200000210301 [1,2,0,0,0,0|0,0,0]=3 11457 B11R1.41 C=CCc1ccccc1NC 34a_200138433279_200000210301 [1,2,0,0,0,0|0,0,0]=3 11458 B11R1.41 C=CCc1ccccc1N[13CH3] 2230a_200138433279_200025704644 [1,2,0,0,0,0|0,0,0]=3 11459 B11R1.41 C=CCc1ccccc1N[13CH3] 34a_200138433279_200025704644 [1,2,0,0,0,0|0,0,0]=3 11460 B11R1.41 C=CCc1ccccc1OC 34a_100000211836_200000210301 [1,2,0,0,0,0|0,0,0]=3 11461 B11R1.41 C=CCc1ccccc1OC 7a_100000211836_200000210301 [1,2,0,0,0,0|0,0,0]=3 11462 B11R1.41 C=CCc1ccccc1O[13CH3] 34a_100000211836_200025704644 [1,2,0,0,0,0|0,0,0]=3 11463 B11R1.41 C=CCc1ccccc1O[13CH3] 7a_100000211836_200025704644 [1,2,0,0,0,0|0,0,0]=3 11464 B11R1.41 C=CCc1ccccc1SC 62a_100009828059_200000210301 [1,2,0,0,0,0|0,0,0]=3 11465 B11R1.41 C=CCc1ccccc1SC 62a_200000210301_100009828059 [1,2,0,0,0,0|0,0,0]=3 11466 B11R1.41 C=CCc1ccccc1S[13CH3] 62a_100009828059_200025704644 [1,2,0,0,0,0|0,0,0]=3 11467 B11R1.41 C=CCc1ccccc1S[13CH3] 62a_200025704644_100009828059 [1,2,0,0,0,0|0,0,0]=3 11468 B11R1.41 C=Cc1ccccc1CNC 271570a_100011290941_100000184654 [1,2,0,0,0,0|1,0,0]=4 11469 B11R1.41 C=Cc1ccccc1COC 271570a_100011290941_100011493684 [1,2,0,0,0,0|1,0,0]=4 11470 B11R1.41 C=Cc1ccccc1COC 34a_200010883148_200000210301 [1,2,0,0,0,0|1,0,0]=4 11471 B11R1.41 C=Cc1ccccc1COC 7a_200010883148_200000210301 [1,2,0,0,0,0|1,0,0]=4 11472 B11R1.41 C=Cc1ccccc1CO[13CH3] 34a_200010883148_200025704644 [1,2,0,0,0,0|1,0,0]=4 11473 B11R1.41 C=Cc1ccccc1CO[13CH3] 7a_200010883148_200025704644 [1,2,0,0,0,0|1,0,0]=4 11474 B11R1.41 C=Cc1ccccc1CSC 271570a_100011290941_100000148299 [1,2,0,0,0,0|1,0,0]=4 11475 B11R1.41 CC=Cc1ccccc1C#N 271570a_100016259895_100000188569 [1,2,0,0,0,0|0,0,1]=4 11476 B11R1.41 CC=Cc1ccccc1C=O 271570a_100016259895_100000211189 [1,2,0,0,0,0|0,0,1]=4 11477 B11R1.41 CC=Cc1ccccc1CC 271570a_100016259895_100011215823 [1,2,0,0,0,0|0,0,1]=4 11478 B11R1.41 CC=Cc1ccccc1CN 271570a_100016259895_100000689332 [1,2,0,0,0,0|0,0,1]=4 11479 B11R1.41 CC=Cc1ccccc1CO 271570a_100016259895_100000187465 [1,2,0,0,0,0|0,0,1]=4 11480 B11R1.41 CC=Cc1ccccc1NC 271570a_100016259895_100020606079 [1,2,0,0,0,0|0,0,1]=4 11481 B11R1.41 CC=Cc1ccccc1NN 271570a_100016259895_100000241748 [1,2,0,0,0,0|0,0,1]=4 11482 B11R1.41 CC=Cc1ccccc1OC 271570a_100016259895_100000174000 [1,2,0,0,0,0|0,0,1]=4 11483 B11R1.41 CC=Cc1ccccc1SC 271570a_100016259895_100011217816 [1,2,0,0,0,0|0,0,1]=4 11484 B11R1.41 CCCc1ccccc1NC 2230a_100000737634_200000210301 [1,2,0,0,0,0|0,0,1]=4 11485 B11R1.41 CCCc1ccccc1NC 34a_100000737634_200000210301 [1,2,0,0,0,0|0,0,1]=4 11486 B11R1.41 CCCc1ccccc1NC 7a_100000737634_200000210301 [1,2,0,0,0,0|0,0,1]=4 11487 B11R1.41 CCCc1ccccc1N[13CH3] 2230a_100000737634_200025704644 [1,2,0,0,0,0|0,0,1]=4 11488 B11R1.41 CCCc1ccccc1N[13CH3] 34a_100000737634_200025704644 [1,2,0,0,0,0|0,0,1]=4 11489 B11R1.41 CCCc1ccccc1N[13CH3] 7a_100000737634_200025704644 [1,2,0,0,0,0|0,0,1]=4 11490 B11R1.41 CCCc1ccccc1OC 34a_100011217252_200000210301 [1,2,0,0,0,0|0,0,1]=4 11491 B11R1.41 CCCc1ccccc1OC 7a_100011217252_200000210301 [1,2,0,0,0,0|0,0,1]=4 11492 B11R1.41 CCCc1ccccc1O[13CH3] 34a_100011217252_200025704644 [1,2,0,0,0,0|0,0,1]=4 11493 B11R1.41 CCCc1ccccc1O[13CH3] 7a_100011217252_200025704644 [1,2,0,0,0,0|0,0,1]=4 11494 B11R1.41 CCc1ccccc1CNC 207a_100102657272_100011219594 [1,2,0,0,0,0|1,0,0]=4 11495 B11R1.41 CCc1ccccc1CNC 270004a_106832991635_100011219594 [1,2,0,0,0,0|1,0,0]=4 11496 B11R1.41 CCc1ccccc1COC 34a_100011663872_200000210301 [1,2,0,0,0,0|1,0,0]=4 11497 B11R1.41 CCc1ccccc1COC 7a_100011663872_200000210301 [1,2,0,0,0,0|1,0,0]=4 11498 B11R1.41 CCc1ccccc1CO[13CH3] 34a_100011663872_200025704644 [1,2,0,0,0,0|1,0,0]=4 11499 B11R1.41 CCc1ccccc1CO[13CH3] 7a_100011663872_200025704644 [1,2,0,0,0,0|1,0,0]=4 11500 B11R1.41 CNCc1ccccc1C#N 2230a_106832991635_100000181865 [1,2,0,0,0,0|1,0,0]=4 11501 B11R1.41 CNCc1ccccc1C#N 34a_100016989011_200000210301 [1,2,0,0,0,0|1,0,0]=4 11502 B11R1.41 CNCc1ccccc1C#N 34a_100102657272_100000181865 [1,2,0,0,0,0|1,0,0]=4 11503 B11R1.41 CNCc1ccccc1C#N 7a_106832991635_100000181865 [1,2,0,0,0,0|1,0,0]=4 11504 B11R1.41 CNCc1ccccc1C=O 2230a_106832991635_200009853537 [1,2,0,0,0,0|1,0,0]=4 11505 B11R1.41 CNCc1ccccc1C=O 34a_100102657272_200009853537 [1,2,0,0,0,0|1,0,0]=4 11506 B11R1.41 CNCc1ccccc1C=O 7a_106832991635_200009853537 [1,2,0,0,0,0|1,0,0]=4 11507 B11R1.41 CNCc1ccccc1CO 2230a_106832991635_100009816955 [1,2,0,0,0,0|1,0,0]=4 11508 B11R1.41 CNCc1ccccc1CO 34a_100102657272_100009816955 [1,2,0,0,0,0|1,0,0]=4 11509 B11R1.41 CNCc1ccccc1CO 7a_106832991635_100009816955 [1,2,0,0,0,0|1,0,0]=4 11510 B11R1.41 CNCc1ccccc1OC 207a_100102657272_100000169842 [1,2,0,0,0,0|1,0,0]=4 11511 B11R1.41 CNCc1ccccc1OC 2230a_106832991635_100000210004 [1,2,0,0,0,0|1,0,0]=4 11512 B11R1.41 CNCc1ccccc1OC 270004a_106832991635_100000169842 [1,2,0,0,0,0|1,0,0]=4 11513 B11R1.41 CNCc1ccccc1OC 34a_100000188900_200000210301 [1,2,0,0,0,0|1,0,0]=4 11514 B11R1.41 CNCc1ccccc1OC 34a_100015189988_200000210301 [1,2,0,0,0,0|1,0,0]=4 11515 B11R1.41 CNCc1ccccc1OC 34a_100102657272_100000210004 [1,2,0,0,0,0|1,0,0]=4 11516 B11R1.41 CNCc1ccccc1OC 7a_106832991635_100000210004 [1,2,0,0,0,0|1,0,0]=4 11517 B11R1.41 CNCc1ccccc1O[13CH3] 34a_100015189988_200025704644 [1,2,0,0,0,0|1,0,0]=4 11518 B11R1.41 CNCc1ccccc1SC 207a_100102657272_100011217347 [1,2,0,0,0,0|1,0,0]=4 11519 B11R1.41 CNCc1ccccc1SC 2230a_106832991635_100000699184 [1,2,0,0,0,0|1,0,0]=4 11520 B11R1.41 CNCc1ccccc1SC 270004a_106832991635_100011217347 [1,2,0,0,0,0|1,0,0]=4 11521 B11R1.41 CNCc1ccccc1SC 34a_100102657272_100000699184 [1,2,0,0,0,0|1,0,0]=4 11522 B11R1.41 CNCc1ccccc1SC 34a_102495365025_200000210301 [1,2,0,0,0,0|1,0,0]=4 11523 B11R1.41 CNCc1ccccc1SC 62a_100000184654_200000210301 [1,2,0,0,0,0|1,0,0]=4 11524 B11R1.41 CNCc1ccccc1SC 62a_200000210301_100000184654 [1,2,0,0,0,0|1,0,0]=4 11525 B11R1.41 CNCc1ccccc1SC 7a_106832991635_100000699184 [1,2,0,0,0,0|1,0,0]=4 11526 B11R1.41 CNCc1ccccc1S[13CH3] 62a_100000184654_200025704644 [1,2,0,0,0,0|1,0,0]=4 11527 B11R1.41 CNCc1ccccc1S[13CH3] 62a_200025704644_100000184654 [1,2,0,0,0,0|1,0,0]=4 11528 B11R1.41 COCc1ccccc1C#N 34a_100138415774_100000181865 [1,2,0,0,0,0|1,0,0]=4 11529 B11R1.41 COCc1ccccc1C#N 34a_200011269968_200000210301 [1,2,0,0,0,0|1,0,0]=4 11530 B11R1.41 COCc1ccccc1C#N 7a_200011269968_200000210301 [1,2,0,0,0,0|1,0,0]=4 11531 B11R1.41 COCc1ccccc1C=O 34a_100138415774_200009853537 [1,2,0,0,0,0|1,0,0]=4 11532 B11R1.41 COCc1ccccc1CBr 34a_100009816955_200000210301 [1,2,0,0,0,0|1,0,0]=4 11533 B11R1.41 COCc1ccccc1CBr 7a_100009816955_200000210301 [1,2,0,0,0,0|1,0,0]=4 11534 B11R1.41 COCc1ccccc1CN 34a_100000743596_200000210301 [1,2,0,0,0,0|1,0,0]=4 11535 B11R1.41 COCc1ccccc1CO 34a_100138415774_100009816955 [1,2,0,0,0,0|1,0,0]=4 11536 B11R1.41 COCc1ccccc1OC 34a_100000211301_200000210301 [1,2,0,0,0,0|1,0,0]=4 11537 B11R1.41 COCc1ccccc1OC 34a_100011488565_200000210301 [1,2,0,0,0,0|1,0,0]=4 11538 B11R1.41 COCc1ccccc1OC 34a_100138415774_100000210004 [1,2,0,0,0,0|1,0,0]=4 11539 B11R1.41 COCc1ccccc1OC 7a_100011488565_200000210301 [1,2,0,0,0,0|1,0,0]=4 11540 B11R1.41 COCc1ccccc1O[13CH3] 34a_100011488565_200025704644 [1,2,0,0,0,0|1,0,0]=4 11541 B11R1.41 COCc1ccccc1O[13CH3] 7a_100011488565_200025704644 [1,2,0,0,0,0|1,0,0]=4 11542 B11R1.41 COCc1ccccc1SC 34a_100000699167_200000210301 [1,2,0,0,0,0|1,0,0]=4 11543 B11R1.41 COCc1ccccc1SC 34a_100138415774_100000699184 [1,2,0,0,0,0|1,0,0]=4 11544 B11R1.41 COCc1ccccc1SC 62a_100011493684_200000210301 [1,2,0,0,0,0|1,0,0]=4 11545 B11R1.41 COCc1ccccc1SC 62a_200000210301_100011493684 [1,2,0,0,0,0|1,0,0]=4 11546 B11R1.41 COCc1ccccc1S[13CH3] 62a_100011493684_200025704644 [1,2,0,0,0,0|1,0,0]=4 11547 B11R1.41 COCc1ccccc1S[13CH3] 62a_200025704644_100011493684 [1,2,0,0,0,0|1,0,0]=4 11548 B11R1.41 COc1ccccc1CN[13CH3] 34a_100000188900_200025704644 [1,2,0,0,0,0|1,0,0]=4 11549 B11R1.41 COc1ccccc1CO[13CH3] 34a_100000211301_200025704644 [1,2,0,0,0,0|1,0,0]=4 11550 B11R1.41 COc1ccccc1CSC 62a_100000210004_200000210301 [1,2,0,0,0,0|1,0,0]=4 11551 B11R1.41 COc1ccccc1CSC 62a_200000210301_100000210004 [1,2,0,0,0,0|1,0,0]=4 11552 B11R1.41 COc1ccccc1CS[13CH3] 62a_100000210004_200025704644 [1,2,0,0,0,0|1,0,0]=4 11553 B11R1.41 COc1ccccc1CS[13CH3] 62a_200025704644_100000210004 [1,2,0,0,0,0|1,0,0]=4 11554 B11R1.41 CSCc1ccccc1C#N 62a_100000186380_200000210301 [1,2,0,0,0,0|1,0,0]=4 11555 B11R1.41 CSCc1ccccc1C#N 62a_200000210301_100000181865 [1,2,0,0,0,0|1,0,0]=4 11556 B11R1.41 CSCc1ccccc1C=O 62a_200000210301_200009853537 [1,2,0,0,0,0|1,0,0]=4 11557 B11R1.41 CSCc1ccccc1C=O 62a_200009853537_200000210301 [1,2,0,0,0,0|1,0,0]=4 11558 B11R1.41 CSCc1ccccc1CO 62a_100009816955_200000210301 [1,2,0,0,0,0|1,0,0]=4 11559 B11R1.41 CSCc1ccccc1CO 62a_200000210301_100009816955 [1,2,0,0,0,0|1,0,0]=4 11560 B11R1.41 CSCc1ccccc1SC 62a_100000148299_200000210301 [1,2,0,0,0,0|1,0,0]=4 11561 B11R1.41 CSCc1ccccc1SC 62a_100000699184_200000210301 [1,2,0,0,0,0|1,0,0]=4 11562 B11R1.41 CSCc1ccccc1SC 62a_200000210301_100000148299 [1,2,0,0,0,0|1,0,0]=4 11563 B11R1.41 CSCc1ccccc1SC 62a_200000210301_100000699184 [1,2,0,0,0,0|1,0,0]=4 11564 B11R1.41 CSCc1ccccc1S[13CH3] 62a_100000148299_200025704644 [1,2,0,0,0,0|1,0,0]=4 11565 B11R1.41 CSCc1ccccc1S[13CH3] 62a_200025704644_100000148299 [1,2,0,0,0,0|1,0,0]=4 11566 B11R1.41 CSc1ccccc1CN[13CH3] 34a_102495365025_200025704644 [1,2,0,0,0,0|1,0,0]=4 11567 B11R1.41 CSc1ccccc1CO[13CH3] 34a_100000699167_200025704644 [1,2,0,0,0,0|1,0,0]=4 11568 B11R1.41 CSc1ccccc1CS[13CH3] 62a_100000699184_200025704644 [1,2,0,0,0,0|1,0,0]=4 11569 B11R1.41 CSc1ccccc1CS[13CH3] 62a_200025704644_100000699184 [1,2,0,0,0,0|1,0,0]=4 11570 B11R1.41 [13CH3]NCc1ccccc1C#N 34a_100016989011_200025704644 [1,2,0,0,0,0|1,0,0]=4 11571 B11R1.41 [13CH3]OCc1ccccc1C#N 34a_200011269968_200025704644 [1,2,0,0,0,0|1,0,0]=4 11572 B11R1.41 [13CH3]OCc1ccccc1C#N 7a_200011269968_200025704644 [1,2,0,0,0,0|1,0,0]=4 11573 B11R1.41 [13CH3]OCc1ccccc1CBr 34a_100009816955_200025704644 [1,2,0,0,0,0|1,0,0]=4 11574 B11R1.41 [13CH3]OCc1ccccc1CBr 7a_100009816955_200025704644 [1,2,0,0,0,0|1,0,0]=4 11575 B11R1.41 [13CH3]OCc1ccccc1CN 34a_100000743596_200025704644 [1,2,0,0,0,0|1,0,0]=4 11576 B11R1.41 [13CH3]SCc1ccccc1C#N 62a_100000186380_200025704644 [1,2,0,0,0,0|1,0,0]=4 11577 B11R1.41 [13CH3]SCc1ccccc1C#N 62a_200025704644_100000181865 [1,2,0,0,0,0|1,0,0]=4 11578 B11R1.41 [13CH3]SCc1ccccc1C=O 62a_200009853537_200025704644 [1,2,0,0,0,0|1,0,0]=4 11579 B11R1.41 [13CH3]SCc1ccccc1C=O 62a_200025704644_200009853537 [1,2,0,0,0,0|1,0,0]=4 11580 B11R1.41 [13CH3]SCc1ccccc1CO 62a_100009816955_200025704644 [1,2,0,0,0,0|1,0,0]=4 11581 B11R1.41 [13CH3]SCc1ccccc1CO 62a_200025704644_100009816955 [1,2,0,0,0,0|1,0,0]=4 11582 B11R1.182 CC=Cc1cc(ccc1Br)Br 271570a_100016259895_100011483371 [1,2,0,0,0,0|0,0,1]=4 11583 B11R1.182 CC=Cc1cc(ccc1Br)C 271570a_100016259895_100012353751 [1,2,0,0,0,0|0,0,1]=4 11584 B11R1.182 CC=Cc1cc(ccc1Br)Cl 271570a_100016259895_100012339723 [1,2,0,0,0,0|0,0,1]=4 11585 B11R1.182 CC=Cc1cc(ccc1Br)F 271570a_100016259895_100011217576 [1,2,0,0,0,0|0,0,1]=4 11586 B11R1.182 CC=Cc1cc(ccc1Br)N 271570a_100016259895_100000750459 [1,2,0,0,0,0|0,0,1]=4 11587 B11R1.182 CC=Cc1cc(ccc1Br)O 271570a_100016259895_100012339312 [1,2,0,0,0,0|0,0,1]=4 11588 B11R1.182 CC=Cc1cc(ccc1C)Br 271570a_100016259895_100011344865 [1,2,0,0,0,0|0,0,1]=4 11589 B11R1.182 CC=Cc1cc(ccc1C)C 271570a_100016259895_100000210833 [1,2,0,0,0,0|0,0,1]=4 11590 B11R1.182 CC=Cc1cc(ccc1C)Cl 271570a_100016259895_100011263213 [1,2,0,0,0,0|0,0,1]=4 11591 B11R1.182 CC=Cc1cc(ccc1C)F 271570a_100016259895_100011218078 [1,2,0,0,0,0|0,0,1]=4 11592 B11R1.182 CC=Cc1cc(ccc1C)N 271570a_100016259895_100000736455 [1,2,0,0,0,0|0,0,1]=4 11593 B11R1.182 CC=Cc1cc(ccc1C)O 271570a_100016259895_100011380479 [1,2,0,0,0,0|0,0,1]=4 11594 B11R1.182 CC=Cc1cc(ccc1Cl)Br 271570a_100016259895_100011772130 [1,2,0,0,0,0|0,0,1]=4 11595 B11R1.182 CC=Cc1cc(ccc1Cl)C 271570a_100016259895_100012356289 [1,2,0,0,0,0|0,0,1]=4 11596 B11R1.182 CC=Cc1cc(ccc1Cl)Cl 271570a_100016259895_100000707729 [1,2,0,0,0,0|0,0,1]=4 11597 B11R1.182 CC=Cc1cc(ccc1Cl)F 271570a_100016259895_100011217299 [1,2,0,0,0,0|0,0,1]=4 11598 B11R1.182 CC=Cc1cc(ccc1Cl)N 271570a_100016259895_100012360549 [1,2,0,0,0,0|0,0,1]=4 11599 B11R1.182 CC=Cc1cc(ccc1Cl)O 271570a_100016259895_100000049588 [1,2,0,0,0,0|0,0,1]=4 11600 B11R1.182 CC=Cc1cc(ccc1F)Br 271570a_100016259895_100011217312 [1,2,0,0,0,0|0,0,1]=4 11601 B11R1.182 CC=Cc1cc(ccc1F)C 271570a_100016259895_100000736223 [1,2,0,0,0,0|0,0,1]=4 11602 B11R1.182 CC=Cc1cc(ccc1F)Cl 271570a_100016259895_100011218116 [1,2,0,0,0,0|0,0,1]=4 11603 B11R1.182 CC=Cc1cc(ccc1F)F 271570a_100016259895_100000750033 [1,2,0,0,0,0|0,0,1]=4 11604 B11R1.182 CC=Cc1cc(ccc1F)N 271570a_100016259895_100000760356 [1,2,0,0,0,0|0,0,1]=4 11605 B11R1.182 CC=Cc1cc(ccc1F)O 271570a_100016259895_100000693481 [1,2,0,0,0,0|0,0,1]=4 11606 B11R1.182 CC=Cc1cc(ccc1N)Br 271570a_100016259895_100000187925 [1,2,0,0,0,0|0,0,1]=4 11607 B11R1.182 CC=Cc1cc(ccc1N)C 271570a_100016259895_100000210942 [1,2,0,0,0,0|0,0,1]=4 11608 B11R1.182 CC=Cc1cc(ccc1N)Cl 271570a_100016259895_100000761889 [1,2,0,0,0,0|0,0,1]=4 11609 B11R1.182 CC=Cc1cc(ccc1N)F 271570a_100016259895_100000760547 [1,2,0,0,0,0|0,0,1]=4 11610 B11R1.182 CC=Cc1cc(ccc1N)N 271570a_100016259895_100011534242 [1,2,0,0,0,0|0,0,1]=4 11611 B11R1.182 CC=Cc1cc(ccc1N)O 271570a_100016259895_100012001276 [1,2,0,0,0,0|0,0,1]=4 11612 B11R1.182 CC=Cc1cc(ccc1O)Br 271570a_100016259895_100012355227 [1,2,0,0,0,0|0,0,1]=4 11613 B11R1.182 CC=Cc1cc(ccc1O)C 271570a_100016259895_100000765521 [1,2,0,0,0,0|0,0,1]=4 11614 B11R1.182 CC=Cc1cc(ccc1O)Cl 271570a_100016259895_100011356953 [1,2,0,0,0,0|0,0,1]=4 11615 B11R1.182 CC=Cc1cc(ccc1O)F 271570a_100016259895_100000211999 [1,2,0,0,0,0|0,0,1]=4 11616 B11R1.182 CC=Cc1cc(ccc1O)N 271570a_100016259895_100011534360 [1,2,0,0,0,0|0,0,1]=4 11617 B11R1.182 CC=Cc1cc(ccc1O)O 271570a_100016259895_100009813629 [1,2,0,0,0,0|0,0,1]=4 11618 B11R1.182 CNCc1cc(ccc1Br)Br 207a_100102657272_100011266429 [1,2,0,0,0,0|1,0,0]=4 11619 B11R1.182 CNCc1cc(ccc1Br)Br 2230a_106832991635_100011982794 [1,2,0,0,0,0|1,0,0]=4 11620 B11R1.182 CNCc1cc(ccc1Br)Br 26a_100102657272_100011220040 [1,2,0,0,0,0|1,0,0]=4 11621 B11R1.182 CNCc1cc(ccc1Br)Br 270004a_106832991635_100011266429 [1,2,0,0,0,0|1,0,0]=4 11622 B11R1.182 CNCc1cc(ccc1Br)Br 34a_100000707832_200000210301 [1,2,0,0,0,0|1,0,0]=4 11623 B11R1.182 CNCc1cc(ccc1Br)Br 34a_100102657272_100011982794 [1,2,0,0,0,0|1,0,0]=4 11624 B11R1.182 CNCc1cc(ccc1Br)Br 7a_106832991635_100011982794 [1,2,0,0,0,0|1,0,0]=4 11625 B11R1.182 CNCc1cc(ccc1Br)C 207a_100102657272_100011551863 [1,2,0,0,0,0|1,0,0]=4 11626 B11R1.182 CNCc1cc(ccc1Br)C 26a_100102657272_100012002257 [1,2,0,0,0,0|1,0,0]=4 11627 B11R1.182 CNCc1cc(ccc1Br)C 270004a_106832991635_100011551863 [1,2,0,0,0,0|1,0,0]=4 11628 B11R1.182 CNCc1cc(ccc1Br)Cl 207a_100102657272_100000746314 [1,2,0,0,0,0|1,0,0]=4 11629 B11R1.182 CNCc1cc(ccc1Br)Cl 2230a_106832991635_100000733903 [1,2,0,0,0,0|1,0,0]=4 11630 B11R1.182 CNCc1cc(ccc1Br)Cl 26a_100102657272_100012339455 [1,2,0,0,0,0|1,0,0]=4 11631 B11R1.182 CNCc1cc(ccc1Br)Cl 270004a_106832991635_100000746314 [1,2,0,0,0,0|1,0,0]=4 11632 B11R1.182 CNCc1cc(ccc1Br)Cl 34a_100102657272_100000733903 [1,2,0,0,0,0|1,0,0]=4 11633 B11R1.182 CNCc1cc(ccc1Br)Cl 7a_106832991635_100000733903 [1,2,0,0,0,0|1,0,0]=4 11634 B11R1.182 CNCc1cc(ccc1Br)F 207a_100102657272_100000766564 [1,2,0,0,0,0|1,0,0]=4 11635 B11R1.182 CNCc1cc(ccc1Br)F 2230a_100000742738_200000210301 [1,2,0,0,0,0|1,0,0]=4 11636 B11R1.182 CNCc1cc(ccc1Br)F 2230a_106832991635_100000736370 [1,2,0,0,0,0|1,0,0]=4 11637 B11R1.182 CNCc1cc(ccc1Br)F 26a_100102657272_100000690578 [1,2,0,0,0,0|1,0,0]=4 11638 B11R1.182 CNCc1cc(ccc1Br)F 270004a_106832991635_100000766564 [1,2,0,0,0,0|1,0,0]=4 11639 B11R1.182 CNCc1cc(ccc1Br)F 34a_100000742738_200000210301 [1,2,0,0,0,0|1,0,0]=4 11640 B11R1.182 CNCc1cc(ccc1Br)F 34a_100102657272_100000736370 [1,2,0,0,0,0|1,0,0]=4 11641 B11R1.182 CNCc1cc(ccc1Br)F 7a_106832991635_100000736370 [1,2,0,0,0,0|1,0,0]=4 11642 B11R1.182 CNCc1cc(ccc1Br)I 207a_100102657272_100010185652 [1,2,0,0,0,0|1,0,0]=4 11643 B11R1.182 CNCc1cc(ccc1Br)I 2230a_106832991635_100012355412 [1,2,0,0,0,0|1,0,0]=4 11644 B11R1.182 CNCc1cc(ccc1Br)I 26a_100102657272_100012356990 [1,2,0,0,0,0|1,0,0]=4 11645 B11R1.182 CNCc1cc(ccc1Br)I 34a_100102657272_100012355412 [1,2,0,0,0,0|1,0,0]=4 11646 B11R1.182 CNCc1cc(ccc1Br)I 7a_106832991635_100012355412 [1,2,0,0,0,0|1,0,0]=4 11647 B11R1.182 CNCc1cc(ccc1C)Br 207a_100102657272_100011361606 [1,2,0,0,0,0|1,0,0]=4 11648 B11R1.182 CNCc1cc(ccc1C)Br 26a_100102657272_100000685420 [1,2,0,0,0,0|1,0,0]=4 11649 B11R1.182 CNCc1cc(ccc1C)Br 270004a_106832991635_100011361606 [1,2,0,0,0,0|1,0,0]=4 11650 B11R1.182 CNCc1cc(ccc1C)C 207a_100102657272_100000211343 [1,2,0,0,0,0|1,0,0]=4 11651 B11R1.182 CNCc1cc(ccc1C)C 2230a_106832991635_100000184699 [1,2,0,0,0,0|1,0,0]=4 11652 B11R1.182 CNCc1cc(ccc1C)C 270004a_106832991635_100000211343 [1,2,0,0,0,0|1,0,0]=4 11653 B11R1.182 CNCc1cc(ccc1C)C 34a_100000174964_200000210301 [1,2,0,0,0,0|1,0,0]=4 11654 B11R1.182 CNCc1cc(ccc1C)C 34a_100102657272_100000184699 [1,2,0,0,0,0|1,0,0]=4 11655 B11R1.182 CNCc1cc(ccc1C)C 7a_106832991635_100000184699 [1,2,0,0,0,0|1,0,0]=4 11656 B11R1.182 CNCc1cc(ccc1C)Cl 207a_100102657272_100011551331 [1,2,0,0,0,0|1,0,0]=4 11657 B11R1.182 CNCc1cc(ccc1C)Cl 2230a_106832991635_100012186985 [1,2,0,0,0,0|1,0,0]=4 11658 B11R1.182 CNCc1cc(ccc1C)Cl 270004a_106832991635_100011551331 [1,2,0,0,0,0|1,0,0]=4 11659 B11R1.182 CNCc1cc(ccc1C)Cl 34a_100000717755_200000210301 [1,2,0,0,0,0|1,0,0]=4 11660 B11R1.182 CNCc1cc(ccc1C)Cl 34a_100102657272_100012186985 [1,2,0,0,0,0|1,0,0]=4 11661 B11R1.182 CNCc1cc(ccc1C)Cl 7a_106832991635_100012186985 [1,2,0,0,0,0|1,0,0]=4 11662 B11R1.182 CNCc1cc(ccc1C)F 207a_100102657272_100000697687 [1,2,0,0,0,0|1,0,0]=4 11663 B11R1.182 CNCc1cc(ccc1C)F 2230a_106832991635_100000709795 [1,2,0,0,0,0|1,0,0]=4 11664 B11R1.182 CNCc1cc(ccc1C)F 270004a_106832991635_100000697687 [1,2,0,0,0,0|1,0,0]=4 11665 B11R1.182 CNCc1cc(ccc1C)F 34a_100011217291_200000210301 [1,2,0,0,0,0|1,0,0]=4 11666 B11R1.182 CNCc1cc(ccc1C)F 34a_100102657272_100000709795 [1,2,0,0,0,0|1,0,0]=4 11667 B11R1.182 CNCc1cc(ccc1C)F 7a_106832991635_100000709795 [1,2,0,0,0,0|1,0,0]=4 11668 B11R1.182 CNCc1cc(ccc1C)O 271570a_203496583355_106744473289 [1,2,0,0,0,0|1,0,0]=4 11669 B11R1.182 CNCc1cc(ccc1C)O 34a_200009844824_200000210301 [1,2,0,0,0,0|1,0,0]=4 11670 B11R1.182 CNCc1cc(ccc1Cl)Br 207a_100102657272_100000746309 [1,2,0,0,0,0|1,0,0]=4 11671 B11R1.182 CNCc1cc(ccc1Cl)Br 2230a_106832991635_100000763347 [1,2,0,0,0,0|1,0,0]=4 11672 B11R1.182 CNCc1cc(ccc1Cl)Br 26a_100102657272_100000738945 [1,2,0,0,0,0|1,0,0]=4 11673 B11R1.182 CNCc1cc(ccc1Cl)Br 270004a_106832991635_100000746309 [1,2,0,0,0,0|1,0,0]=4 11674 B11R1.182 CNCc1cc(ccc1Cl)Br 34a_100025772652_200000210301 [1,2,0,0,0,0|1,0,0]=4 11675 B11R1.182 CNCc1cc(ccc1Cl)Br 34a_100102657272_100000763347 [1,2,0,0,0,0|1,0,0]=4 11676 B11R1.182 CNCc1cc(ccc1Cl)Br 7a_106832991635_100000763347 [1,2,0,0,0,0|1,0,0]=4 11677 B11R1.182 CNCc1cc(ccc1Cl)C 207a_100102657272_100011551332 [1,2,0,0,0,0|1,0,0]=4 11678 B11R1.182 CNCc1cc(ccc1Cl)C 2230a_100025705715_200000210301 [1,2,0,0,0,0|1,0,0]=4 11679 B11R1.182 CNCc1cc(ccc1Cl)C 2230a_106832991635_100009871730 [1,2,0,0,0,0|1,0,0]=4 11680 B11R1.182 CNCc1cc(ccc1Cl)C 26a_100102657272_100000211493 [1,2,0,0,0,0|1,0,0]=4 11681 B11R1.182 CNCc1cc(ccc1Cl)C 270004a_106832991635_100011551332 [1,2,0,0,0,0|1,0,0]=4 11682 B11R1.182 CNCc1cc(ccc1Cl)C 34a_100025705715_200000210301 [1,2,0,0,0,0|1,0,0]=4 11683 B11R1.182 CNCc1cc(ccc1Cl)C 34a_100102657272_100009871730 [1,2,0,0,0,0|1,0,0]=4 11684 B11R1.182 CNCc1cc(ccc1Cl)C 7a_106832991635_100009871730 [1,2,0,0,0,0|1,0,0]=4 11685 B11R1.182 CNCc1cc(ccc1Cl)Cl 207a_100102657272_100000746308 [1,2,0,0,0,0|1,0,0]=4 11686 B11R1.182 CNCc1cc(ccc1Cl)Cl 2230a_106832991635_100000756322 [1,2,0,0,0,0|1,0,0]=4 11687 B11R1.182 CNCc1cc(ccc1Cl)Cl 26a_100102657272_100000211422 [1,2,0,0,0,0|1,0,0]=4 11688 B11R1.182 CNCc1cc(ccc1Cl)Cl 270004a_106832991635_100000746308 [1,2,0,0,0,0|1,0,0]=4 11689 B11R1.182 CNCc1cc(ccc1Cl)Cl 34a_100102657272_100000756322 [1,2,0,0,0,0|1,0,0]=4 11690 B11R1.182 CNCc1cc(ccc1Cl)Cl 34a_100102946428_200000210301 [1,2,0,0,0,0|1,0,0]=4 11691 B11R1.182 CNCc1cc(ccc1Cl)Cl 7a_106832991635_100000756322 [1,2,0,0,0,0|1,0,0]=4 11692 B11R1.182 CNCc1cc(ccc1Cl)F 207a_100102657272_100011218309 [1,2,0,0,0,0|1,0,0]=4 11693 B11R1.182 CNCc1cc(ccc1Cl)F 2230a_100011830483_200000210301 [1,2,0,0,0,0|1,0,0]=4 11694 B11R1.182 CNCc1cc(ccc1Cl)F 2230a_106832991635_100000709952 [1,2,0,0,0,0|1,0,0]=4 11695 B11R1.182 CNCc1cc(ccc1Cl)F 26a_100102657272_100000692107 [1,2,0,0,0,0|1,0,0]=4 11696 B11R1.182 CNCc1cc(ccc1Cl)F 270004a_106832991635_100011218309 [1,2,0,0,0,0|1,0,0]=4 11697 B11R1.182 CNCc1cc(ccc1Cl)F 34a_100011830483_200000210301 [1,2,0,0,0,0|1,0,0]=4 11698 B11R1.182 CNCc1cc(ccc1Cl)F 34a_100102657272_100000709952 [1,2,0,0,0,0|1,0,0]=4 11699 B11R1.182 CNCc1cc(ccc1Cl)F 7a_106832991635_100000709952 [1,2,0,0,0,0|1,0,0]=4 11700 B11R1.182 CNCc1cc(ccc1Cl)I 207a_100102657272_100010254384 [1,2,0,0,0,0|1,0,0]=4 11701 B11R1.182 CNCc1cc(ccc1Cl)I 2230a_106832991635_100010188191 [1,2,0,0,0,0|1,0,0]=4 11702 B11R1.182 CNCc1cc(ccc1Cl)I 34a_100102657272_100010188191 [1,2,0,0,0,0|1,0,0]=4 11703 B11R1.182 CNCc1cc(ccc1Cl)I 7a_106832991635_100010188191 [1,2,0,0,0,0|1,0,0]=4 11704 B11R1.182 CNCc1cc(ccc1F)Br 207a_100102657272_100000211465 [1,2,0,0,0,0|1,0,0]=4 11705 B11R1.182 CNCc1cc(ccc1F)Br 2230a_106832991635_100000736399 [1,2,0,0,0,0|1,0,0]=4 11706 B11R1.182 CNCc1cc(ccc1F)Br 26a_100102657272_100000686035 [1,2,0,0,0,0|1,0,0]=4 11707 B11R1.182 CNCc1cc(ccc1F)Br 270004a_106832991635_100000211465 [1,2,0,0,0,0|1,0,0]=4 11708 B11R1.182 CNCc1cc(ccc1F)Br 34a_100009815772_200000210301 [1,2,0,0,0,0|1,0,0]=4 11709 B11R1.182 CNCc1cc(ccc1F)Br 34a_100102657272_100000736399 [1,2,0,0,0,0|1,0,0]=4 11710 B11R1.182 CNCc1cc(ccc1F)Br 7a_106832991635_100000736399 [1,2,0,0,0,0|1,0,0]=4 11711 B11R1.182 CNCc1cc(ccc1F)C 207a_100102657272_100000756917 [1,2,0,0,0,0|1,0,0]=4 11712 B11R1.182 CNCc1cc(ccc1F)C 2230a_106832991635_100011260760 [1,2,0,0,0,0|1,0,0]=4 11713 B11R1.182 CNCc1cc(ccc1F)C 270004a_106832991635_100000756917 [1,2,0,0,0,0|1,0,0]=4 11714 B11R1.182 CNCc1cc(ccc1F)C 34a_100102657272_100011260760 [1,2,0,0,0,0|1,0,0]=4 11715 B11R1.182 CNCc1cc(ccc1F)C 34a_100102693586_200000210301 [1,2,0,0,0,0|1,0,0]=4 11716 B11R1.182 CNCc1cc(ccc1F)C 7a_106832991635_100011260760 [1,2,0,0,0,0|1,0,0]=4 11717 B11R1.182 CNCc1cc(ccc1F)Cl 207a_100102657272_100000745245 [1,2,0,0,0,0|1,0,0]=4 11718 B11R1.182 CNCc1cc(ccc1F)Cl 2230a_106832991635_100000716957 [1,2,0,0,0,0|1,0,0]=4 11719 B11R1.182 CNCc1cc(ccc1F)Cl 270004a_106832991635_100000745245 [1,2,0,0,0,0|1,0,0]=4 11720 B11R1.182 CNCc1cc(ccc1F)Cl 34a_100011211646_200000210301 [1,2,0,0,0,0|1,0,0]=4 11721 B11R1.182 CNCc1cc(ccc1F)Cl 34a_100102657272_100000716957 [1,2,0,0,0,0|1,0,0]=4 11722 B11R1.182 CNCc1cc(ccc1F)Cl 7a_106832991635_100000716957 [1,2,0,0,0,0|1,0,0]=4 11723 B11R1.182 CNCc1cc(ccc1F)F 207a_100102657272_100000740046 [1,2,0,0,0,0|1,0,0]=4 11724 B11R1.182 CNCc1cc(ccc1F)F 2230a_106832991635_100000741279 [1,2,0,0,0,0|1,0,0]=4 11725 B11R1.182 CNCc1cc(ccc1F)F 270004a_106832991635_100000740046 [1,2,0,0,0,0|1,0,0]=4 11726 B11R1.182 CNCc1cc(ccc1F)F 34a_100000752317_200000210301 [1,2,0,0,0,0|1,0,0]=4 11727 B11R1.182 CNCc1cc(ccc1F)F 34a_100102657272_100000741279 [1,2,0,0,0,0|1,0,0]=4 11728 B11R1.182 CNCc1cc(ccc1F)F 7a_106832991635_100000741279 [1,2,0,0,0,0|1,0,0]=4 11729 B11R1.182 CNCc1cc(ccc1F)I 207a_100102657272_100000050626 [1,2,0,0,0,0|1,0,0]=4 11730 B11R1.182 CNCc1cc(ccc1F)I 2230a_106832991635_200010149601 [1,2,0,0,0,0|1,0,0]=4 11731 B11R1.182 CNCc1cc(ccc1F)I 34a_100102657272_200010149601 [1,2,0,0,0,0|1,0,0]=4 11732 B11R1.182 CNCc1cc(ccc1F)I 7a_106832991635_200010149601 [1,2,0,0,0,0|1,0,0]=4 11733 B11R1.182 CNCc1cc(ccc1F)O 271570a_203496583355_100000748472 [1,2,0,0,0,0|1,0,0]=4 11734 B11R1.182 CNCc1cc(ccc1I)Br 207a_100102657272_100010185651 [1,2,0,0,0,0|1,0,0]=4 11735 B11R1.182 CNCc1cc(ccc1I)Br 2230a_106832991635_100012362523 [1,2,0,0,0,0|1,0,0]=4 11736 B11R1.182 CNCc1cc(ccc1I)Br 26a_100102657272_100012344904 [1,2,0,0,0,0|1,0,0]=4 11737 B11R1.182 CNCc1cc(ccc1I)Br 270004a_106832991635_100010185651 [1,2,0,0,0,0|1,0,0]=4 11738 B11R1.182 CNCc1cc(ccc1I)Br 34a_100102657272_100012362523 [1,2,0,0,0,0|1,0,0]=4 11739 B11R1.182 CNCc1cc(ccc1I)Br 7a_106832991635_100012362523 [1,2,0,0,0,0|1,0,0]=4 11740 B11R1.182 CNCc1cc(ccc1I)C 207a_100102657272_100010150105 [1,2,0,0,0,0|1,0,0]=4 11741 B11R1.182 CNCc1cc(ccc1I)C 270004a_106832991635_100010150105 [1,2,0,0,0,0|1,0,0]=4 11742 B11R1.182 CNCc1cc(ccc1I)Cl 207a_100102657272_100010254386 [1,2,0,0,0,0|1,0,0]=4 11743 B11R1.182 CNCc1cc(ccc1I)Cl 2230a_106832991635_100012348826 [1,2,0,0,0,0|1,0,0]=4 11744 B11R1.182 CNCc1cc(ccc1I)Cl 270004a_106832991635_100010254386 [1,2,0,0,0,0|1,0,0]=4 11745 B11R1.182 CNCc1cc(ccc1I)Cl 34a_100102657272_100012348826 [1,2,0,0,0,0|1,0,0]=4 11746 B11R1.182 CNCc1cc(ccc1I)Cl 7a_106832991635_100012348826 [1,2,0,0,0,0|1,0,0]=4 11747 B11R1.182 CNCc1cc(ccc1I)F 207a_100102657272_100010186294 [1,2,0,0,0,0|1,0,0]=4 11748 B11R1.182 CNCc1cc(ccc1I)F 2230a_106832991635_100010149606 [1,2,0,0,0,0|1,0,0]=4 11749 B11R1.182 CNCc1cc(ccc1I)F 270004a_106832991635_100010186294 [1,2,0,0,0,0|1,0,0]=4 11750 B11R1.182 CNCc1cc(ccc1I)F 34a_100102657272_100010149606 [1,2,0,0,0,0|1,0,0]=4 11751 B11R1.182 CNCc1cc(ccc1I)F 7a_106832991635_100010149606 [1,2,0,0,0,0|1,0,0]=4 11752 B11R1.182 CNCc1cc(ccc1O)Br 34a_100000730032_200000210301 [1,2,0,0,0,0|1,0,0]=4 11753 B11R1.182 CNCc1cc(ccc1O)Cl 34a_100000238540_200000210301 [1,2,0,0,0,0|1,0,0]=4 11754 B11R1.182 CNCc1cc(ccc1O)F 34a_100102657272_100010161318 [1,2,0,0,0,0|1,0,0]=4 11755 B11R1.182 CNCc1cc(ccc1O)F 7a_106832991635_100010161318 [1,2,0,0,0,0|1,0,0]=4 11756 B11R1.182 CNCc1cc(ccc1O)O 271570a_203496583355_100011602694 [1,2,0,0,0,0|1,0,0]=4 11757 B11R1.182 COCc1cc(ccc1Br)Br 34a_100011266457_200000210301 [1,2,0,0,0,0|1,0,0]=4 11758 B11R1.182 COCc1cc(ccc1Br)Br 34a_100138415774_100011982794 [1,2,0,0,0,0|1,0,0]=4 11759 B11R1.182 COCc1cc(ccc1Br)Br 7a_100011266457_200000210301 [1,2,0,0,0,0|1,0,0]=4 11760 B11R1.182 COCc1cc(ccc1Br)C 34a_100012361352_200000210301 [1,2,0,0,0,0|1,0,0]=4 11761 B11R1.182 COCc1cc(ccc1Br)C 7a_100012361352_200000210301 [1,2,0,0,0,0|1,0,0]=4 11762 B11R1.182 COCc1cc(ccc1Br)Cl 34a_100012355668_200000210301 [1,2,0,0,0,0|1,0,0]=4 11763 B11R1.182 COCc1cc(ccc1Br)Cl 34a_100138415774_100000733903 [1,2,0,0,0,0|1,0,0]=4 11764 B11R1.182 COCc1cc(ccc1Br)Cl 7a_100012355668_200000210301 [1,2,0,0,0,0|1,0,0]=4 11765 B11R1.182 COCc1cc(ccc1Br)F 34a_100011217561_200000210301 [1,2,0,0,0,0|1,0,0]=4 11766 B11R1.182 COCc1cc(ccc1Br)F 34a_100138415774_100000736370 [1,2,0,0,0,0|1,0,0]=4 11767 B11R1.182 COCc1cc(ccc1Br)F 7a_100011217561_200000210301 [1,2,0,0,0,0|1,0,0]=4 11768 B11R1.182 COCc1cc(ccc1Br)I 34a_100138415774_100012355412 [1,2,0,0,0,0|1,0,0]=4 11769 B11R1.182 COCc1cc(ccc1Br)I 7a_100012359683_200000210301 [1,2,0,0,0,0|1,0,0]=4 11770 B11R1.182 COCc1cc(ccc1Br)N 34a_100012347228_200000210301 [1,2,0,0,0,0|1,0,0]=4 11771 B11R1.182 COCc1cc(ccc1Br)O 271570a_203496583355_202125822959 [1,2,0,0,0,0|1,0,0]=4 11772 B11R1.182 COCc1cc(ccc1C)Br 34a_100000700630_200000210301 [1,2,0,0,0,0|1,0,0]=4 11773 B11R1.182 COCc1cc(ccc1C)Br 7a_100000700630_200000210301 [1,2,0,0,0,0|1,0,0]=4 11774 B11R1.182 COCc1cc(ccc1C)C 34a_100138415774_100000184699 [1,2,0,0,0,0|1,0,0]=4 11775 B11R1.182 COCc1cc(ccc1C)C 34a_200011215349_200000210301 [1,2,0,0,0,0|1,0,0]=4 11776 B11R1.182 COCc1cc(ccc1C)C 7a_200011215349_200000210301 [1,2,0,0,0,0|1,0,0]=4 11777 B11R1.182 COCc1cc(ccc1C)Cl 34a_100012002407_200000210301 [1,2,0,0,0,0|1,0,0]=4 11778 B11R1.182 COCc1cc(ccc1C)Cl 34a_100138415774_100012186985 [1,2,0,0,0,0|1,0,0]=4 11779 B11R1.182 COCc1cc(ccc1C)Cl 7a_100012002407_200000210301 [1,2,0,0,0,0|1,0,0]=4 11780 B11R1.182 COCc1cc(ccc1C)F 34a_100011219218_200000210301 [1,2,0,0,0,0|1,0,0]=4 11781 B11R1.182 COCc1cc(ccc1C)F 34a_100138415774_100000709795 [1,2,0,0,0,0|1,0,0]=4 11782 B11R1.182 COCc1cc(ccc1C)F 7a_100011219218_200000210301 [1,2,0,0,0,0|1,0,0]=4 11783 B11R1.182 COCc1cc(ccc1C)I 34a_100010150140_200000210301 [1,2,0,0,0,0|1,0,0]=4 11784 B11R1.182 COCc1cc(ccc1C)I 7a_100010150140_200000210301 [1,2,0,0,0,0|1,0,0]=4 11785 B11R1.182 COCc1cc(ccc1Cl)Br 34a_100011215897_200000210301 [1,2,0,0,0,0|1,0,0]=4 11786 B11R1.182 COCc1cc(ccc1Cl)Br 34a_100138415774_100000763347 [1,2,0,0,0,0|1,0,0]=4 11787 B11R1.182 COCc1cc(ccc1Cl)Br 7a_100011215897_200000210301 [1,2,0,0,0,0|1,0,0]=4 11788 B11R1.182 COCc1cc(ccc1Cl)C 34a_100009878994_200000210301 [1,2,0,0,0,0|1,0,0]=4 11789 B11R1.182 COCc1cc(ccc1Cl)C 34a_100138415774_100009871730 [1,2,0,0,0,0|1,0,0]=4 11790 B11R1.182 COCc1cc(ccc1Cl)C 7a_100009878994_200000210301 [1,2,0,0,0,0|1,0,0]=4 11791 B11R1.182 COCc1cc(ccc1Cl)Cl 34a_100000698905_200000210301 [1,2,0,0,0,0|1,0,0]=4 11792 B11R1.182 COCc1cc(ccc1Cl)Cl 34a_100138415774_100000756322 [1,2,0,0,0,0|1,0,0]=4 11793 B11R1.182 COCc1cc(ccc1Cl)Cl 7a_100000698905_200000210301 [1,2,0,0,0,0|1,0,0]=4 11794 B11R1.182 COCc1cc(ccc1Cl)F 34a_100011218361_200000210301 [1,2,0,0,0,0|1,0,0]=4 11795 B11R1.182 COCc1cc(ccc1Cl)F 34a_100138415774_100000709952 [1,2,0,0,0,0|1,0,0]=4 11796 B11R1.182 COCc1cc(ccc1Cl)F 7a_100011218361_200000210301 [1,2,0,0,0,0|1,0,0]=4 11797 B11R1.182 COCc1cc(ccc1Cl)I 34a_100010128486_200000210301 [1,2,0,0,0,0|1,0,0]=4 11798 B11R1.182 COCc1cc(ccc1Cl)I 34a_100138415774_100010188191 [1,2,0,0,0,0|1,0,0]=4 11799 B11R1.182 COCc1cc(ccc1Cl)I 7a_100010128486_200000210301 [1,2,0,0,0,0|1,0,0]=4 11800 B11R1.182 COCc1cc(ccc1Cl)N 34a_100011273577_200000210301 [1,2,0,0,0,0|1,0,0]=4 11801 B11R1.182 COCc1cc(ccc1F)Br 34a_100000246282_200000210301 [1,2,0,0,0,0|1,0,0]=4 11802 B11R1.182 COCc1cc(ccc1F)Br 34a_100138415774_100000736399 [1,2,0,0,0,0|1,0,0]=4 11803 B11R1.182 COCc1cc(ccc1F)Br 7a_100000246282_200000210301 [1,2,0,0,0,0|1,0,0]=4 11804 B11R1.182 COCc1cc(ccc1F)C 34a_100011692775_200000210301 [1,2,0,0,0,0|1,0,0]=4 11805 B11R1.182 COCc1cc(ccc1F)C 34a_100138415774_100011260760 [1,2,0,0,0,0|1,0,0]=4 11806 B11R1.182 COCc1cc(ccc1F)C 7a_100011692775_200000210301 [1,2,0,0,0,0|1,0,0]=4 11807 B11R1.182 COCc1cc(ccc1F)Cl 34a_100011217248_200000210301 [1,2,0,0,0,0|1,0,0]=4 11808 B11R1.182 COCc1cc(ccc1F)Cl 34a_100138415774_100000716957 [1,2,0,0,0,0|1,0,0]=4 11809 B11R1.182 COCc1cc(ccc1F)Cl 7a_100011217248_200000210301 [1,2,0,0,0,0|1,0,0]=4 11810 B11R1.182 COCc1cc(ccc1F)F 34a_100011217725_200000210301 [1,2,0,0,0,0|1,0,0]=4 11811 B11R1.182 COCc1cc(ccc1F)F 34a_100138415774_100000741279 [1,2,0,0,0,0|1,0,0]=4 11812 B11R1.182 COCc1cc(ccc1F)F 7a_100011217725_200000210301 [1,2,0,0,0,0|1,0,0]=4 11813 B11R1.182 COCc1cc(ccc1F)I 34a_100000049604_200000210301 [1,2,0,0,0,0|1,0,0]=4 11814 B11R1.182 COCc1cc(ccc1F)I 34a_100138415774_200010149601 [1,2,0,0,0,0|1,0,0]=4 11815 B11R1.182 COCc1cc(ccc1F)I 7a_100000049604_200000210301 [1,2,0,0,0,0|1,0,0]=4 11816 B11R1.182 COCc1cc(ccc1F)N 34a_100011218011_200000210301 [1,2,0,0,0,0|1,0,0]=4 11817 B11R1.182 COCc1cc(ccc1F)O 271570a_203496583355_100010140362 [1,2,0,0,0,0|1,0,0]=4 11818 B11R1.182 COCc1cc(ccc1I)Br 34a_100011356890_200000210301 [1,2,0,0,0,0|1,0,0]=4 11819 B11R1.182 COCc1cc(ccc1I)Br 34a_100138415774_100012362523 [1,2,0,0,0,0|1,0,0]=4 11820 B11R1.182 COCc1cc(ccc1I)Br 7a_100011356890_200000210301 [1,2,0,0,0,0|1,0,0]=4 11821 B11R1.182 COCc1cc(ccc1I)Cl 34a_100138415774_100012348826 [1,2,0,0,0,0|1,0,0]=4 11822 B11R1.182 COCc1cc(ccc1I)F 34a_100010255287_200000210301 [1,2,0,0,0,0|1,0,0]=4 11823 B11R1.182 COCc1cc(ccc1I)F 34a_100138415774_100010149606 [1,2,0,0,0,0|1,0,0]=4 11824 B11R1.182 COCc1cc(ccc1I)F 7a_100010255287_200000210301 [1,2,0,0,0,0|1,0,0]=4 11825 B11R1.182 COCc1cc(ccc1N)Br 34a_100012353972_200000210301 [1,2,0,0,0,0|1,0,0]=4 11826 B11R1.182 COCc1cc(ccc1N)Br 7a_100012353972_200000210301 [1,2,0,0,0,0|1,0,0]=4 11827 B11R1.182 COCc1cc(ccc1N)C 34a_100011215565_200000210301 [1,2,0,0,0,0|1,0,0]=4 11828 B11R1.182 COCc1cc(ccc1N)C 7a_100011215565_200000210301 [1,2,0,0,0,0|1,0,0]=4 11829 B11R1.182 COCc1cc(ccc1N)Cl 34a_100011214999_200000210301 [1,2,0,0,0,0|1,0,0]=4 11830 B11R1.182 COCc1cc(ccc1N)Cl 7a_100011214999_200000210301 [1,2,0,0,0,0|1,0,0]=4 11831 B11R1.182 COCc1cc(ccc1N)F 34a_100011296978_200000210301 [1,2,0,0,0,0|1,0,0]=4 11832 B11R1.182 COCc1cc(ccc1N)F 7a_100011296978_200000210301 [1,2,0,0,0,0|1,0,0]=4 11833 B11R1.182 COCc1cc(ccc1O)F 34a_100138415774_100010161318 [1,2,0,0,0,0|1,0,0]=4 11834 B11R1.182 CSCc1cc(ccc1Br)Br 62a_100011982794_200000210301 [1,2,0,0,0,0|1,0,0]=4 11835 B11R1.182 CSCc1cc(ccc1Br)Br 62a_200000210301_100011982794 [1,2,0,0,0,0|1,0,0]=4 11836 B11R1.182 CSCc1cc(ccc1Br)Cl 62a_100000733903_200000210301 [1,2,0,0,0,0|1,0,0]=4 11837 B11R1.182 CSCc1cc(ccc1Br)Cl 62a_200000210301_100000733903 [1,2,0,0,0,0|1,0,0]=4 11838 B11R1.182 CSCc1cc(ccc1Br)F 62a_100000736370_200000210301 [1,2,0,0,0,0|1,0,0]=4 11839 B11R1.182 CSCc1cc(ccc1Br)F 62a_200000210301_100000736370 [1,2,0,0,0,0|1,0,0]=4 11840 B11R1.182 CSCc1cc(ccc1Br)I 62a_100012355412_200000210301 [1,2,0,0,0,0|1,0,0]=4 11841 B11R1.182 CSCc1cc(ccc1Br)I 62a_200000210301_100012355412 [1,2,0,0,0,0|1,0,0]=4 11842 B11R1.182 CSCc1cc(ccc1C)C 62a_100000184699_200000210301 [1,2,0,0,0,0|1,0,0]=4 11843 B11R1.182 CSCc1cc(ccc1C)C 62a_200000210301_100000184699 [1,2,0,0,0,0|1,0,0]=4 11844 B11R1.182 CSCc1cc(ccc1C)Cl 62a_100012186985_200000210301 [1,2,0,0,0,0|1,0,0]=4 11845 B11R1.182 CSCc1cc(ccc1C)Cl 62a_200000210301_100012186985 [1,2,0,0,0,0|1,0,0]=4 11846 B11R1.182 CSCc1cc(ccc1C)F 62a_100000709795_200000210301 [1,2,0,0,0,0|1,0,0]=4 11847 B11R1.182 CSCc1cc(ccc1C)F 62a_200000210301_100000709795 [1,2,0,0,0,0|1,0,0]=4 11848 B11R1.182 CSCc1cc(ccc1Cl)Br 62a_100000763347_200000210301 [1,2,0,0,0,0|1,0,0]=4 11849 B11R1.182 CSCc1cc(ccc1Cl)Br 62a_200000210301_100000763347 [1,2,0,0,0,0|1,0,0]=4 11850 B11R1.182 CSCc1cc(ccc1Cl)C 62a_100009871730_200000210301 [1,2,0,0,0,0|1,0,0]=4 11851 B11R1.182 CSCc1cc(ccc1Cl)C 62a_200000210301_100009871730 [1,2,0,0,0,0|1,0,0]=4 11852 B11R1.182 CSCc1cc(ccc1Cl)Cl 62a_100000756322_200000210301 [1,2,0,0,0,0|1,0,0]=4 11853 B11R1.182 CSCc1cc(ccc1Cl)Cl 62a_200000210301_100000756322 [1,2,0,0,0,0|1,0,0]=4 11854 B11R1.182 CSCc1cc(ccc1Cl)F 62a_100000709952_200000210301 [1,2,0,0,0,0|1,0,0]=4 11855 B11R1.182 CSCc1cc(ccc1Cl)F 62a_200000210301_100000709952 [1,2,0,0,0,0|1,0,0]=4 11856 B11R1.182 CSCc1cc(ccc1Cl)I 62a_100010188191_200000210301 [1,2,0,0,0,0|1,0,0]=4 11857 B11R1.182 CSCc1cc(ccc1Cl)I 62a_200000210301_100010188191 [1,2,0,0,0,0|1,0,0]=4 11858 B11R1.182 CSCc1cc(ccc1F)Br 62a_100000736399_200000210301 [1,2,0,0,0,0|1,0,0]=4 11859 B11R1.182 CSCc1cc(ccc1F)Br 62a_200000210301_100000736399 [1,2,0,0,0,0|1,0,0]=4 11860 B11R1.182 CSCc1cc(ccc1F)C 62a_100011260760_200000210301 [1,2,0,0,0,0|1,0,0]=4 11861 B11R1.182 CSCc1cc(ccc1F)C 62a_200000210301_100011260760 [1,2,0,0,0,0|1,0,0]=4 11862 B11R1.182 CSCc1cc(ccc1F)Cl 62a_100000716957_200000210301 [1,2,0,0,0,0|1,0,0]=4 11863 B11R1.182 CSCc1cc(ccc1F)Cl 62a_200000210301_100000716957 [1,2,0,0,0,0|1,0,0]=4 11864 B11R1.182 CSCc1cc(ccc1F)F 62a_100000685659_200000210301 [1,2,0,0,0,0|1,0,0]=4 11865 B11R1.182 CSCc1cc(ccc1F)F 62a_200000210301_100000685659 [1,2,0,0,0,0|1,0,0]=4 11866 B11R1.182 CSCc1cc(ccc1F)I 62a_200000210301_200010149601 [1,2,0,0,0,0|1,0,0]=4 11867 B11R1.182 CSCc1cc(ccc1F)I 62a_200010149601_200000210301 [1,2,0,0,0,0|1,0,0]=4 11868 B11R1.182 CSCc1cc(ccc1I)Br 62a_100012362523_200000210301 [1,2,0,0,0,0|1,0,0]=4 11869 B11R1.182 CSCc1cc(ccc1I)Br 62a_200000210301_100012362523 [1,2,0,0,0,0|1,0,0]=4 11870 B11R1.182 CSCc1cc(ccc1I)Cl 62a_100012348826_200000210301 [1,2,0,0,0,0|1,0,0]=4 11871 B11R1.182 CSCc1cc(ccc1I)Cl 62a_200000210301_100012348826 [1,2,0,0,0,0|1,0,0]=4 11872 B11R1.182 CSCc1cc(ccc1I)F 62a_100010149606_200000210301 [1,2,0,0,0,0|1,0,0]=4 11873 B11R1.182 CSCc1cc(ccc1I)F 62a_200000210301_100010149606 [1,2,0,0,0,0|1,0,0]=4 11874 B11R1.182 CSCc1cc(ccc1O)F 62a_100010161318_200000210301 [1,2,0,0,0,0|1,0,0]=4 11875 B11R1.182 CSCc1cc(ccc1O)F 62a_200000210301_100010161318 [1,2,0,0,0,0|1,0,0]=4 11876 B11R1.182 Cc1ccc(c(c1)CN[13CH3])C 34a_100000174964_200025704644 [1,2,0,0,0,0|1,0,0]=4 11877 B11R1.182 Cc1ccc(c(c1)CN[13CH3])Cl 2230a_100025705715_200025704644 [1,2,0,0,0,0|1,0,0]=4 11878 B11R1.182 Cc1ccc(c(c1)CN[13CH3])Cl 34a_100025705715_200025704644 [1,2,0,0,0,0|1,0,0]=4 11879 B11R1.182 Cc1ccc(c(c1)CN[13CH3])F 34a_100102693586_200025704644 [1,2,0,0,0,0|1,0,0]=4 11880 B11R1.182 Cc1ccc(c(c1)CO[13CH3])Br 34a_100012361352_200025704644 [1,2,0,0,0,0|1,0,0]=4 11881 B11R1.182 Cc1ccc(c(c1)CO[13CH3])Br 7a_100012361352_200025704644 [1,2,0,0,0,0|1,0,0]=4 11882 B11R1.182 Cc1ccc(c(c1)CO[13CH3])C 34a_200011215349_200025704644 [1,2,0,0,0,0|1,0,0]=4 11883 B11R1.182 Cc1ccc(c(c1)CO[13CH3])C 7a_200011215349_200025704644 [1,2,0,0,0,0|1,0,0]=4 11884 B11R1.182 Cc1ccc(c(c1)CO[13CH3])Cl 34a_100009878994_200025704644 [1,2,0,0,0,0|1,0,0]=4 11885 B11R1.182 Cc1ccc(c(c1)CO[13CH3])Cl 7a_100009878994_200025704644 [1,2,0,0,0,0|1,0,0]=4 11886 B11R1.182 Cc1ccc(c(c1)CO[13CH3])F 34a_100011692775_200025704644 [1,2,0,0,0,0|1,0,0]=4 11887 B11R1.182 Cc1ccc(c(c1)CO[13CH3])F 7a_100011692775_200025704644 [1,2,0,0,0,0|1,0,0]=4 11888 B11R1.182 Cc1ccc(c(c1)CO[13CH3])N 34a_100011215565_200025704644 [1,2,0,0,0,0|1,0,0]=4 11889 B11R1.182 Cc1ccc(c(c1)CO[13CH3])N 7a_100011215565_200025704644 [1,2,0,0,0,0|1,0,0]=4 11890 B11R1.182 Cc1ccc(c(c1)CS[13CH3])C 62a_100000184699_200025704644 [1,2,0,0,0,0|1,0,0]=4 11891 B11R1.182 Cc1ccc(c(c1)CS[13CH3])C 62a_200025704644_100000184699 [1,2,0,0,0,0|1,0,0]=4 11892 B11R1.182 Cc1ccc(c(c1)CS[13CH3])Cl 62a_100009871730_200025704644 [1,2,0,0,0,0|1,0,0]=4 11893 B11R1.182 Cc1ccc(c(c1)CS[13CH3])Cl 62a_200025704644_100009871730 [1,2,0,0,0,0|1,0,0]=4 11894 B11R1.182 Cc1ccc(c(c1)CS[13CH3])F 62a_100011260760_200025704644 [1,2,0,0,0,0|1,0,0]=4 11895 B11R1.182 Cc1ccc(c(c1)CS[13CH3])F 62a_200025704644_100011260760 [1,2,0,0,0,0|1,0,0]=4 11896 B11R1.182 Cc1ccc(cc1CN[13CH3])Cl 34a_100000717755_200025704644 [1,2,0,0,0,0|1,0,0]=4 11897 B11R1.182 Cc1ccc(cc1CN[13CH3])F 34a_100011217291_200025704644 [1,2,0,0,0,0|1,0,0]=4 11898 B11R1.182 Cc1ccc(cc1CN[13CH3])O 34a_200009844824_200025704644 [1,2,0,0,0,0|1,0,0]=4 11899 B11R1.182 Cc1ccc(cc1CO[13CH3])Br 34a_100000700630_200025704644 [1,2,0,0,0,0|1,0,0]=4 11900 B11R1.182 Cc1ccc(cc1CO[13CH3])Br 7a_100000700630_200025704644 [1,2,0,0,0,0|1,0,0]=4 11901 B11R1.182 Cc1ccc(cc1CO[13CH3])Cl 34a_100012002407_200025704644 [1,2,0,0,0,0|1,0,0]=4 11902 B11R1.182 Cc1ccc(cc1CO[13CH3])Cl 7a_100012002407_200025704644 [1,2,0,0,0,0|1,0,0]=4 11903 B11R1.182 Cc1ccc(cc1CO[13CH3])F 34a_100011219218_200025704644 [1,2,0,0,0,0|1,0,0]=4 11904 B11R1.182 Cc1ccc(cc1CO[13CH3])F 7a_100011219218_200025704644 [1,2,0,0,0,0|1,0,0]=4 11905 B11R1.182 Cc1ccc(cc1CO[13CH3])I 34a_100010150140_200025704644 [1,2,0,0,0,0|1,0,0]=4 11906 B11R1.182 Cc1ccc(cc1CO[13CH3])I 7a_100010150140_200025704644 [1,2,0,0,0,0|1,0,0]=4 11907 B11R1.182 Cc1ccc(cc1CS[13CH3])Cl 62a_100012186985_200025704644 [1,2,0,0,0,0|1,0,0]=4 11908 B11R1.182 Cc1ccc(cc1CS[13CH3])Cl 62a_200025704644_100012186985 [1,2,0,0,0,0|1,0,0]=4 11909 B11R1.182 Cc1ccc(cc1CS[13CH3])F 62a_100000709795_200025704644 [1,2,0,0,0,0|1,0,0]=4 11910 B11R1.182 Cc1ccc(cc1CS[13CH3])F 62a_200025704644_100000709795 [1,2,0,0,0,0|1,0,0]=4 11911 B11R1.182 [13CH3]NCc1cc(ccc1Br)Br 34a_100000707832_200025704644 [1,2,0,0,0,0|1,0,0]=4 11912 B11R1.182 [13CH3]NCc1cc(ccc1Br)F 2230a_100000742738_200025704644 [1,2,0,0,0,0|1,0,0]=4 11913 B11R1.182 [13CH3]NCc1cc(ccc1Br)F 34a_100000742738_200025704644 [1,2,0,0,0,0|1,0,0]=4 11914 B11R1.182 [13CH3]NCc1cc(ccc1Cl)Br 34a_100025772652_200025704644 [1,2,0,0,0,0|1,0,0]=4 11915 B11R1.182 [13CH3]NCc1cc(ccc1Cl)Cl 34a_100102946428_200025704644 [1,2,0,0,0,0|1,0,0]=4 11916 B11R1.182 [13CH3]NCc1cc(ccc1Cl)F 2230a_100011830483_200025704644 [1,2,0,0,0,0|1,0,0]=4 11917 B11R1.182 [13CH3]NCc1cc(ccc1Cl)F 34a_100011830483_200025704644 [1,2,0,0,0,0|1,0,0]=4 11918 B11R1.182 [13CH3]NCc1cc(ccc1F)Br 34a_100009815772_200025704644 [1,2,0,0,0,0|1,0,0]=4 11919 B11R1.182 [13CH3]NCc1cc(ccc1F)Cl 34a_100011211646_200025704644 [1,2,0,0,0,0|1,0,0]=4 11920 B11R1.182 [13CH3]NCc1cc(ccc1F)F 34a_100000752317_200025704644 [1,2,0,0,0,0|1,0,0]=4 11921 B11R1.182 [13CH3]NCc1cc(ccc1O)Br 34a_100000730032_200025704644 [1,2,0,0,0,0|1,0,0]=4 11922 B11R1.182 [13CH3]NCc1cc(ccc1O)Cl 34a_100000238540_200025704644 [1,2,0,0,0,0|1,0,0]=4 11923 B11R1.182 [13CH3]OCc1cc(ccc1Br)Br 34a_100011266457_200025704644 [1,2,0,0,0,0|1,0,0]=4 11924 B11R1.182 [13CH3]OCc1cc(ccc1Br)Br 7a_100011266457_200025704644 [1,2,0,0,0,0|1,0,0]=4 11925 B11R1.182 [13CH3]OCc1cc(ccc1Br)Cl 34a_100012355668_200025704644 [1,2,0,0,0,0|1,0,0]=4 11926 B11R1.182 [13CH3]OCc1cc(ccc1Br)Cl 7a_100012355668_200025704644 [1,2,0,0,0,0|1,0,0]=4 11927 B11R1.182 [13CH3]OCc1cc(ccc1Br)F 34a_100011217561_200025704644 [1,2,0,0,0,0|1,0,0]=4 11928 B11R1.182 [13CH3]OCc1cc(ccc1Br)F 7a_100011217561_200025704644 [1,2,0,0,0,0|1,0,0]=4 11929 B11R1.182 [13CH3]OCc1cc(ccc1Br)I 7a_100012359683_200025704644 [1,2,0,0,0,0|1,0,0]=4 11930 B11R1.182 [13CH3]OCc1cc(ccc1Br)N 34a_100012347228_200025704644 [1,2,0,0,0,0|1,0,0]=4 11931 B11R1.182 [13CH3]OCc1cc(ccc1Cl)Br 34a_100011215897_200025704644 [1,2,0,0,0,0|1,0,0]=4 11932 B11R1.182 [13CH3]OCc1cc(ccc1Cl)Br 7a_100011215897_200025704644 [1,2,0,0,0,0|1,0,0]=4 11933 B11R1.182 [13CH3]OCc1cc(ccc1Cl)Cl 34a_100000698905_200025704644 [1,2,0,0,0,0|1,0,0]=4 11934 B11R1.182 [13CH3]OCc1cc(ccc1Cl)Cl 7a_100000698905_200025704644 [1,2,0,0,0,0|1,0,0]=4 11935 B11R1.182 [13CH3]OCc1cc(ccc1Cl)F 34a_100011218361_200025704644 [1,2,0,0,0,0|1,0,0]=4 11936 B11R1.182 [13CH3]OCc1cc(ccc1Cl)F 7a_100011218361_200025704644 [1,2,0,0,0,0|1,0,0]=4 11937 B11R1.182 [13CH3]OCc1cc(ccc1Cl)I 34a_100010128486_200025704644 [1,2,0,0,0,0|1,0,0]=4 11938 B11R1.182 [13CH3]OCc1cc(ccc1Cl)I 7a_100010128486_200025704644 [1,2,0,0,0,0|1,0,0]=4 11939 B11R1.182 [13CH3]OCc1cc(ccc1Cl)N 34a_100011273577_200025704644 [1,2,0,0,0,0|1,0,0]=4 11940 B11R1.182 [13CH3]OCc1cc(ccc1F)Br 34a_100000246282_200025704644 [1,2,0,0,0,0|1,0,0]=4 11941 B11R1.182 [13CH3]OCc1cc(ccc1F)Br 7a_100000246282_200025704644 [1,2,0,0,0,0|1,0,0]=4 11942 B11R1.182 [13CH3]OCc1cc(ccc1F)Cl 34a_100011217248_200025704644 [1,2,0,0,0,0|1,0,0]=4 11943 B11R1.182 [13CH3]OCc1cc(ccc1F)Cl 7a_100011217248_200025704644 [1,2,0,0,0,0|1,0,0]=4 11944 B11R1.182 [13CH3]OCc1cc(ccc1F)F 34a_100011217725_200025704644 [1,2,0,0,0,0|1,0,0]=4 11945 B11R1.182 [13CH3]OCc1cc(ccc1F)F 7a_100011217725_200025704644 [1,2,0,0,0,0|1,0,0]=4 11946 B11R1.182 [13CH3]OCc1cc(ccc1F)I 34a_100000049604_200025704644 [1,2,0,0,0,0|1,0,0]=4 11947 B11R1.182 [13CH3]OCc1cc(ccc1F)I 7a_100000049604_200025704644 [1,2,0,0,0,0|1,0,0]=4 11948 B11R1.182 [13CH3]OCc1cc(ccc1F)N 34a_100011218011_200025704644 [1,2,0,0,0,0|1,0,0]=4 11949 B11R1.182 [13CH3]OCc1cc(ccc1I)Br 34a_100011356890_200025704644 [1,2,0,0,0,0|1,0,0]=4 11950 B11R1.182 [13CH3]OCc1cc(ccc1I)Br 7a_100011356890_200025704644 [1,2,0,0,0,0|1,0,0]=4 11951 B11R1.182 [13CH3]OCc1cc(ccc1I)F 34a_100010255287_200025704644 [1,2,0,0,0,0|1,0,0]=4 11952 B11R1.182 [13CH3]OCc1cc(ccc1I)F 7a_100010255287_200025704644 [1,2,0,0,0,0|1,0,0]=4 11953 B11R1.182 [13CH3]OCc1cc(ccc1N)Br 34a_100012353972_200025704644 [1,2,0,0,0,0|1,0,0]=4 11954 B11R1.182 [13CH3]OCc1cc(ccc1N)Br 7a_100012353972_200025704644 [1,2,0,0,0,0|1,0,0]=4 11955 B11R1.182 [13CH3]OCc1cc(ccc1N)Cl 34a_100011214999_200025704644 [1,2,0,0,0,0|1,0,0]=4 11956 B11R1.182 [13CH3]OCc1cc(ccc1N)Cl 7a_100011214999_200025704644 [1,2,0,0,0,0|1,0,0]=4 11957 B11R1.182 [13CH3]OCc1cc(ccc1N)F 34a_100011296978_200025704644 [1,2,0,0,0,0|1,0,0]=4 11958 B11R1.182 [13CH3]OCc1cc(ccc1N)F 7a_100011296978_200025704644 [1,2,0,0,0,0|1,0,0]=4 11959 B11R1.182 [13CH3]SCc1cc(ccc1Br)Br 62a_100011982794_200025704644 [1,2,0,0,0,0|1,0,0]=4 11960 B11R1.182 [13CH3]SCc1cc(ccc1Br)Br 62a_200025704644_100011982794 [1,2,0,0,0,0|1,0,0]=4 11961 B11R1.182 [13CH3]SCc1cc(ccc1Br)Cl 62a_100000733903_200025704644 [1,2,0,0,0,0|1,0,0]=4 11962 B11R1.182 [13CH3]SCc1cc(ccc1Br)Cl 62a_200025704644_100000733903 [1,2,0,0,0,0|1,0,0]=4 11963 B11R1.182 [13CH3]SCc1cc(ccc1Br)F 62a_100000736370_200025704644 [1,2,0,0,0,0|1,0,0]=4 11964 B11R1.182 [13CH3]SCc1cc(ccc1Br)F 62a_200025704644_100000736370 [1,2,0,0,0,0|1,0,0]=4 11965 B11R1.182 [13CH3]SCc1cc(ccc1Br)I 62a_100012355412_200025704644 [1,2,0,0,0,0|1,0,0]=4 11966 B11R1.182 [13CH3]SCc1cc(ccc1Br)I 62a_200025704644_100012355412 [1,2,0,0,0,0|1,0,0]=4 11967 B11R1.182 [13CH3]SCc1cc(ccc1Cl)Br 62a_100000763347_200025704644 [1,2,0,0,0,0|1,0,0]=4 11968 B11R1.182 [13CH3]SCc1cc(ccc1Cl)Br 62a_200025704644_100000763347 [1,2,0,0,0,0|1,0,0]=4 11969 B11R1.182 [13CH3]SCc1cc(ccc1Cl)Cl 62a_100000756322_200025704644 [1,2,0,0,0,0|1,0,0]=4 11970 B11R1.182 [13CH3]SCc1cc(ccc1Cl)Cl 62a_200025704644_100000756322 [1,2,0,0,0,0|1,0,0]=4 11971 B11R1.182 [13CH3]SCc1cc(ccc1Cl)F 62a_100000709952_200025704644 [1,2,0,0,0,0|1,0,0]=4 11972 B11R1.182 [13CH3]SCc1cc(ccc1Cl)F 62a_200025704644_100000709952 [1,2,0,0,0,0|1,0,0]=4 11973 B11R1.182 [13CH3]SCc1cc(ccc1Cl)I 62a_100010188191_200025704644 [1,2,0,0,0,0|1,0,0]=4 11974 B11R1.182 [13CH3]SCc1cc(ccc1Cl)I 62a_200025704644_100010188191 [1,2,0,0,0,0|1,0,0]=4 11975 B11R1.182 [13CH3]SCc1cc(ccc1F)Br 62a_100000736399_200025704644 [1,2,0,0,0,0|1,0,0]=4 11976 B11R1.182 [13CH3]SCc1cc(ccc1F)Br 62a_200025704644_100000736399 [1,2,0,0,0,0|1,0,0]=4 11977 B11R1.182 [13CH3]SCc1cc(ccc1F)Cl 62a_100000716957_200025704644 [1,2,0,0,0,0|1,0,0]=4 11978 B11R1.182 [13CH3]SCc1cc(ccc1F)Cl 62a_200025704644_100000716957 [1,2,0,0,0,0|1,0,0]=4 11979 B11R1.182 [13CH3]SCc1cc(ccc1F)F 62a_100000685659_200025704644 [1,2,0,0,0,0|1,0,0]=4 11980 B11R1.182 [13CH3]SCc1cc(ccc1F)F 62a_200025704644_100000685659 [1,2,0,0,0,0|1,0,0]=4 11981 B11R1.182 [13CH3]SCc1cc(ccc1F)I 62a_200010149601_200025704644 [1,2,0,0,0,0|1,0,0]=4 11982 B11R1.182 [13CH3]SCc1cc(ccc1F)I 62a_200025704644_200010149601 [1,2,0,0,0,0|1,0,0]=4 11983 B11R1.182 [13CH3]SCc1cc(ccc1I)Br 62a_100012362523_200025704644 [1,2,0,0,0,0|1,0,0]=4 11984 B11R1.182 [13CH3]SCc1cc(ccc1I)Br 62a_200025704644_100012362523 [1,2,0,0,0,0|1,0,0]=4 11985 B11R1.182 [13CH3]SCc1cc(ccc1I)Cl 62a_100012348826_200025704644 [1,2,0,0,0,0|1,0,0]=4 11986 B11R1.182 [13CH3]SCc1cc(ccc1I)Cl 62a_200025704644_100012348826 [1,2,0,0,0,0|1,0,0]=4 11987 B11R1.182 [13CH3]SCc1cc(ccc1I)F 62a_100010149606_200025704644 [1,2,0,0,0,0|1,0,0]=4 11988 B11R1.182 [13CH3]SCc1cc(ccc1I)F 62a_200025704644_100010149606 [1,2,0,0,0,0|1,0,0]=4 11989 B11R1.182 [13CH3]SCc1cc(ccc1O)F 62a_100010161318_200025704644 [1,2,0,0,0,0|1,0,0]=4 11990 B11R1.182 [13CH3]SCc1cc(ccc1O)F 62a_200025704644_100010161318 [1,2,0,0,0,0|1,0,0]=4 11991 B11R1.222 CC(N[13CH3])c1ccccc1Br 2230a_100000181357_200025704644 [1,2,0,0,0,0|1,0,0]=4 11992 B11R1.222 CC(N[13CH3])c1ccccc1Cl 2230a_100000174978_200025704644 [1,2,0,0,0,0|1,0,0]=4 11993 B11R1.222 CC(N[13CH3])c1ccccc1Cl 34a_100000174978_200025704644 [1,2,0,0,0,0|1,0,0]=4 11994 B11R1.222 CC(N[13CH3])c1ccccc1F 2230a_100000181408_200025704644 [1,2,0,0,0,0|1,0,0]=4 11995 B11R1.222 CC(N[13CH3])c1ccccc1F 34a_100000181408_200025704644 [1,2,0,0,0,0|1,0,0]=4 11996 B11R1.222 CC(O[13CH3])c1ccccc1Br 34a_100000702211_200025704644 [1,2,0,0,0,0|1,0,0]=4 11997 B11R1.222 CC(O[13CH3])c1ccccc1Br 7a_100000702211_200025704644 [1,2,0,0,0,0|1,0,0]=4 11998 B11R1.222 CC(O[13CH3])c1ccccc1Cl 34a_100000740796_200025704644 [1,2,0,0,0,0|1,0,0]=4 11999 B11R1.222 CC(O[13CH3])c1ccccc1Cl 7a_100000740796_200025704644 [1,2,0,0,0,0|1,0,0]=4 12000 B11R1.222 CC(O[13CH3])c1ccccc1F 34a_100000697922_200025704644 [1,2,0,0,0,0|1,0,0]=4 12001 B11R1.222 CC(O[13CH3])c1ccccc1F 7a_100000697922_200025704644 [1,2,0,0,0,0|1,0,0]=4 12002 B11R1.222 CC(O[13CH3])c1ccccc1N 7a_100011405641_200025704644 [1,2,0,0,0,0|1,0,0]=4 12003 B11R1.222 CC(S[13CH3])c1ccccc1Cl 62a_100000181259_200025704644 [1,2,0,0,0,0|1,0,0]=4 12004 B11R1.222 CC(S[13CH3])c1ccccc1Cl 62a_200025704644_100000181259 [1,2,0,0,0,0|1,0,0]=4 12005 B11R1.222 CC(S[13CH3])c1ccccc1F 62a_200000741388_200025704644 [1,2,0,0,0,0|1,0,0]=4 12006 B11R1.222 CC(S[13CH3])c1ccccc1F 62a_200025704644_200000741388 [1,2,0,0,0,0|1,0,0]=4 12007 B11R1.222 CNC(C)c1ccccc1Br 2230a_100000181357_200000210301 [1,2,0,0,0,0|1,0,0]=4 12008 B11R1.222 CNC(C)c1ccccc1Br 269862a_106832991636_100000187085 [1,2,0,0,0,0|1,0,0]=4 12009 B11R1.222 CNC(C)c1ccccc1C 2230a_100000181355_200000210301 [1,2,0,0,0,0|1,0,0]=4 12010 B11R1.222 CNC(C)c1ccccc1C 269862a_106832991636_100000211656 [1,2,0,0,0,0|1,0,0]=4 12011 B11R1.222 CNC(C)c1ccccc1C 34a_100000181355_200000210301 [1,2,0,0,0,0|1,0,0]=4 12012 B11R1.222 CNC(C)c1ccccc1Cl 2230a_100000174978_200000210301 [1,2,0,0,0,0|1,0,0]=4 12013 B11R1.222 CNC(C)c1ccccc1Cl 2230a_106832991635_100000181259 [1,2,0,0,0,0|1,0,0]=4 12014 B11R1.222 CNC(C)c1ccccc1Cl 269862a_106832991636_100000210134 [1,2,0,0,0,0|1,0,0]=4 12015 B11R1.222 CNC(C)c1ccccc1Cl 34a_100000174978_200000210301 [1,2,0,0,0,0|1,0,0]=4 12016 B11R1.222 CNC(C)c1ccccc1Cl 7a_106832991635_100000181259 [1,2,0,0,0,0|1,0,0]=4 12017 B11R1.222 CNC(C)c1ccccc1F 2230a_100000181408_200000210301 [1,2,0,0,0,0|1,0,0]=4 12018 B11R1.222 CNC(C)c1ccccc1F 2230a_106832991635_200000741388 [1,2,0,0,0,0|1,0,0]=4 12019 B11R1.222 CNC(C)c1ccccc1F 269862a_106832991636_100000210632 [1,2,0,0,0,0|1,0,0]=4 12020 B11R1.222 CNC(C)c1ccccc1F 34a_100000181408_200000210301 [1,2,0,0,0,0|1,0,0]=4 12021 B11R1.222 CNC(C)c1ccccc1F 34a_100102657272_200000741388 [1,2,0,0,0,0|1,0,0]=4 12022 B11R1.222 CNC(C)c1ccccc1F 7a_106832991635_200000741388 [1,2,0,0,0,0|1,0,0]=4 12023 B11R1.222 CNC(C)c1ccccc1I 269862a_106832991636_100000751169 [1,2,0,0,0,0|1,0,0]=4 12024 B11R1.222 CNC(C)c1ccccc1O 271570a_203496583355_100000692418 [1,2,0,0,0,0|1,0,0]=4 12025 B11R1.222 CN[C@H](C)c1ccccc1O 2230a_100025703389_200000210301 [1,2,0,0,0,0|1,0,0]=4 12026 B11R1.222 COC(C)c1ccccc1Br 34a_100000702211_200000210301 [1,2,0,0,0,0|1,0,0]=4 12027 B11R1.222 COC(C)c1ccccc1Br 7a_100000702211_200000210301 [1,2,0,0,0,0|1,0,0]=4 12028 B11R1.222 COC(C)c1ccccc1C 34a_100000742021_200000210301 [1,2,0,0,0,0|1,0,0]=4 12029 B11R1.222 COC(C)c1ccccc1C 7a_100000742021_200000210301 [1,2,0,0,0,0|1,0,0]=4 12030 B11R1.222 COC(C)c1ccccc1Cl 34a_100000740796_200000210301 [1,2,0,0,0,0|1,0,0]=4 12031 B11R1.222 COC(C)c1ccccc1Cl 7a_100000740796_200000210301 [1,2,0,0,0,0|1,0,0]=4 12032 B11R1.222 COC(C)c1ccccc1F 34a_100000697922_200000210301 [1,2,0,0,0,0|1,0,0]=4 12033 B11R1.222 COC(C)c1ccccc1F 34a_100138415774_200000741388 [1,2,0,0,0,0|1,0,0]=4 12034 B11R1.222 COC(C)c1ccccc1F 7a_100000697922_200000210301 [1,2,0,0,0,0|1,0,0]=4 12035 B11R1.222 COC(C)c1ccccc1N 7a_100011405641_200000210301 [1,2,0,0,0,0|1,0,0]=4 12036 B11R1.222 CSC(C)c1ccccc1Cl 62a_100000181259_200000210301 [1,2,0,0,0,0|1,0,0]=4 12037 B11R1.222 CSC(C)c1ccccc1Cl 62a_200000210301_100000181259 [1,2,0,0,0,0|1,0,0]=4 12038 B11R1.222 CSC(C)c1ccccc1F 62a_200000210301_200000741388 [1,2,0,0,0,0|1,0,0]=4 12039 B11R1.222 CSC(C)c1ccccc1F 62a_200000741388_200000210301 [1,2,0,0,0,0|1,0,0]=4 12040 B11R1.222 C[C@@H](N[13CH3])c1ccccc1O 2230a_100025703389_200025704644 [1,2,0,0,0,0|1,0,0]=4 12041 B11R1.222 Cc1ccccc1C(C)N[13CH3] 2230a_100000181355_200025704644 [1,2,0,0,0,0|1,0,0]=4 12042 B11R1.222 Cc1ccccc1C(C)N[13CH3] 34a_100000181355_200025704644 [1,2,0,0,0,0|1,0,0]=4 12043 B11R1.222 Cc1ccccc1C(C)O[13CH3] 34a_100000742021_200025704644 [1,2,0,0,0,0|1,0,0]=4 12044 B11R1.222 Cc1ccccc1C(C)O[13CH3] 7a_100000742021_200025704644 [1,2,0,0,0,0|1,0,0]=4 12045 B11R1.605 C=CCc1c(ccnc1F)O 271570a_203496583355_200010238768 [1,2,0,0,0,0|1,0,0]=4 12046 B11R1.605 CC=Cc1c(cccc1Br)Br 271570a_100016259895_100009994525 [1,2,0,0,0,0|0,0,1]=4 12047 B11R1.605 CC=Cc1c(cccc1Br)Cl 271570a_100016259895_100010214488 [1,2,0,0,0,0|0,0,1]=4 12048 B11R1.605 CC=Cc1c(cccc1Br)F 271570a_100016259895_100011219512 [1,2,0,0,0,0|0,0,1]=4 12049 B11R1.605 CC=Cc1c(cccc1Br)N 271570a_100016259895_100020590159 [1,2,0,0,0,0|0,0,1]=4 12050 B11R1.605 CC=Cc1c(cccc1Br)O 271570a_100016259895_100010187912 [1,2,0,0,0,0|0,0,1]=4 12051 B11R1.605 CC=Cc1c(cccc1C)C 271570a_100016259895_100000033847 [1,2,0,0,0,0|0,0,1]=4 12052 B11R1.605 CC=Cc1c(cccc1Cl)C 271570a_100016259895_100000043165 [1,2,0,0,0,0|0,0,1]=4 12053 B11R1.605 CC=Cc1c(cccc1Cl)Cl 271570a_100016259895_100000034237 [1,2,0,0,0,0|0,0,1]=4 12054 B11R1.605 CC=Cc1c(cccc1Cl)F 271570a_100016259895_100000050007 [1,2,0,0,0,0|0,0,1]=4 12055 B11R1.605 CC=Cc1c(cccc1Cl)N 271570a_100016259895_100000049713 [1,2,0,0,0,0|0,0,1]=4 12056 B11R1.605 CC=Cc1c(cccc1Cl)O 271570a_100016259895_100000050174 [1,2,0,0,0,0|0,0,1]=4 12057 B11R1.605 CC=Cc1c(cccc1F)C 271570a_100016259895_100012349962 [1,2,0,0,0,0|0,0,1]=4 12058 B11R1.605 CC=Cc1c(cccc1F)F 271570a_100016259895_100000693133 [1,2,0,0,0,0|0,0,1]=4 12059 B11R1.605 CC=Cc1c(cccc1F)N 271570a_100016259895_100011934729 [1,2,0,0,0,0|0,0,1]=4 12060 B11R1.605 CC=Cc1c(cccc1F)O 271570a_100016259895_100009820682 [1,2,0,0,0,0|0,0,1]=4 12061 B11R1.605 CC=Cc1c(cccc1N)C 271570a_100016259895_100000684715 [1,2,0,0,0,0|0,0,1]=4 12062 B11R1.605 CC=Cc1c(cccc1O)C 271570a_100016259895_100000686692 [1,2,0,0,0,0|0,0,1]=4 12063 B11R1.605 CC=Cc1c(cccc1O)N 271570a_100016259895_100012183704 [1,2,0,0,0,0|0,0,1]=4 12064 B11R1.605 CC=Cc1c(cccc1O)O 271570a_100016259895_100010205330 [1,2,0,0,0,0|0,0,1]=4 12065 B11R1.605 CNCc1c(cccc1Br)Br 207a_100102657272_100010233043 [1,2,0,0,0,0|1,0,0]=4 12066 B11R1.605 CNCc1c(cccc1Br)Br 26a_100102657272_100000736428 [1,2,0,0,0,0|1,0,0]=4 12067 B11R1.605 CNCc1c(cccc1Br)Br 270004a_106832991635_100010233043 [1,2,0,0,0,0|1,0,0]=4 12068 B11R1.605 CNCc1c(cccc1Br)C 207a_100102657272_100009881667 [1,2,0,0,0,0|1,0,0]=4 12069 B11R1.605 CNCc1c(cccc1Br)C 2230a_106832991635_100010146847 [1,2,0,0,0,0|1,0,0]=4 12070 B11R1.605 CNCc1c(cccc1Br)C 26a_100102657272_100009817157 [1,2,0,0,0,0|1,0,0]=4 12071 B11R1.605 CNCc1c(cccc1Br)C 270004a_106832991635_100009881667 [1,2,0,0,0,0|1,0,0]=4 12072 B11R1.605 CNCc1c(cccc1Br)C 34a_100102657272_100010146847 [1,2,0,0,0,0|1,0,0]=4 12073 B11R1.605 CNCc1c(cccc1Br)C 7a_106832991635_100010146847 [1,2,0,0,0,0|1,0,0]=4 12074 B11R1.605 CNCc1c(cccc1Br)Cl 207a_100102657272_100011249081 [1,2,0,0,0,0|1,0,0]=4 12075 B11R1.605 CNCc1c(cccc1Br)Cl 2230a_106832991635_100010138402 [1,2,0,0,0,0|1,0,0]=4 12076 B11R1.605 CNCc1c(cccc1Br)Cl 26a_100102657272_100010214474 [1,2,0,0,0,0|1,0,0]=4 12077 B11R1.605 CNCc1c(cccc1Br)Cl 270004a_106832991635_100011249081 [1,2,0,0,0,0|1,0,0]=4 12078 B11R1.605 CNCc1c(cccc1Br)Cl 34a_100102657272_100010138402 [1,2,0,0,0,0|1,0,0]=4 12079 B11R1.605 CNCc1c(cccc1Br)Cl 7a_106832991635_100010138402 [1,2,0,0,0,0|1,0,0]=4 12080 B11R1.605 CNCc1c(cccc1Br)F 207a_100102657272_100000752695 [1,2,0,0,0,0|1,0,0]=4 12081 B11R1.605 CNCc1c(cccc1Br)F 2230a_106832991635_100012145669 [1,2,0,0,0,0|1,0,0]=4 12082 B11R1.605 CNCc1c(cccc1Br)F 26a_100102657272_100009813666 [1,2,0,0,0,0|1,0,0]=4 12083 B11R1.605 CNCc1c(cccc1Br)F 270004a_106832991635_100000752695 [1,2,0,0,0,0|1,0,0]=4 12084 B11R1.605 CNCc1c(cccc1Br)F 34a_100012349121_200000210301 [1,2,0,0,0,0|1,0,0]=4 12085 B11R1.605 CNCc1c(cccc1Br)F 34a_100102657272_100012145669 [1,2,0,0,0,0|1,0,0]=4 12086 B11R1.605 CNCc1c(cccc1Br)F 7a_106832991635_100000696636 [1,2,0,0,0,0|1,0,0]=4 12087 B11R1.605 CNCc1c(cccc1C)C 207a_100102657272_100000758299 [1,2,0,0,0,0|1,0,0]=4 12088 B11R1.605 CNCc1c(cccc1C)C 2230a_106832991635_100000758300 [1,2,0,0,0,0|1,0,0]=4 12089 B11R1.605 CNCc1c(cccc1C)C 270004a_106832991635_100000758299 [1,2,0,0,0,0|1,0,0]=4 12090 B11R1.605 CNCc1c(cccc1C)C 34a_100000689800_200000210301 [1,2,0,0,0,0|1,0,0]=4 12091 B11R1.605 CNCc1c(cccc1C)C 34a_100102657272_100000758300 [1,2,0,0,0,0|1,0,0]=4 12092 B11R1.605 CNCc1c(cccc1C)C 7a_106832991635_100000758300 [1,2,0,0,0,0|1,0,0]=4 12093 B11R1.605 CNCc1c(cccc1Cl)C 207a_100102657272_100000041122 [1,2,0,0,0,0|1,0,0]=4 12094 B11R1.605 CNCc1c(cccc1Cl)C 270004a_106832991635_100000041122 [1,2,0,0,0,0|1,0,0]=4 12095 B11R1.605 CNCc1c(cccc1Cl)Cl 207a_100102657272_100000189306 [1,2,0,0,0,0|1,0,0]=4 12096 B11R1.605 CNCc1c(cccc1Cl)Cl 2230a_100000174884_200000210301 [1,2,0,0,0,0|1,0,0]=4 12097 B11R1.605 CNCc1c(cccc1Cl)Cl 2230a_106832991635_100000187851 [1,2,0,0,0,0|1,0,0]=4 12098 B11R1.605 CNCc1c(cccc1Cl)Cl 26a_100102657272_100000211709 [1,2,0,0,0,0|1,0,0]=4 12099 B11R1.605 CNCc1c(cccc1Cl)Cl 270004a_106832991635_100000189306 [1,2,0,0,0,0|1,0,0]=4 12100 B11R1.605 CNCc1c(cccc1Cl)Cl 34a_100000174884_200000210301 [1,2,0,0,0,0|1,0,0]=4 12101 B11R1.605 CNCc1c(cccc1Cl)Cl 34a_100102657272_100000187851 [1,2,0,0,0,0|1,0,0]=4 12102 B11R1.605 CNCc1c(cccc1Cl)Cl 7a_106832991635_100000187851 [1,2,0,0,0,0|1,0,0]=4 12103 B11R1.605 CNCc1c(cccc1Cl)F 207a_100102657272_100000210083 [1,2,0,0,0,0|1,0,0]=4 12104 B11R1.605 CNCc1c(cccc1Cl)F 2230a_106832991635_100000187852 [1,2,0,0,0,0|1,0,0]=4 12105 B11R1.605 CNCc1c(cccc1Cl)F 270004a_106832991635_100000210083 [1,2,0,0,0,0|1,0,0]=4 12106 B11R1.605 CNCc1c(cccc1Cl)F 34a_100000174883_200000210301 [1,2,0,0,0,0|1,0,0]=4 12107 B11R1.605 CNCc1c(cccc1Cl)F 34a_100102657272_100000187852 [1,2,0,0,0,0|1,0,0]=4 12108 B11R1.605 CNCc1c(cccc1Cl)F 7a_106832991635_100000187852 [1,2,0,0,0,0|1,0,0]=4 12109 B11R1.605 CNCc1c(cccc1F)C 207a_100102657272_100000069827 [1,2,0,0,0,0|1,0,0]=4 12110 B11R1.605 CNCc1c(cccc1F)C 2230a_106832991635_100009814554 [1,2,0,0,0,0|1,0,0]=4 12111 B11R1.605 CNCc1c(cccc1F)C 270004a_106832991635_100000069827 [1,2,0,0,0,0|1,0,0]=4 12112 B11R1.605 CNCc1c(cccc1F)C 34a_100000762012_200000210301 [1,2,0,0,0,0|1,0,0]=4 12113 B11R1.605 CNCc1c(cccc1F)C 34a_100102657272_100009814554 [1,2,0,0,0,0|1,0,0]=4 12114 B11R1.605 CNCc1c(cccc1F)C 7a_106832991635_100009814554 [1,2,0,0,0,0|1,0,0]=4 12115 B11R1.605 CNCc1c(cccc1F)F 207a_100102657272_100000211061 [1,2,0,0,0,0|1,0,0]=4 12116 B11R1.605 CNCc1c(cccc1F)F 2230a_106832991635_100000698325 [1,2,0,0,0,0|1,0,0]=4 12117 B11R1.605 CNCc1c(cccc1F)F 270004a_106832991635_100000211061 [1,2,0,0,0,0|1,0,0]=4 12118 B11R1.605 CNCc1c(cccc1F)F 34a_100000688400_200000210301 [1,2,0,0,0,0|1,0,0]=4 12119 B11R1.605 CNCc1c(cccc1F)F 34a_100102657272_100000698325 [1,2,0,0,0,0|1,0,0]=4 12120 B11R1.605 CNCc1c(cccc1F)F 7a_106832991635_100000698325 [1,2,0,0,0,0|1,0,0]=4 12121 B11R1.605 CNCc1c(cccc1F)O 271570a_203496583355_106744473292 [1,2,0,0,0,0|1,0,0]=4 12122 B11R1.605 CNCc1c(cccc1I)Br 2230a_106832991635_100010146611 [1,2,0,0,0,0|1,0,0]=4 12123 B11R1.605 CNCc1c(cccc1I)Br 26a_100102657272_100010084509 [1,2,0,0,0,0|1,0,0]=4 12124 B11R1.605 CNCc1c(cccc1I)Br 34a_100102657272_100010146611 [1,2,0,0,0,0|1,0,0]=4 12125 B11R1.605 CNCc1c(cccc1I)Br 7a_106832991635_100010146611 [1,2,0,0,0,0|1,0,0]=4 12126 B11R1.605 CNCc1c(cccc1I)C 2230a_106832991635_100010150146 [1,2,0,0,0,0|1,0,0]=4 12127 B11R1.605 CNCc1c(cccc1I)C 34a_100102657272_100010150146 [1,2,0,0,0,0|1,0,0]=4 12128 B11R1.605 CNCc1c(cccc1I)C 7a_106832991635_100010150146 [1,2,0,0,0,0|1,0,0]=4 12129 B11R1.605 CNCc1c(cccc1I)Cl 207a_100102657272_100010147682 [1,2,0,0,0,0|1,0,0]=4 12130 B11R1.605 CNCc1c(cccc1I)Cl 270004a_106832991635_100010147682 [1,2,0,0,0,0|1,0,0]=4 12131 B11R1.605 CNCc1c(cccc1I)F 207a_100102657272_100010178011 [1,2,0,0,0,0|1,0,0]=4 12132 B11R1.605 CNCc1c(cccc1I)F 2230a_106832991635_100010149602 [1,2,0,0,0,0|1,0,0]=4 12133 B11R1.605 CNCc1c(cccc1I)F 270004a_106832991635_100010178011 [1,2,0,0,0,0|1,0,0]=4 12134 B11R1.605 CNCc1c(cccc1I)F 34a_100102657272_100010149602 [1,2,0,0,0,0|1,0,0]=4 12135 B11R1.605 CNCc1c(cccc1I)F 7a_106832991635_100010149602 [1,2,0,0,0,0|1,0,0]=4 12136 B11R1.605 COCc1c(cccc1Br)Br 34a_100010172814_200000210301 [1,2,0,0,0,0|1,0,0]=4 12137 B11R1.605 COCc1c(cccc1Br)Br 7a_100010172814_200000210301 [1,2,0,0,0,0|1,0,0]=4 12138 B11R1.605 COCc1c(cccc1Br)C 34a_100138415774_100010146847 [1,2,0,0,0,0|1,0,0]=4 12139 B11R1.605 COCc1c(cccc1Br)Cl 34a_100138415774_100010138402 [1,2,0,0,0,0|1,0,0]=4 12140 B11R1.605 COCc1c(cccc1Br)F 34a_100012355691_200000210301 [1,2,0,0,0,0|1,0,0]=4 12141 B11R1.605 COCc1c(cccc1Br)F 34a_100138415774_100012145669 [1,2,0,0,0,0|1,0,0]=4 12142 B11R1.605 COCc1c(cccc1Br)F 7a_100012355691_200000210301 [1,2,0,0,0,0|1,0,0]=4 12143 B11R1.605 COCc1c(cccc1Br)N 34a_100000747656_200000210301 [1,2,0,0,0,0|1,0,0]=4 12144 B11R1.605 COCc1c(cccc1C)C 34a_100011933981_200000210301 [1,2,0,0,0,0|1,0,0]=4 12145 B11R1.605 COCc1c(cccc1C)C 34a_100138415774_100000758300 [1,2,0,0,0,0|1,0,0]=4 12146 B11R1.605 COCc1c(cccc1C)C 7a_100011933981_200000210301 [1,2,0,0,0,0|1,0,0]=4 12147 B11R1.605 COCc1c(cccc1Cl)C 34a_100000082531_200000210301 [1,2,0,0,0,0|1,0,0]=4 12148 B11R1.605 COCc1c(cccc1Cl)C 7a_100000082531_200000210301 [1,2,0,0,0,0|1,0,0]=4 12149 B11R1.605 COCc1c(cccc1Cl)Cl 34a_100000215722_200000210301 [1,2,0,0,0,0|1,0,0]=4 12150 B11R1.605 COCc1c(cccc1Cl)Cl 34a_100138415774_100000187851 [1,2,0,0,0,0|1,0,0]=4 12151 B11R1.605 COCc1c(cccc1Cl)Cl 7a_100000215722_200000210301 [1,2,0,0,0,0|1,0,0]=4 12152 B11R1.605 COCc1c(cccc1Cl)F 34a_100000215723_200000210301 [1,2,0,0,0,0|1,0,0]=4 12153 B11R1.605 COCc1c(cccc1Cl)F 34a_100138415774_100000187852 [1,2,0,0,0,0|1,0,0]=4 12154 B11R1.605 COCc1c(cccc1Cl)F 7a_100000215723_200000210301 [1,2,0,0,0,0|1,0,0]=4 12155 B11R1.605 COCc1c(cccc1Cl)N 34a_100011916388_200000210301 [1,2,0,0,0,0|1,0,0]=4 12156 B11R1.605 COCc1c(cccc1F)C 34a_100000057874_200000210301 [1,2,0,0,0,0|1,0,0]=4 12157 B11R1.605 COCc1c(cccc1F)C 34a_100138415774_100009814554 [1,2,0,0,0,0|1,0,0]=4 12158 B11R1.605 COCc1c(cccc1F)C 7a_100000057874_200000210301 [1,2,0,0,0,0|1,0,0]=4 12159 B11R1.605 COCc1c(cccc1F)F 34a_100000698215_200000210301 [1,2,0,0,0,0|1,0,0]=4 12160 B11R1.605 COCc1c(cccc1F)F 34a_100138415774_100000698325 [1,2,0,0,0,0|1,0,0]=4 12161 B11R1.605 COCc1c(cccc1F)F 7a_100000698215_200000210301 [1,2,0,0,0,0|1,0,0]=4 12162 B11R1.605 COCc1c(cccc1F)N 34a_100011846719_200000210301 [1,2,0,0,0,0|1,0,0]=4 12163 B11R1.605 COCc1c(cccc1I)Br 34a_100138415774_100010146611 [1,2,0,0,0,0|1,0,0]=4 12164 B11R1.605 COCc1c(cccc1I)C 34a_100138415774_100010150146 [1,2,0,0,0,0|1,0,0]=4 12165 B11R1.605 COCc1c(cccc1I)F 34a_100010214973_200000210301 [1,2,0,0,0,0|1,0,0]=4 12166 B11R1.605 COCc1c(cccc1I)F 34a_100138415774_100010149602 [1,2,0,0,0,0|1,0,0]=4 12167 B11R1.605 COCc1c(cccc1I)F 7a_100010214973_200000210301 [1,2,0,0,0,0|1,0,0]=4 12168 B11R1.605 CSCc1c(cccc1Br)C 62a_100010146847_200000210301 [1,2,0,0,0,0|1,0,0]=4 12169 B11R1.605 CSCc1c(cccc1Br)C 62a_200000210301_100010146847 [1,2,0,0,0,0|1,0,0]=4 12170 B11R1.605 CSCc1c(cccc1Br)Cl 62a_100010138402_200000210301 [1,2,0,0,0,0|1,0,0]=4 12171 B11R1.605 CSCc1c(cccc1Br)Cl 62a_200000210301_100010138402 [1,2,0,0,0,0|1,0,0]=4 12172 B11R1.605 CSCc1c(cccc1Br)F 62a_100012145669_200000210301 [1,2,0,0,0,0|1,0,0]=4 12173 B11R1.605 CSCc1c(cccc1Br)F 62a_200000210301_100012145669 [1,2,0,0,0,0|1,0,0]=4 12174 B11R1.605 CSCc1c(cccc1C)C 62a_100000758300_200000210301 [1,2,0,0,0,0|1,0,0]=4 12175 B11R1.605 CSCc1c(cccc1C)C 62a_200000210301_100000758300 [1,2,0,0,0,0|1,0,0]=4 12176 B11R1.605 CSCc1c(cccc1Cl)Cl 62a_100000187851_200000210301 [1,2,0,0,0,0|1,0,0]=4 12177 B11R1.605 CSCc1c(cccc1Cl)Cl 62a_200000210301_100000187851 [1,2,0,0,0,0|1,0,0]=4 12178 B11R1.605 CSCc1c(cccc1Cl)F 62a_100000187852_200000210301 [1,2,0,0,0,0|1,0,0]=4 12179 B11R1.605 CSCc1c(cccc1Cl)F 62a_200000210301_100000187852 [1,2,0,0,0,0|1,0,0]=4 12180 B11R1.605 CSCc1c(cccc1F)C 62a_100009814554_200000210301 [1,2,0,0,0,0|1,0,0]=4 12181 B11R1.605 CSCc1c(cccc1F)C 62a_200000210301_100009814554 [1,2,0,0,0,0|1,0,0]=4 12182 B11R1.605 CSCc1c(cccc1F)F 62a_100000709179_200000210301 [1,2,0,0,0,0|1,0,0]=4 12183 B11R1.605 CSCc1c(cccc1F)F 62a_200000210301_100000698325 [1,2,0,0,0,0|1,0,0]=4 12184 B11R1.605 CSCc1c(cccc1I)Br 62a_100010146611_200000210301 [1,2,0,0,0,0|1,0,0]=4 12185 B11R1.605 CSCc1c(cccc1I)Br 62a_200000210301_100010146611 [1,2,0,0,0,0|1,0,0]=4 12186 B11R1.605 CSCc1c(cccc1I)C 62a_100010150146_200000210301 [1,2,0,0,0,0|1,0,0]=4 12187 B11R1.605 CSCc1c(cccc1I)C 62a_200000210301_100010150146 [1,2,0,0,0,0|1,0,0]=4 12188 B11R1.605 CSCc1c(cccc1I)F 62a_100010149602_200000210301 [1,2,0,0,0,0|1,0,0]=4 12189 B11R1.605 CSCc1c(cccc1I)F 62a_200000210301_100010149602 [1,2,0,0,0,0|1,0,0]=4 12190 B11R1.605 Cc1cccc(c1CN[13CH3])C 34a_100000689800_200025704644 [1,2,0,0,0,0|1,0,0]=4 12191 B11R1.605 Cc1cccc(c1CN[13CH3])F 34a_100000762012_200025704644 [1,2,0,0,0,0|1,0,0]=4 12192 B11R1.605 Cc1cccc(c1CO[13CH3])C 34a_100011933981_200025704644 [1,2,0,0,0,0|1,0,0]=4 12193 B11R1.605 Cc1cccc(c1CO[13CH3])C 7a_100011933981_200025704644 [1,2,0,0,0,0|1,0,0]=4 12194 B11R1.605 Cc1cccc(c1CO[13CH3])Cl 34a_100000082531_200025704644 [1,2,0,0,0,0|1,0,0]=4 12195 B11R1.605 Cc1cccc(c1CO[13CH3])Cl 7a_100000082531_200025704644 [1,2,0,0,0,0|1,0,0]=4 12196 B11R1.605 Cc1cccc(c1CO[13CH3])F 34a_100000057874_200025704644 [1,2,0,0,0,0|1,0,0]=4 12197 B11R1.605 Cc1cccc(c1CO[13CH3])F 7a_100000057874_200025704644 [1,2,0,0,0,0|1,0,0]=4 12198 B11R1.605 Cc1cccc(c1CS[13CH3])Br 62a_100010146847_200025704644 [1,2,0,0,0,0|1,0,0]=4 12199 B11R1.605 Cc1cccc(c1CS[13CH3])Br 62a_200025704644_100010146847 [1,2,0,0,0,0|1,0,0]=4 12200 B11R1.605 Cc1cccc(c1CS[13CH3])C 62a_100000758300_200025704644 [1,2,0,0,0,0|1,0,0]=4 12201 B11R1.605 Cc1cccc(c1CS[13CH3])C 62a_200025704644_100000758300 [1,2,0,0,0,0|1,0,0]=4 12202 B11R1.605 Cc1cccc(c1CS[13CH3])F 62a_100009814554_200025704644 [1,2,0,0,0,0|1,0,0]=4 12203 B11R1.605 Cc1cccc(c1CS[13CH3])F 62a_200025704644_100009814554 [1,2,0,0,0,0|1,0,0]=4 12204 B11R1.605 Cc1cccc(c1CS[13CH3])I 62a_100010150146_200025704644 [1,2,0,0,0,0|1,0,0]=4 12205 B11R1.605 Cc1cccc(c1CS[13CH3])I 62a_200025704644_100010150146 [1,2,0,0,0,0|1,0,0]=4 12206 B11R1.605 [13CH3]NCc1c(cccc1Br)F 34a_100012349121_200025704644 [1,2,0,0,0,0|1,0,0]=4 12207 B11R1.605 [13CH3]NCc1c(cccc1Cl)Cl 2230a_100000174884_200025704644 [1,2,0,0,0,0|1,0,0]=4 12208 B11R1.605 [13CH3]NCc1c(cccc1Cl)Cl 34a_100000174884_200025704644 [1,2,0,0,0,0|1,0,0]=4 12209 B11R1.605 [13CH3]NCc1c(cccc1Cl)F 34a_100000174883_200025704644 [1,2,0,0,0,0|1,0,0]=4 12210 B11R1.605 [13CH3]NCc1c(cccc1F)F 34a_100000688400_200025704644 [1,2,0,0,0,0|1,0,0]=4 12211 B11R1.605 [13CH3]OCc1c(cccc1Br)Br 34a_100010172814_200025704644 [1,2,0,0,0,0|1,0,0]=4 12212 B11R1.605 [13CH3]OCc1c(cccc1Br)Br 7a_100010172814_200025704644 [1,2,0,0,0,0|1,0,0]=4 12213 B11R1.605 [13CH3]OCc1c(cccc1Br)F 34a_100012355691_200025704644 [1,2,0,0,0,0|1,0,0]=4 12214 B11R1.605 [13CH3]OCc1c(cccc1Br)F 7a_100012355691_200025704644 [1,2,0,0,0,0|1,0,0]=4 12215 B11R1.605 [13CH3]OCc1c(cccc1Br)N 34a_100000747656_200025704644 [1,2,0,0,0,0|1,0,0]=4 12216 B11R1.605 [13CH3]OCc1c(cccc1Cl)Cl 34a_100000215722_200025704644 [1,2,0,0,0,0|1,0,0]=4 12217 B11R1.605 [13CH3]OCc1c(cccc1Cl)Cl 7a_100000215722_200025704644 [1,2,0,0,0,0|1,0,0]=4 12218 B11R1.605 [13CH3]OCc1c(cccc1Cl)F 34a_100000215723_200025704644 [1,2,0,0,0,0|1,0,0]=4 12219 B11R1.605 [13CH3]OCc1c(cccc1Cl)F 7a_100000215723_200025704644 [1,2,0,0,0,0|1,0,0]=4 12220 B11R1.605 [13CH3]OCc1c(cccc1Cl)N 34a_100011916388_200025704644 [1,2,0,0,0,0|1,0,0]=4 12221 B11R1.605 [13CH3]OCc1c(cccc1F)F 34a_100000698215_200025704644 [1,2,0,0,0,0|1,0,0]=4 12222 B11R1.605 [13CH3]OCc1c(cccc1F)F 7a_100000698215_200025704644 [1,2,0,0,0,0|1,0,0]=4 12223 B11R1.605 [13CH3]OCc1c(cccc1F)N 34a_100011846719_200025704644 [1,2,0,0,0,0|1,0,0]=4 12224 B11R1.605 [13CH3]OCc1c(cccc1I)F 34a_100010214973_200025704644 [1,2,0,0,0,0|1,0,0]=4 12225 B11R1.605 [13CH3]OCc1c(cccc1I)F 7a_100010214973_200025704644 [1,2,0,0,0,0|1,0,0]=4 12226 B11R1.605 [13CH3]SCc1c(cccc1Br)Cl 62a_100010138402_200025704644 [1,2,0,0,0,0|1,0,0]=4 12227 B11R1.605 [13CH3]SCc1c(cccc1Br)Cl 62a_200025704644_100010138402 [1,2,0,0,0,0|1,0,0]=4 12228 B11R1.605 [13CH3]SCc1c(cccc1Br)F 62a_100012145669_200025704644 [1,2,0,0,0,0|1,0,0]=4 12229 B11R1.605 [13CH3]SCc1c(cccc1Br)F 62a_200025704644_100012145669 [1,2,0,0,0,0|1,0,0]=4 12230 B11R1.605 [13CH3]SCc1c(cccc1Cl)Cl 62a_100000187851_200025704644 [1,2,0,0,0,0|1,0,0]=4 12231 B11R1.605 [13CH3]SCc1c(cccc1Cl)Cl 62a_200025704644_100000187851 [1,2,0,0,0,0|1,0,0]=4 12232 B11R1.605 [13CH3]SCc1c(cccc1Cl)F 62a_100000187852_200025704644 [1,2,0,0,0,0|1,0,0]=4 12233 B11R1.605 [13CH3]SCc1c(cccc1Cl)F 62a_200025704644_100000187852 [1,2,0,0,0,0|1,0,0]=4 12234 B11R1.605 [13CH3]SCc1c(cccc1F)F 62a_100000709179_200025704644 [1,2,0,0,0,0|1,0,0]=4 12235 B11R1.605 [13CH3]SCc1c(cccc1F)F 62a_200025704644_100000698325 [1,2,0,0,0,0|1,0,0]=4 12236 B11R1.605 [13CH3]SCc1c(cccc1I)Br 62a_100010146611_200025704644 [1,2,0,0,0,0|1,0,0]=4 12237 B11R1.605 [13CH3]SCc1c(cccc1I)Br 62a_200025704644_100010146611 [1,2,0,0,0,0|1,0,0]=4 12238 B11R1.605 [13CH3]SCc1c(cccc1I)F 62a_100010149602_200025704644 [1,2,0,0,0,0|1,0,0]=4 12239 B11R1.605 [13CH3]SCc1c(cccc1I)F 62a_200025704644_100010149602 [1,2,0,0,0,0|1,0,0]=4 12240 B11R1.23 CC(N[13CH3])c1cccc(c1)Br 2230a_100020642005_200025704644 [1,2,0,0,0,0|1,0,0]=4 12241 B11R1.23 CC(N[13CH3])c1cccc(c1)Cl 2230a_100102723534_200025704644 [1,2,0,0,0,0|1,0,0]=4 12242 B11R1.23 CC(N[13CH3])c1cccc(c1)Cl 34a_100102723534_200025704644 [1,2,0,0,0,0|1,0,0]=4 12243 B11R1.23 CC(N[13CH3])c1cccc(c1)O 2230a_100000740644_200025704644 [1,2,0,0,0,0|1,0,0]=4 12244 B11R1.23 CC(O[13CH3])c1cccc(c1)Br 34a_100000246457_200025704644 [1,2,0,0,0,0|1,0,0]=4 12245 B11R1.23 CC(O[13CH3])c1cccc(c1)Br 7a_100000246457_200025704644 [1,2,0,0,0,0|1,0,0]=4 12246 B11R1.23 CC(O[13CH3])c1cccc(c1)F 34a_100000744526_200025704644 [1,2,0,0,0,0|1,0,0]=4 12247 B11R1.23 CC(O[13CH3])c1cccc(c1)F 7a_100000744526_200025704644 [1,2,0,0,0,0|1,0,0]=4 12248 B11R1.23 CC(O[13CH3])c1cccc(c1)I 34a_100013085317_200025704644 [1,2,0,0,0,0|1,0,0]=4 12249 B11R1.23 CC(O[13CH3])c1cccc(c1)I 7a_100013085317_200025704644 [1,2,0,0,0,0|1,0,0]=4 12250 B11R1.23 CC(O[13CH3])c1cccc(c1)N 34a_100011217120_200025704644 [1,2,0,0,0,0|1,0,0]=4 12251 B11R1.23 CC(O[13CH3])c1cccc(c1)N 7a_100011217120_200025704644 [1,2,0,0,0,0|1,0,0]=4 12252 B11R1.23 CCC(O)c1cccc(c1)O 271570a_203496583355_200013212081 [1,2,0,0,0,0|0,0,1]=4 12253 B11R1.23 CC[C@H](N)c1cccc(c1)O 271570a_203496583355_100102422761 [1,2,0,0,0,0|0,0,1]=4 12254 B11R1.23 CNC(C)c1cccc(c1)Br 2230a_100020642005_200000210301 [1,2,0,0,0,0|1,0,0]=4 12255 B11R1.23 CNC(C)c1cccc(c1)Br 269862a_106832991636_100000210093 [1,2,0,0,0,0|1,0,0]=4 12256 B11R1.23 CNC(C)c1cccc(c1)C 269862a_106832991636_100000211476 [1,2,0,0,0,0|1,0,0]=4 12257 B11R1.23 CNC(C)c1cccc(c1)Cl 2230a_100102723534_200000210301 [1,2,0,0,0,0|1,0,0]=4 12258 B11R1.23 CNC(C)c1cccc(c1)Cl 269862a_106832991636_200000210964 [1,2,0,0,0,0|1,0,0]=4 12259 B11R1.23 CNC(C)c1cccc(c1)Cl 34a_100102723534_200000210301 [1,2,0,0,0,0|1,0,0]=4 12260 B11R1.23 CNC(C)c1cccc(c1)F 269862a_106832991636_100000187083 [1,2,0,0,0,0|1,0,0]=4 12261 B11R1.23 CNC(C)c1cccc(c1)I 269862a_106832991636_100011356966 [1,2,0,0,0,0|1,0,0]=4 12262 B11R1.23 CNC(C)c1cccc(c1)O 2230a_100000740644_200000210301 [1,2,0,0,0,0|1,0,0]=4 12263 B11R1.23 CNC(C)c1cccc(c1)O 269862a_106832991636_100000211620 [1,2,0,0,0,0|1,0,0]=4 12264 B11R1.23 CNC(C)c1cccc(c1)O 271570a_203496583355_100025717457 [1,2,0,0,0,0|1,0,0]=4 12265 B11R1.23 CN[C@H](C)c1cccc(c1)C 2230a_100000698126_200000210301 [1,2,0,0,0,0|1,0,0]=4 12266 B11R1.23 CN[C@H](C)c1cccc(c1)C 34a_100000698126_200000210301 [1,2,0,0,0,0|1,0,0]=4 12267 B11R1.23 CN[C@H](C)c1cccc(c1)F 2230a_100015193778_200000210301 [1,2,0,0,0,0|1,0,0]=4 12268 B11R1.23 CN[C@H](C)c1cccc(c1)F 34a_100015193778_200000210301 [1,2,0,0,0,0|1,0,0]=4 12269 B11R1.23 COC(C)c1cccc(c1)Br 34a_100000246457_200000210301 [1,2,0,0,0,0|1,0,0]=4 12270 B11R1.23 COC(C)c1cccc(c1)Br 7a_100000246457_200000210301 [1,2,0,0,0,0|1,0,0]=4 12271 B11R1.23 COC(C)c1cccc(c1)C 34a_100000757818_200000210301 [1,2,0,0,0,0|1,0,0]=4 12272 B11R1.23 COC(C)c1cccc(c1)C 7a_100000757818_200000210301 [1,2,0,0,0,0|1,0,0]=4 12273 B11R1.23 COC(C)c1cccc(c1)F 34a_100000744526_200000210301 [1,2,0,0,0,0|1,0,0]=4 12274 B11R1.23 COC(C)c1cccc(c1)F 7a_100000744526_200000210301 [1,2,0,0,0,0|1,0,0]=4 12275 B11R1.23 COC(C)c1cccc(c1)I 34a_100013085317_200000210301 [1,2,0,0,0,0|1,0,0]=4 12276 B11R1.23 COC(C)c1cccc(c1)I 7a_100013085317_200000210301 [1,2,0,0,0,0|1,0,0]=4 12277 B11R1.23 COC(C)c1cccc(c1)N 34a_100011217120_200000210301 [1,2,0,0,0,0|1,0,0]=4 12278 B11R1.23 COC(C)c1cccc(c1)N 7a_100011217120_200000210301 [1,2,0,0,0,0|1,0,0]=4 12279 B11R1.23 CO[C@H](C)c1cccc(c1)Cl 34a_100000747380_200000210301 [1,2,0,0,0,0|1,0,0]=4 12280 B11R1.23 CO[C@H](C)c1cccc(c1)Cl 7a_100000747380_200000210301 [1,2,0,0,0,0|1,0,0]=4 12281 B11R1.23 C[C@@H](N[13CH3])c1cccc(c1)F 2230a_100015193778_200025704644 [1,2,0,0,0,0|1,0,0]=4 12282 B11R1.23 C[C@@H](N[13CH3])c1cccc(c1)F 34a_100015193778_200025704644 [1,2,0,0,0,0|1,0,0]=4 12283 B11R1.23 C[C@@H](O[13CH3])c1cccc(c1)Cl 34a_100000747380_200025704644 [1,2,0,0,0,0|1,0,0]=4 12284 B11R1.23 C[C@@H](O[13CH3])c1cccc(c1)Cl 7a_100000747380_200025704644 [1,2,0,0,0,0|1,0,0]=4 12285 B11R1.23 Cc1cccc(c1)C(C)O[13CH3] 34a_100000757818_200025704644 [1,2,0,0,0,0|1,0,0]=4 12286 B11R1.23 Cc1cccc(c1)C(C)O[13CH3] 7a_100000757818_200025704644 [1,2,0,0,0,0|1,0,0]=4 12287 B11R1.23 Cc1cccc(c1)[C@@H](C)N[13CH3] 2230a_100000698126_200025704644 [1,2,0,0,0,0|1,0,0]=4 12288 B11R1.23 Cc1cccc(c1)[C@@H](C)N[13CH3] 34a_100000698126_200025704644 [1,2,0,0,0,0|1,0,0]=4 12289 B11R1.24 C=CCNc1cc(ccn1)F 27a_100020586998_100000764206 [1,2,0,0,0,0|1,0,0]=4 12290 B11R1.24 C=CCNc1cc[nH]c(=O)c1 27a_100020586998_100000061649 [1,2,0,0,0,0|1,0,0]=4 12291 B11R1.24 C=CCNc1cccc(c1)Br 34a_100000210019_100015514636 [1,2,0,0,0,0|0,0,0]=3 12292 B11R1.24 C=CCNc1cccc(c1)C 2230a_100000188690_100000210623 [1,2,0,0,0,0|0,0,0]=3 12293 B11R1.24 C=CCNc1cccc(c1)C 34a_100000188690_100015514636 [1,2,0,0,0,0|0,0,0]=3 12294 B11R1.24 C=CCNc1cccc(c1)Cl 34a_100000185859_100015514636 [1,2,0,0,0,0|0,0,0]=3 12295 B11R1.24 C=CCNc1cccc(c1)F 34a_100000210047_100015514636 [1,2,0,0,0,0|0,0,0]=3 12296 B11R1.24 C=CCNc1cccc(c1)I 34a_100000211102_100015514636 [1,2,0,0,0,0|0,0,0]=3 12297 B11R1.24 C=CCNc1cccc(c1)O 34a_100000210217_100015514636 [1,2,0,0,0,0|0,0,0]=3 12298 B11R1.24 C=CCNc1cccc(n1)F 27a_100020586998_100009815982 [1,2,0,0,0,0|1,0,0]=4 12299 B11R1.24 C=CCNc1ccnc(c1)C 27a_100020586998_100000758586 [1,2,0,0,0,0|1,0,0]=4 12300 B11R1.24 C=CCNc1ccnc(c1)F 27a_100020586998_100009816116 [1,2,0,0,0,0|1,0,0]=4 12301 B11R1.24 C=CCOc1cc[nH]c(=O)c1 34a_100000032262_100015514636 [1,2,0,0,0,0|1,0,0]=4 12302 B11R1.24 C=CCOc1ccc[n+](c1)[O-] 34a_100000039713_100015514636 [1,2,0,0,0,0|1,0,0]=4 12303 B11R1.24 C=CCOc1ccc[n+](c1)[O-] 7a_100000039713_100015514636 [1,2,0,0,0,0|1,0,0]=4 12304 B11R1.24 C=CCOc1cccc(=O)[nH]1 34a_100000033347_100015514636 [1,2,0,0,0,0|1,0,0]=4 12305 B11R1.24 C=CCOc1cccc(c1)Br 34a_100000210342_100015514636 [1,2,0,0,0,0|0,0,0]=3 12306 B11R1.24 C=CCOc1cccc(c1)Br 7a_100000210342_100015514636 [1,2,0,0,0,0|0,0,0]=3 12307 B11R1.24 C=CCOc1cccc(c1)C 34a_100000210337_100015514636 [1,2,0,0,0,0|0,0,0]=3 12308 B11R1.24 C=CCOc1cccc(c1)C 7a_100000210337_100015514636 [1,2,0,0,0,0|0,0,0]=3 12309 B11R1.24 C=CCOc1cccc(c1)Cl 34a_100000210295_100015514636 [1,2,0,0,0,0|0,0,0]=3 12310 B11R1.24 C=CCOc1cccc(c1)Cl 7a_100000210295_100015514636 [1,2,0,0,0,0|0,0,0]=3 12311 B11R1.24 C=CCOc1cccc(c1)F 34a_100000210426_100015514636 [1,2,0,0,0,0|0,0,0]=3 12312 B11R1.24 C=CCOc1cccc(c1)F 7a_100000210426_100015514636 [1,2,0,0,0,0|0,0,0]=3 12313 B11R1.24 C=CCOc1cccc(c1)I 34a_100000211634_100015514636 [1,2,0,0,0,0|0,0,0]=3 12314 B11R1.24 C=CCOc1cccc(c1)I 7a_100000211634_100015514636 [1,2,0,0,0,0|0,0,0]=3 12315 B11R1.24 C=CCOc1cccc(c1)N 34a_100000210217_100015514636 [1,2,0,0,0,0|0,0,0]=3 12316 B11R1.24 C=CCOc1cccc(n1)F 34a_100011432558_100015514636 [1,2,0,0,0,0|1,0,0]=4 12317 B11R1.24 C=CCOc1ccnc(c1)C 34a_100000688365_100015514636 [1,2,0,0,0,0|1,0,0]=4 12318 B11R1.24 C=CCOc1ccnc(c1)Cl 34a_100000762945_100015514636 [1,2,0,0,0,0|1,0,0]=4 12319 B11R1.24 C=CCOc1ccnc(c1)F 34a_100000732698_100015514636 [1,2,0,0,0,0|1,0,0]=4 12320 B11R1.24 C=CCOc1ccnc(c1)N 34a_100011834064_100015514636 [1,2,0,0,0,0|1,0,0]=4 12321 B11R1.24 C=CCOc1cncc(c1)Br 34a_100000754920_100015514636 [1,2,0,0,0,0|1,0,0]=4 12322 B11R1.24 C=CCOc1cncc(c1)Br 7a_100000754920_100015514636 [1,2,0,0,0,0|1,0,0]=4 12323 B11R1.24 C=CCOc1cncc(c1)C 34a_100011830280_100015514636 [1,2,0,0,0,0|1,0,0]=4 12324 B11R1.24 C=CCOc1cncc(c1)C 7a_100011830280_100015514636 [1,2,0,0,0,0|1,0,0]=4 12325 B11R1.24 C=CCOc1cncc(c1)Cl 7a_100000032511_100015514636 [1,2,0,0,0,0|1,0,0]=4 12326 B11R1.24 C=CCOc1cncc(c1)F 34a_100011830296_100015514636 [1,2,0,0,0,0|1,0,0]=4 12327 B11R1.24 C=CCOc1cncc(c1)F 7a_100011830296_100015514636 [1,2,0,0,0,0|1,0,0]=4 12328 B11R1.24 C=CCOc1cncc(c1)N 34a_100011997051_100015514636 [1,2,0,0,0,0|1,0,0]=4 12329 B11R1.24 C=CCSc1cc(=O)cc[nH]1 62a_100009817434_100000210623 [1,2,0,0,0,0|1,0,0]=4 12330 B11R1.24 C=CCSc1cc(ccn1)C 62a_100000210623_100000750283 [1,2,0,0,0,0|1,0,0]=4 12331 B11R1.24 C=CCSc1cc(ccn1)C 62a_100000750283_100000210623 [1,2,0,0,0,0|1,0,0]=4 12332 B11R1.24 C=CCSc1cc(ccn1)Cl 62a_100000210623_100010167805 [1,2,0,0,0,0|1,0,0]=4 12333 B11R1.24 C=CCSc1cc(ccn1)Cl 62a_100010167805_100000210623 [1,2,0,0,0,0|1,0,0]=4 12334 B11R1.24 C=CCSc1cc(ccn1)F 62a_100000210623_100000764206 [1,2,0,0,0,0|1,0,0]=4 12335 B11R1.24 C=CCSc1cc(ccn1)F 62a_100000764206_100000210623 [1,2,0,0,0,0|1,0,0]=4 12336 B11R1.24 C=CCSc1cc(ccn1)N 62a_100000210623_100009814236 [1,2,0,0,0,0|1,0,0]=4 12337 B11R1.24 C=CCSc1cc(ccn1)N 62a_100009814236_100000210623 [1,2,0,0,0,0|1,0,0]=4 12338 B11R1.24 C=CCSc1cc(ccn1)O 62a_100000210623_100000762945 [1,2,0,0,0,0|1,0,0]=4 12339 B11R1.24 C=CCSc1cc[nH]c(=O)c1 62a_100000210623_100009816521 [1,2,0,0,0,0|1,0,0]=4 12340 B11R1.24 C=CCSc1cc[nH]c(=O)c1 62a_100009816521_100000210623 [1,2,0,0,0,0|1,0,0]=4 12341 B11R1.24 C=CCSc1ccc[n+](c1)C 62a_100000210623_100009996589 [1,2,0,0,0,0|1,0,0]=4 12342 B11R1.24 C=CCSc1ccc[n+](c1)C 62a_100009996589_100000210623 [1,2,0,0,0,0|1,0,0]=4 12343 B11R1.24 C=CCSc1ccc[n+](c1)[O-] 62a_100000210623_100009815978 [1,2,0,0,0,0|1,0,0]=4 12344 B11R1.24 C=CCSc1cccc(=O)[nH]1 62a_100000210623_100000752884 [1,2,0,0,0,0|1,0,0]=4 12345 B11R1.24 C=CCSc1cccc(c1)Br 62a_100000210623_100000691529 [1,2,0,0,0,0|0,0,0]=3 12346 B11R1.24 C=CCSc1cccc(c1)Br 62a_100000691529_100000210623 [1,2,0,0,0,0|0,0,0]=3 12347 B11R1.24 C=CCSc1cccc(c1)C 62a_100000210623_100011215228 [1,2,0,0,0,0|0,0,0]=3 12348 B11R1.24 C=CCSc1cccc(c1)C 62a_100011215228_100000210623 [1,2,0,0,0,0|0,0,0]=3 12349 B11R1.24 C=CCSc1cccc(c1)Cl 62a_100000210623_100000699651 [1,2,0,0,0,0|0,0,0]=3 12350 B11R1.24 C=CCSc1cccc(c1)Cl 62a_100000699651_100000210623 [1,2,0,0,0,0|0,0,0]=3 12351 B11R1.24 C=CCSc1cccc(c1)F 62a_100000210623_100000685547 [1,2,0,0,0,0|0,0,0]=3 12352 B11R1.24 C=CCSc1cccc(c1)F 62a_100000685547_100000210623 [1,2,0,0,0,0|0,0,0]=3 12353 B11R1.24 C=CCSc1cccc(c1)N 62a_100000210019_100000210623 [1,2,0,0,0,0|0,0,0]=3 12354 B11R1.24 C=CCSc1cccc(c1)N 62a_100000210623_100000210019 [1,2,0,0,0,0|0,0,0]=3 12355 B11R1.24 C=CCSc1cccc(c1)O 62a_100000210623_100000211634 [1,2,0,0,0,0|0,0,0]=3 12356 B11R1.24 C=CCSc1cccc(c1)[S] 62a_100000210623_114929384022 [1,2,0,0,0,0|0,0,0]=3 12357 B11R1.24 C=CCSc1cccc(c1)[S] 62a_114929384022_100000210623 [1,2,0,0,0,0|0,0,0]=3 12358 B11R1.24 C=CCSc1cccc(n1)Br 62a_100000210623_100000684672 [1,2,0,0,0,0|1,0,0]=4 12359 B11R1.24 C=CCSc1cccc(n1)Br 62a_100000684672_100000210623 [1,2,0,0,0,0|1,0,0]=4 12360 B11R1.24 C=CCSc1cccc(n1)C 62a_100000210623_100000742759 [1,2,0,0,0,0|1,0,0]=4 12361 B11R1.24 C=CCSc1cccc(n1)C 62a_100000742759_100000210623 [1,2,0,0,0,0|1,0,0]=4 12362 B11R1.24 C=CCSc1cccc(n1)Cl 62a_100000051397_100000210623 [1,2,0,0,0,0|1,0,0]=4 12363 B11R1.24 C=CCSc1cccc(n1)Cl 62a_100000210623_100000051397 [1,2,0,0,0,0|1,0,0]=4 12364 B11R1.24 C=CCSc1cccc(n1)F 62a_100000210623_100009815982 [1,2,0,0,0,0|1,0,0]=4 12365 B11R1.24 C=CCSc1cccc(n1)F 62a_100009815982_100000210623 [1,2,0,0,0,0|1,0,0]=4 12366 B11R1.24 C=CCSc1cccc(n1)N 62a_100000210623_100000740741 [1,2,0,0,0,0|1,0,0]=4 12367 B11R1.24 C=CCSc1cccc(n1)N 62a_100000740741_100000210623 [1,2,0,0,0,0|1,0,0]=4 12368 B11R1.24 C=CCSc1ccnc(c1)Br 62a_100000210623_100009814637 [1,2,0,0,0,0|1,0,0]=4 12369 B11R1.24 C=CCSc1ccnc(c1)Br 62a_100009814637_100000210623 [1,2,0,0,0,0|1,0,0]=4 12370 B11R1.24 C=CCSc1ccnc(c1)C 62a_100000210623_100000758586 [1,2,0,0,0,0|1,0,0]=4 12371 B11R1.24 C=CCSc1ccnc(c1)C 62a_100000758586_100000210623 [1,2,0,0,0,0|1,0,0]=4 12372 B11R1.24 C=CCSc1ccnc(c1)Cl 62a_100000035001_100000210623 [1,2,0,0,0,0|1,0,0]=4 12373 B11R1.24 C=CCSc1ccnc(c1)Cl 62a_100000210623_100000035001 [1,2,0,0,0,0|1,0,0]=4 12374 B11R1.24 C=CCSc1ccnc(c1)F 62a_100000210623_100009816116 [1,2,0,0,0,0|1,0,0]=4 12375 B11R1.24 C=CCSc1ccnc(c1)F 62a_100009816116_100000210623 [1,2,0,0,0,0|1,0,0]=4 12376 B11R1.24 C=CCSc1ccnc(c1)N 62a_100000049665_100000210623 [1,2,0,0,0,0|1,0,0]=4 12377 B11R1.24 C=CCSc1ccnc(c1)N 62a_100000210623_100000049665 [1,2,0,0,0,0|1,0,0]=4 12378 B11R1.24 C=CCSc1cncc(c1)Br 62a_100000210623_100000728054 [1,2,0,0,0,0|1,0,0]=4 12379 B11R1.24 C=CCSc1cncc(c1)Br 62a_100000728054_100000210623 [1,2,0,0,0,0|1,0,0]=4 12380 B11R1.24 C=CCSc1cncc(c1)C 62a_100000210623_100000760492 [1,2,0,0,0,0|1,0,0]=4 12381 B11R1.24 C=CCSc1cncc(c1)C 62a_100000760492_100000210623 [1,2,0,0,0,0|1,0,0]=4 12382 B11R1.24 C=CCSc1cncc(c1)Cl 62a_100000049639_100000210623 [1,2,0,0,0,0|1,0,0]=4 12383 B11R1.24 C=CCSc1cncc(c1)Cl 62a_100000210623_100000049639 [1,2,0,0,0,0|1,0,0]=4 12384 B11R1.24 C=CCSc1cncc(c1)F 62a_100000210623_100000744099 [1,2,0,0,0,0|1,0,0]=4 12385 B11R1.24 C=CCSc1cncc(c1)F 62a_100000744099_100000210623 [1,2,0,0,0,0|1,0,0]=4 12386 B11R1.24 C=CCSc1cncc(c1)N 62a_100000210623_100000687067 [1,2,0,0,0,0|1,0,0]=4 12387 B11R1.24 C=CCSc1cncc(c1)N 62a_100000687067_100000210623 [1,2,0,0,0,0|1,0,0]=4 12388 B11R1.24 C=CCSc1cncc(c1)O 62a_100000210623_100000754920 [1,2,0,0,0,0|1,0,0]=4 12389 B11R1.24 C=CCSc1cncc(c1)O 62a_100000754920_100000210623 [1,2,0,0,0,0|1,0,0]=4 12390 B11R1.24 CC=NNc1cccc(c1)Br 4a_100000217339_200000210099 [1,2,0,0,0,0|1,0,0]=4 12391 B11R1.24 CC=NNc1cccc(c1)C 4a_100000681630_200000210099 [1,2,0,0,0,0|1,0,0]=4 12392 B11R1.24 CC=NNc1cccc(c1)Cl 4a_100000184277_200000210099 [1,2,0,0,0,0|1,0,0]=4 12393 B11R1.24 CC=NNc1cccc(c1)F 4a_100000745080_200000210099 [1,2,0,0,0,0|1,0,0]=4 12394 B11R1.24 CC=NNc1cccc(c1)I 4a_100020605690_200000210099 [1,2,0,0,0,0|1,0,0]=4 12395 B11R1.24 CCCCc1cccc(c1)Br 271570a_100020621405_100000691529 [1,2,0,0,0,0|0,0,1]=4 12396 B11R1.24 CCCCc1cccc(c1)C 271570a_100020621405_100011215228 [1,2,0,0,0,0|0,0,1]=4 12397 B11R1.24 CCCCc1cccc(c1)Cl 271570a_100020621405_100000699651 [1,2,0,0,0,0|0,0,1]=4 12398 B11R1.24 CCCCc1cccc(c1)F 271570a_100020621405_100000685547 [1,2,0,0,0,0|0,0,1]=4 12399 B11R1.24 CCCCc1cccc(c1)N 271570a_100020621405_100000210019 [1,2,0,0,0,0|0,0,1]=4 12400 B11R1.24 CCCCc1cccc(c1)O 271570a_100020621405_100000211634 [1,2,0,0,0,0|0,0,1]=4 12401 B11R1.24 CCCCc1cccc(c1)O 271570a_203496583355_200010244551 [1,2,0,0,0,0|0,0,1]=4 12402 B11R1.24 CCCCc1cccc(c1)[S] 271570a_100020621405_114929384022 [1,2,0,0,0,0|0,0,1]=4 12403 B11R1.24 CCCNc1cccc(c1)Br 34a_100000210019_100000210303 [1,2,0,0,0,0|0,0,1]=4 12404 B11R1.24 CCCNc1cccc(c1)C 2230a_100000188690_100000210303 [1,2,0,0,0,0|0,0,1]=4 12405 B11R1.24 CCCNc1cccc(c1)C 34a_100000188690_100000210303 [1,2,0,0,0,0|0,0,1]=4 12406 B11R1.24 CCCNc1cccc(c1)Cl 34a_100000185859_100000210303 [1,2,0,0,0,0|0,0,1]=4 12407 B11R1.24 CCCNc1cccc(c1)F 34a_100000210047_100000210303 [1,2,0,0,0,0|0,0,1]=4 12408 B11R1.24 CCCNc1cccc(c1)I 34a_100000211102_100000210303 [1,2,0,0,0,0|0,0,1]=4 12409 B11R1.24 CCCNc1cccc(c1)O 34a_100000210217_100000210303 [1,2,0,0,0,0|0,0,1]=4 12410 B11R1.24 CCCOc1cccc(c1)Br 34a_100000210342_100000210303 [1,2,0,0,0,0|0,0,1]=4 12411 B11R1.24 CCCOc1cccc(c1)Br 7a_100000210342_100000210303 [1,2,0,0,0,0|0,0,1]=4 12412 B11R1.24 CCCOc1cccc(c1)C 34a_100000210337_100000210303 [1,2,0,0,0,0|0,0,1]=4 12413 B11R1.24 CCCOc1cccc(c1)C 7a_100000210337_100000210303 [1,2,0,0,0,0|0,0,1]=4 12414 B11R1.24 CCCOc1cccc(c1)Cl 34a_100000210295_100000210303 [1,2,0,0,0,0|0,0,1]=4 12415 B11R1.24 CCCOc1cccc(c1)Cl 7a_100000210295_100000210303 [1,2,0,0,0,0|0,0,1]=4 12416 B11R1.24 CCCOc1cccc(c1)F 34a_100000210426_100000210303 [1,2,0,0,0,0|0,0,1]=4 12417 B11R1.24 CCCOc1cccc(c1)F 7a_100000210426_100000210303 [1,2,0,0,0,0|0,0,1]=4 12418 B11R1.24 CCCOc1cccc(c1)I 34a_100000211634_100000210303 [1,2,0,0,0,0|0,0,1]=4 12419 B11R1.24 CCCOc1cccc(c1)I 7a_100000211634_100000210303 [1,2,0,0,0,0|0,0,1]=4 12420 B11R1.24 CCCOc1cccc(c1)N 34a_100000210217_100000210303 [1,2,0,0,0,0|0,0,1]=4 12421 B11R1.24 CCCOc1cccc(c1)O 271570a_203496583355_100000170004 [1,2,0,0,0,0|0,0,1]=4 12422 B11R1.24 CCCSc1cccc(c1)Br 62a_100000210303_100000691529 [1,2,0,0,0,0|0,0,1]=4 12423 B11R1.24 CCCSc1cccc(c1)Br 62a_100000691529_100000210303 [1,2,0,0,0,0|0,0,1]=4 12424 B11R1.24 CCCSc1cccc(c1)C 62a_100000210303_100011215228 [1,2,0,0,0,0|0,0,1]=4 12425 B11R1.24 CCCSc1cccc(c1)C 62a_100011215228_100000210303 [1,2,0,0,0,0|0,0,1]=4 12426 B11R1.24 CCCSc1cccc(c1)Cl 62a_100000210303_100000699651 [1,2,0,0,0,0|0,0,1]=4 12427 B11R1.24 CCCSc1cccc(c1)Cl 62a_100000699651_100000210303 [1,2,0,0,0,0|0,0,1]=4 12428 B11R1.24 CCCSc1cccc(c1)F 62a_100000210303_100000685547 [1,2,0,0,0,0|0,0,1]=4 12429 B11R1.24 CCCSc1cccc(c1)F 62a_100000685547_100000210303 [1,2,0,0,0,0|0,0,1]=4 12430 B11R1.24 CCCSc1cccc(c1)N 62a_100000210019_100000210303 [1,2,0,0,0,0|0,0,1]=4 12431 B11R1.24 CCCSc1cccc(c1)N 62a_100000210303_100000210019 [1,2,0,0,0,0|0,0,1]=4 12432 B11R1.24 CCCSc1cccc(c1)O 271570a_203496583355_200009815762 [1,2,0,0,0,0|0,0,1]=4 12433 B11R1.24 CCCSc1cccc(c1)O 62a_100000210303_100000211634 [1,2,0,0,0,0|0,0,1]=4 12434 B11R1.24 CCCSc1cccc(c1)[S] 62a_100000210303_114929384022 [1,2,0,0,0,0|0,0,1]=4 12435 B11R1.24 CCCSc1cccc(c1)[S] 62a_114929384022_100000210303 [1,2,0,0,0,0|0,0,1]=4 12436 B11R1.24 CCNCc1cccc(c1)Br 207a_100015525214_100000210085 [1,2,0,0,0,0|0,0,1]=4 12437 B11R1.24 CCNCc1cccc(c1)Br 2230a_100000174977_100000210202 [1,2,0,0,0,0|0,0,1]=4 12438 B11R1.24 CCNCc1cccc(c1)Br 2230a_100015525214_100000698116 [1,2,0,0,0,0|0,0,1]=4 12439 B11R1.24 CCNCc1cccc(c1)Br 270004a_100015525214_100000210085 [1,2,0,0,0,0|0,0,1]=4 12440 B11R1.24 CCNCc1cccc(c1)Br 34a_100000174977_100000210202 [1,2,0,0,0,0|0,0,1]=4 12441 B11R1.24 CCNCc1cccc(c1)C 207a_100015525214_100000211157 [1,2,0,0,0,0|0,0,1]=4 12442 B11R1.24 CCNCc1cccc(c1)C 2230a_100000185548_100000210202 [1,2,0,0,0,0|0,0,1]=4 12443 B11R1.24 CCNCc1cccc(c1)C 2230a_100015525214_100000211840 [1,2,0,0,0,0|0,0,1]=4 12444 B11R1.24 CCNCc1cccc(c1)C 270004a_100015525214_100000211157 [1,2,0,0,0,0|0,0,1]=4 12445 B11R1.24 CCNCc1cccc(c1)C 34a_100000185548_100000210202 [1,2,0,0,0,0|0,0,1]=4 12446 B11R1.24 CCNCc1cccc(c1)Cl 207a_100015525214_100000210801 [1,2,0,0,0,0|0,0,1]=4 12447 B11R1.24 CCNCc1cccc(c1)Cl 2230a_100000174878_100000210202 [1,2,0,0,0,0|0,0,1]=4 12448 B11R1.24 CCNCc1cccc(c1)Cl 2230a_100015525214_100000181238 [1,2,0,0,0,0|0,0,1]=4 12449 B11R1.24 CCNCc1cccc(c1)Cl 270004a_100015525214_100000210801 [1,2,0,0,0,0|0,0,1]=4 12450 B11R1.24 CCNCc1cccc(c1)Cl 34a_100000174878_100000210202 [1,2,0,0,0,0|0,0,1]=4 12451 B11R1.24 CCNCc1cccc(c1)F 207a_100015525214_100000210812 [1,2,0,0,0,0|0,0,1]=4 12452 B11R1.24 CCNCc1cccc(c1)F 2230a_100000174948_100000210202 [1,2,0,0,0,0|0,0,1]=4 12453 B11R1.24 CCNCc1cccc(c1)F 2230a_100015525214_100000230114 [1,2,0,0,0,0|0,0,1]=4 12454 B11R1.24 CCNCc1cccc(c1)F 270004a_100015525214_100000210812 [1,2,0,0,0,0|0,0,1]=4 12455 B11R1.24 CCNCc1cccc(c1)F 34a_100000174948_100000210202 [1,2,0,0,0,0|0,0,1]=4 12456 B11R1.24 CCNCc1cccc(c1)I 207a_100015525214_100000014684 [1,2,0,0,0,0|0,0,1]=4 12457 B11R1.24 CCNCc1cccc(c1)I 2230a_100000106179_100000210202 [1,2,0,0,0,0|0,0,1]=4 12458 B11R1.24 CCNCc1cccc(c1)I 2230a_100015525214_100011218688 [1,2,0,0,0,0|0,0,1]=4 12459 B11R1.24 CCNCc1cccc(c1)I 270004a_100015525214_100000014684 [1,2,0,0,0,0|0,0,1]=4 12460 B11R1.24 CCNCc1cccc(c1)I 34a_100000106179_100000210202 [1,2,0,0,0,0|0,0,1]=4 12461 B11R1.24 CCNCc1cccc(c1)O 207a_100015525214_100000188321 [1,2,0,0,0,0|0,0,1]=4 12462 B11R1.24 CCNCc1cccc(c1)O 2230a_100000743036_100000210202 [1,2,0,0,0,0|0,0,1]=4 12463 B11R1.24 CCNCc1cccc(c1)O 2230a_100015525214_100011660834 [1,2,0,0,0,0|0,0,1]=4 12464 B11R1.24 CCNCc1cccc(c1)O 270004a_100015525214_100000188321 [1,2,0,0,0,0|0,0,1]=4 12465 B11R1.24 CCNCc1cccc(c1)O 271570a_203496583355_100000187426 [1,2,0,0,0,0|0,0,1]=4 12466 B11R1.24 CCNCc1cccc(c1)O 34a_100000743036_100000210202 [1,2,0,0,0,0|0,0,1]=4 12467 B11R1.24 CCOCc1cccc(c1)Br 34a_100000687537_100000210202 [1,2,0,0,0,0|0,0,1]=4 12468 B11R1.24 CCOCc1cccc(c1)Br 34a_100121572206_100000698116 [1,2,0,0,0,0|0,0,1]=4 12469 B11R1.24 CCOCc1cccc(c1)Br 7a_100000687537_100000210202 [1,2,0,0,0,0|0,0,1]=4 12470 B11R1.24 CCOCc1cccc(c1)C 34a_100011217746_100000210202 [1,2,0,0,0,0|0,0,1]=4 12471 B11R1.24 CCOCc1cccc(c1)C 34a_100121572206_100000211840 [1,2,0,0,0,0|0,0,1]=4 12472 B11R1.24 CCOCc1cccc(c1)C 7a_100011217746_100000210202 [1,2,0,0,0,0|0,0,1]=4 12473 B11R1.24 CCOCc1cccc(c1)Cl 34a_100000241301_100000210202 [1,2,0,0,0,0|0,0,1]=4 12474 B11R1.24 CCOCc1cccc(c1)Cl 34a_100121572206_100000187163 [1,2,0,0,0,0|0,0,1]=4 12475 B11R1.24 CCOCc1cccc(c1)Cl 7a_100000241301_100000210202 [1,2,0,0,0,0|0,0,1]=4 12476 B11R1.24 CCOCc1cccc(c1)F 34a_100000210976_100000210202 [1,2,0,0,0,0|0,0,1]=4 12477 B11R1.24 CCOCc1cccc(c1)F 34a_100121572206_100000187166 [1,2,0,0,0,0|0,0,1]=4 12478 B11R1.24 CCOCc1cccc(c1)F 7a_100000210976_100000210202 [1,2,0,0,0,0|0,0,1]=4 12479 B11R1.24 CCOCc1cccc(c1)I 34a_100011215336_100000210202 [1,2,0,0,0,0|0,0,1]=4 12480 B11R1.24 CCOCc1cccc(c1)I 34a_100121572206_100011218688 [1,2,0,0,0,0|0,0,1]=4 12481 B11R1.24 CCOCc1cccc(c1)I 7a_100011215336_100000210202 [1,2,0,0,0,0|0,0,1]=4 12482 B11R1.24 CCOCc1cccc(c1)N 34a_100000211919_100000210202 [1,2,0,0,0,0|0,0,1]=4 12483 B11R1.24 CCOCc1cccc(c1)O 271570a_203496583355_100011493694 [1,2,0,0,0,0|0,0,1]=4 12484 B11R1.24 CCOCc1cccc(c1)O 34a_100121572206_100011660834 [1,2,0,0,0,0|0,0,1]=4 12485 B11R1.24 CCSCc1cccc(c1)Br 62a_100000210202_100000211773 [1,2,0,0,0,0|0,0,1]=4 12486 B11R1.24 CCSCc1cccc(c1)Br 62a_100000211773_100000210202 [1,2,0,0,0,0|0,0,1]=4 12487 B11R1.24 CCSCc1cccc(c1)C 62a_100000210202_100000211840 [1,2,0,0,0,0|0,0,1]=4 12488 B11R1.24 CCSCc1cccc(c1)C 62a_100000211840_100000210202 [1,2,0,0,0,0|0,0,1]=4 12489 B11R1.24 CCSCc1cccc(c1)Cl 62a_100000187163_100000210202 [1,2,0,0,0,0|0,0,1]=4 12490 B11R1.24 CCSCc1cccc(c1)Cl 62a_100000210202_100000187163 [1,2,0,0,0,0|0,0,1]=4 12491 B11R1.24 CCSCc1cccc(c1)F 62a_100000210202_100000230114 [1,2,0,0,0,0|0,0,1]=4 12492 B11R1.24 CCSCc1cccc(c1)F 62a_100000230114_100000210202 [1,2,0,0,0,0|0,0,1]=4 12493 B11R1.24 CCSCc1cccc(c1)I 62a_100000210202_100011218688 [1,2,0,0,0,0|0,0,1]=4 12494 B11R1.24 CCSCc1cccc(c1)I 62a_100011218688_100000210202 [1,2,0,0,0,0|0,0,1]=4 12495 B11R1.24 CCSCc1cccc(c1)O 62a_100000210202_100011660834 [1,2,0,0,0,0|0,0,1]=4 12496 B11R1.24 CCSCc1cccc(c1)O 62a_100011660834_100000210202 [1,2,0,0,0,0|0,0,1]=4 12497 B11R1.24 CNCCc1cccc(c1)Br 2230a_100011207229_200000210301 [1,2,0,0,0,0|0,0,1]=4 12498 B11R1.24 CNCCc1cccc(c1)Br 2230a_106832991635_100011740638 [1,2,0,0,0,0|0,0,1]=4 12499 B11R1.24 CNCCc1cccc(c1)Br 34a_100011207229_200000210301 [1,2,0,0,0,0|0,0,1]=4 12500 B11R1.24 CNCCc1cccc(c1)Br 34a_100102657272_100011740638 [1,2,0,0,0,0|0,0,1]=4 12501 B11R1.24 CNCCc1cccc(c1)Br 7a_106832991635_100011740638 [1,2,0,0,0,0|0,0,1]=4 12502 B11R1.24 CNCCc1cccc(c1)C 2230a_100000749837_200000210301 [1,2,0,0,0,0|0,0,1]=4 12503 B11R1.24 CNCCc1cccc(c1)C 2230a_106832991635_100011713685 [1,2,0,0,0,0|0,0,1]=4 12504 B11R1.24 CNCCc1cccc(c1)C 34a_100000749837_200000210301 [1,2,0,0,0,0|0,0,1]=4 12505 B11R1.24 CNCCc1cccc(c1)C 34a_100102657272_100011713685 [1,2,0,0,0,0|0,0,1]=4 12506 B11R1.24 CNCCc1cccc(c1)C 7a_106832991635_100011713685 [1,2,0,0,0,0|0,0,1]=4 12507 B11R1.24 CNCCc1cccc(c1)Cl 2230a_100000185263_200000210301 [1,2,0,0,0,0|0,0,1]=4 12508 B11R1.24 CNCCc1cccc(c1)Cl 2230a_106832991635_100011713710 [1,2,0,0,0,0|0,0,1]=4 12509 B11R1.24 CNCCc1cccc(c1)Cl 34a_100000185263_200000210301 [1,2,0,0,0,0|0,0,1]=4 12510 B11R1.24 CNCCc1cccc(c1)Cl 34a_100102657272_100011713710 [1,2,0,0,0,0|0,0,1]=4 12511 B11R1.24 CNCCc1cccc(c1)Cl 7a_106832991635_100011713710 [1,2,0,0,0,0|0,0,1]=4 12512 B11R1.24 CNCCc1cccc(c1)F 2230a_100000205154_200000210301 [1,2,0,0,0,0|0,0,1]=4 12513 B11R1.24 CNCCc1cccc(c1)F 2230a_106832991635_100011217235 [1,2,0,0,0,0|0,0,1]=4 12514 B11R1.24 CNCCc1cccc(c1)F 34a_100000205154_200000210301 [1,2,0,0,0,0|0,0,1]=4 12515 B11R1.24 CNCCc1cccc(c1)F 34a_100102657272_100011217235 [1,2,0,0,0,0|0,0,1]=4 12516 B11R1.24 CNCCc1cccc(c1)F 7a_106832991635_100011217235 [1,2,0,0,0,0|0,0,1]=4 12517 B11R1.24 CNCCc1cccc(c1)O 2230a_100000747277_200000210301 [1,2,0,0,0,0|0,0,1]=4 12518 B11R1.24 CNCCc1cccc(c1)O 34a_100000747277_200000210301 [1,2,0,0,0,0|0,0,1]=4 12519 B11R1.24 COCCc1cccc(c1)Br 34a_100011217444_200000210301 [1,2,0,0,0,0|0,0,1]=4 12520 B11R1.24 COCCc1cccc(c1)Br 34a_100138415774_100011740638 [1,2,0,0,0,0|0,0,1]=4 12521 B11R1.24 COCCc1cccc(c1)Br 7a_100011217444_200000210301 [1,2,0,0,0,0|0,0,1]=4 12522 B11R1.24 COCCc1cccc(c1)C 34a_100011217157_200000210301 [1,2,0,0,0,0|0,0,1]=4 12523 B11R1.24 COCCc1cccc(c1)C 34a_100138415774_100011713685 [1,2,0,0,0,0|0,0,1]=4 12524 B11R1.24 COCCc1cccc(c1)C 7a_100011217157_200000210301 [1,2,0,0,0,0|0,0,1]=4 12525 B11R1.24 COCCc1cccc(c1)Cl 34a_100000754733_200000210301 [1,2,0,0,0,0|0,0,1]=4 12526 B11R1.24 COCCc1cccc(c1)Cl 34a_100138415774_100011713710 [1,2,0,0,0,0|0,0,1]=4 12527 B11R1.24 COCCc1cccc(c1)Cl 7a_100000754733_200000210301 [1,2,0,0,0,0|0,0,1]=4 12528 B11R1.24 COCCc1cccc(c1)F 34a_100000763591_200000210301 [1,2,0,0,0,0|0,0,1]=4 12529 B11R1.24 COCCc1cccc(c1)F 34a_100138415774_100011217235 [1,2,0,0,0,0|0,0,1]=4 12530 B11R1.24 COCCc1cccc(c1)F 7a_100000763591_200000210301 [1,2,0,0,0,0|0,0,1]=4 12531 B11R1.24 COCCc1cccc(c1)N 34a_100011996697_200000210301 [1,2,0,0,0,0|0,0,1]=4 12532 B11R1.24 COCNc1cccc(c1)C 2230a_100000188690_100000766300 [1,2,0,0,0,0|1,0,0]=4 12533 B11R1.24 COCOc1cccc(c1)O 271570a_203496583355_100012265688 [1,2,0,0,0,0|1,0,0]=4 12534 B11R1.24 COCSc1cccc(c1)Br 62a_100000691529_100000766300 [1,2,0,0,0,0|1,0,0]=4 12535 B11R1.24 COCSc1cccc(c1)Br 62a_100000766300_100000691529 [1,2,0,0,0,0|1,0,0]=4 12536 B11R1.24 COCSc1cccc(c1)C 62a_100000766300_100011215228 [1,2,0,0,0,0|1,0,0]=4 12537 B11R1.24 COCSc1cccc(c1)C 62a_100011215228_100000766300 [1,2,0,0,0,0|1,0,0]=4 12538 B11R1.24 COCSc1cccc(c1)Cl 62a_100000699651_100000766300 [1,2,0,0,0,0|1,0,0]=4 12539 B11R1.24 COCSc1cccc(c1)Cl 62a_100000766300_100000699651 [1,2,0,0,0,0|1,0,0]=4 12540 B11R1.24 COCSc1cccc(c1)F 62a_100000685547_100000766300 [1,2,0,0,0,0|1,0,0]=4 12541 B11R1.24 COCSc1cccc(c1)F 62a_100000766300_100000685547 [1,2,0,0,0,0|1,0,0]=4 12542 B11R1.24 COCSc1cccc(c1)N 62a_100000210019_100000766300 [1,2,0,0,0,0|1,0,0]=4 12543 B11R1.24 COCSc1cccc(c1)N 62a_100000766300_100000210019 [1,2,0,0,0,0|1,0,0]=4 12544 B11R1.24 COCSc1cccc(c1)O 62a_100000766300_100000211634 [1,2,0,0,0,0|1,0,0]=4 12545 B11R1.24 COCSc1cccc(c1)[S] 62a_100000766300_114929384022 [1,2,0,0,0,0|1,0,0]=4 12546 B11R1.24 COCSc1cccc(c1)[S] 62a_114929384022_100000766300 [1,2,0,0,0,0|1,0,0]=4 12547 B11R1.24 CSCCc1cccc(c1)Br 62a_100011740638_200000210301 [1,2,0,0,0,0|0,0,1]=4 12548 B11R1.24 CSCCc1cccc(c1)Br 62a_200000210301_100011740638 [1,2,0,0,0,0|0,0,1]=4 12549 B11R1.24 CSCCc1cccc(c1)C 62a_100011713685_200000210301 [1,2,0,0,0,0|0,0,1]=4 12550 B11R1.24 CSCCc1cccc(c1)C 62a_200000210301_100011713685 [1,2,0,0,0,0|0,0,1]=4 12551 B11R1.24 CSCCc1cccc(c1)Cl 62a_100011713710_200000210301 [1,2,0,0,0,0|0,0,1]=4 12552 B11R1.24 CSCCc1cccc(c1)Cl 62a_200000210301_100011713710 [1,2,0,0,0,0|0,0,1]=4 12553 B11R1.24 CSCCc1cccc(c1)F 62a_100011217235_200000210301 [1,2,0,0,0,0|0,0,1]=4 12554 B11R1.24 CSCCc1cccc(c1)F 62a_200000210301_100011217235 [1,2,0,0,0,0|0,0,1]=4 12555 B11R1.24 CSCNc1cccc(c1)Br 34a_100000210019_100011218213 [1,2,0,0,0,0|1,0,0]=4 12556 B11R1.24 CSCNc1cccc(c1)C 2230a_100000188690_100011218213 [1,2,0,0,0,0|1,0,0]=4 12557 B11R1.24 CSCNc1cccc(c1)C 34a_100000188690_100011218213 [1,2,0,0,0,0|1,0,0]=4 12558 B11R1.24 CSCNc1cccc(c1)Cl 34a_100000185859_100011218213 [1,2,0,0,0,0|1,0,0]=4 12559 B11R1.24 CSCNc1cccc(c1)F 34a_100000210047_100011218213 [1,2,0,0,0,0|1,0,0]=4 12560 B11R1.24 CSCNc1cccc(c1)I 34a_100000211102_100011218213 [1,2,0,0,0,0|1,0,0]=4 12561 B11R1.24 CSCNc1cccc(c1)O 34a_100000210217_100011218213 [1,2,0,0,0,0|1,0,0]=4 12562 B11R1.24 CSCOc1cccc(c1)Br 34a_100000210342_100011218213 [1,2,0,0,0,0|1,0,0]=4 12563 B11R1.24 CSCOc1cccc(c1)C 34a_100000210337_100011218213 [1,2,0,0,0,0|1,0,0]=4 12564 B11R1.24 CSCOc1cccc(c1)Cl 34a_100000210295_100011218213 [1,2,0,0,0,0|1,0,0]=4 12565 B11R1.24 CSCOc1cccc(c1)F 34a_100000210426_100011218213 [1,2,0,0,0,0|1,0,0]=4 12566 B11R1.24 CSCOc1cccc(c1)I 34a_100000211634_100011218213 [1,2,0,0,0,0|1,0,0]=4 12567 B11R1.24 CSCOc1cccc(c1)N 34a_100000210217_100011218213 [1,2,0,0,0,0|1,0,0]=4 12568 B11R1.24 CSCSc1cccc(c1)Br 62a_100000691529_100011218213 [1,2,0,0,0,0|1,0,0]=4 12569 B11R1.24 CSCSc1cccc(c1)Br 62a_100011218213_100000691529 [1,2,0,0,0,0|1,0,0]=4 12570 B11R1.24 CSCSc1cccc(c1)C 62a_100011215228_100011218213 [1,2,0,0,0,0|1,0,0]=4 12571 B11R1.24 CSCSc1cccc(c1)C 62a_100011218213_100011215228 [1,2,0,0,0,0|1,0,0]=4 12572 B11R1.24 CSCSc1cccc(c1)Cl 62a_100000699651_100011218213 [1,2,0,0,0,0|1,0,0]=4 12573 B11R1.24 CSCSc1cccc(c1)Cl 62a_100011218213_100000699651 [1,2,0,0,0,0|1,0,0]=4 12574 B11R1.24 CSCSc1cccc(c1)F 62a_100000685547_100011218213 [1,2,0,0,0,0|1,0,0]=4 12575 B11R1.24 CSCSc1cccc(c1)F 62a_100011218213_100000685547 [1,2,0,0,0,0|1,0,0]=4 12576 B11R1.24 CSCSc1cccc(c1)N 62a_100000210019_100011218213 [1,2,0,0,0,0|1,0,0]=4 12577 B11R1.24 CSCSc1cccc(c1)N 62a_100011218213_100000210019 [1,2,0,0,0,0|1,0,0]=4 12578 B11R1.24 CSCSc1cccc(c1)O 62a_100011218213_100000211634 [1,2,0,0,0,0|1,0,0]=4 12579 B11R1.24 CSCSc1cccc(c1)[S] 62a_100011218213_114929384022 [1,2,0,0,0,0|1,0,0]=4 12580 B11R1.24 CSCSc1cccc(c1)[S] 62a_114929384022_100011218213 [1,2,0,0,0,0|1,0,0]=4 12581 B11R1.24 Cc1cccc(c1)CCN[13CH3] 2230a_100000749837_200025704644 [1,2,0,0,0,0|0,0,1]=4 12582 B11R1.24 Cc1cccc(c1)CCN[13CH3] 34a_100000749837_200025704644 [1,2,0,0,0,0|0,0,1]=4 12583 B11R1.24 Cc1cccc(c1)CCO[13CH3] 34a_100011217157_200025704644 [1,2,0,0,0,0|0,0,1]=4 12584 B11R1.24 Cc1cccc(c1)CCO[13CH3] 7a_100011217157_200025704644 [1,2,0,0,0,0|0,0,1]=4 12585 B11R1.24 Cc1cccc(c1)CCS[13CH3] 62a_100011713685_200025704644 [1,2,0,0,0,0|0,0,1]=4 12586 B11R1.24 Cc1cccc(c1)CCS[13CH3] 62a_200025704644_100011713685 [1,2,0,0,0,0|0,0,1]=4 12587 B11R1.24 Cc1cccc(c1)CNCF 34a_100000185548_100015361967 [1,2,0,0,0,0|1,0,0]=4 12588 B11R1.24 Cc1cccc(c1)COCF 34a_100011217746_100015361967 [1,2,0,0,0,0|1,0,0]=4 12589 B11R1.24 Cc1cccc(c1)COCF 7a_100011217746_100015361967 [1,2,0,0,0,0|1,0,0]=4 12590 B11R1.24 Cc1cccc(c1)CSCF 62a_100000211840_100015361967 [1,2,0,0,0,0|1,0,0]=4 12591 B11R1.24 Cc1cccc(c1)CSCF 62a_100015361967_100000211840 [1,2,0,0,0,0|1,0,0]=4 12592 B11R1.24 Cc1cccc(c1)NCC=O 2230a_100000188690_200015260668 [1,2,0,0,0,0|1,0,0]=4 12593 B11R1.24 Cc1cccc(c1)NCC=O 34a_100000188690_200009817547 [1,2,0,0,0,0|1,0,0]=4 12594 B11R1.24 Cc1cccc(c1)OCC=O 34a_100000210337_200009817547 [1,2,0,0,0,0|1,0,0]=4 12595 B11R1.24 Cc1cccc(c1)OCC=O 7a_100000210337_200015260668 [1,2,0,0,0,0|1,0,0]=4 12596 B11R1.24 Cc1cccc(c1)SCC=O 62a_100011215228_200015260668 [1,2,0,0,0,0|1,0,0]=4 12597 B11R1.24 Cc1cccc(c1)SCC=O 62a_200015260668_100011215228 [1,2,0,0,0,0|1,0,0]=4 12598 B11R1.24 FCNCc1cccc(c1)Br 34a_100000174977_100015361967 [1,2,0,0,0,0|1,0,0]=4 12599 B11R1.24 FCNCc1cccc(c1)Cl 34a_100000174878_100015361967 [1,2,0,0,0,0|1,0,0]=4 12600 B11R1.24 FCNCc1cccc(c1)F 34a_100000174948_100015361967 [1,2,0,0,0,0|1,0,0]=4 12601 B11R1.24 FCNCc1cccc(c1)I 34a_100000106179_100015361967 [1,2,0,0,0,0|1,0,0]=4 12602 B11R1.24 FCOCc1cccc(c1)Br 34a_100000687537_100015361967 [1,2,0,0,0,0|1,0,0]=4 12603 B11R1.24 FCOCc1cccc(c1)Br 7a_100000687537_100015361967 [1,2,0,0,0,0|1,0,0]=4 12604 B11R1.24 FCOCc1cccc(c1)Cl 34a_100000241301_100015361967 [1,2,0,0,0,0|1,0,0]=4 12605 B11R1.24 FCOCc1cccc(c1)Cl 7a_100000241301_100015361967 [1,2,0,0,0,0|1,0,0]=4 12606 B11R1.24 FCOCc1cccc(c1)F 34a_100000210976_100015361967 [1,2,0,0,0,0|1,0,0]=4 12607 B11R1.24 FCOCc1cccc(c1)F 7a_100000210976_100015361967 [1,2,0,0,0,0|1,0,0]=4 12608 B11R1.24 FCOCc1cccc(c1)I 34a_100011215336_100015361967 [1,2,0,0,0,0|1,0,0]=4 12609 B11R1.24 FCOCc1cccc(c1)I 7a_100011215336_100015361967 [1,2,0,0,0,0|1,0,0]=4 12610 B11R1.24 FCSCc1cccc(c1)Br 62a_100000211773_100015361967 [1,2,0,0,0,0|1,0,0]=4 12611 B11R1.24 FCSCc1cccc(c1)Br 62a_100015361967_100000211773 [1,2,0,0,0,0|1,0,0]=4 12612 B11R1.24 FCSCc1cccc(c1)Cl 62a_100000187163_100015361967 [1,2,0,0,0,0|1,0,0]=4 12613 B11R1.24 FCSCc1cccc(c1)Cl 62a_100015361967_100000187163 [1,2,0,0,0,0|1,0,0]=4 12614 B11R1.24 FCSCc1cccc(c1)F 62a_100000230114_100015361967 [1,2,0,0,0,0|1,0,0]=4 12615 B11R1.24 FCSCc1cccc(c1)F 62a_100015361967_100000230114 [1,2,0,0,0,0|1,0,0]=4 12616 B11R1.24 FCSCc1cccc(c1)I 62a_100011218688_100015361967 [1,2,0,0,0,0|1,0,0]=4 12617 B11R1.24 FCSCc1cccc(c1)I 62a_100015361967_100011218688 [1,2,0,0,0,0|1,0,0]=4 12618 B11R1.24 NCCCc1cccc(c1)O 271570a_203496583355_100000753791 [1,2,0,0,0,0|0,0,1]=4 12619 B11R1.24 Nc1cccc(c1)COCF 34a_100000211919_100015361967 [1,2,0,0,0,0|1,0,0]=4 12620 B11R1.24 Nc1cccc(c1)OCC=O 34a_100000210217_200009817547 [1,2,0,0,0,0|1,0,0]=4 12621 B11R1.24 Nc1cccc(c1)SCC=O 62a_100000210019_200015260668 [1,2,0,0,0,0|1,0,0]=4 12622 B11R1.24 Nc1cccc(c1)SCC=O 62a_200015260668_100000210019 [1,2,0,0,0,0|1,0,0]=4 12623 B11R1.24 O=CCNc1cccc(c1)Br 34a_100000210019_200009817547 [1,2,0,0,0,0|1,0,0]=4 12624 B11R1.24 O=CCNc1cccc(c1)Cl 34a_100000185859_200009817547 [1,2,0,0,0,0|1,0,0]=4 12625 B11R1.24 O=CCNc1cccc(c1)F 34a_100000210047_200009817547 [1,2,0,0,0,0|1,0,0]=4 12626 B11R1.24 O=CCNc1cccc(c1)I 34a_100000211102_200009817547 [1,2,0,0,0,0|1,0,0]=4 12627 B11R1.24 O=CCNc1cccc(c1)O 34a_100000210217_200009817547 [1,2,0,0,0,0|1,0,0]=4 12628 B11R1.24 O=CCOc1cccc(c1)Br 34a_100000210342_200009817547 [1,2,0,0,0,0|1,0,0]=4 12629 B11R1.24 O=CCOc1cccc(c1)Br 7a_100000210342_200015260668 [1,2,0,0,0,0|1,0,0]=4 12630 B11R1.24 O=CCOc1cccc(c1)Cl 34a_100000210295_200009817547 [1,2,0,0,0,0|1,0,0]=4 12631 B11R1.24 O=CCOc1cccc(c1)Cl 7a_100000210295_200015260668 [1,2,0,0,0,0|1,0,0]=4 12632 B11R1.24 O=CCOc1cccc(c1)F 34a_100000210426_200009817547 [1,2,0,0,0,0|1,0,0]=4 12633 B11R1.24 O=CCOc1cccc(c1)F 7a_100000210426_200015260668 [1,2,0,0,0,0|1,0,0]=4 12634 B11R1.24 O=CCOc1cccc(c1)I 34a_100000211634_200009817547 [1,2,0,0,0,0|1,0,0]=4 12635 B11R1.24 O=CCOc1cccc(c1)I 7a_100000211634_200015260668 [1,2,0,0,0,0|1,0,0]=4 12636 B11R1.24 O=CCSc1cccc(c1)Br 62a_100000691529_200015260668 [1,2,0,0,0,0|1,0,0]=4 12637 B11R1.24 O=CCSc1cccc(c1)Br 62a_200015260668_100000691529 [1,2,0,0,0,0|1,0,0]=4 12638 B11R1.24 O=CCSc1cccc(c1)Cl 62a_100000699651_200015260668 [1,2,0,0,0,0|1,0,0]=4 12639 B11R1.24 O=CCSc1cccc(c1)Cl 62a_200015260668_100000699651 [1,2,0,0,0,0|1,0,0]=4 12640 B11R1.24 O=CCSc1cccc(c1)F 62a_100000685547_200015260668 [1,2,0,0,0,0|1,0,0]=4 12641 B11R1.24 O=CCSc1cccc(c1)F 62a_200015260668_100000685547 [1,2,0,0,0,0|1,0,0]=4 12642 B11R1.24 O=CCSc1cccc(c1)O 62a_200015260668_100000211634 [1,2,0,0,0,0|1,0,0]=4 12643 B11R1.24 O=CCSc1cccc(c1)[S] 62a_114929384022_200015260668 [1,2,0,0,0,0|1,0,0]=4 12644 B11R1.24 O=CCSc1cccc(c1)[S] 62a_200015260668_114929384022 [1,2,0,0,0,0|1,0,0]=4 12645 B11R1.24 OCCCc1cccc(c1)O 271570a_203496583355_100011709248 [1,2,0,0,0,0|0,0,1]=4 12646 B11R1.24 Oc1cccc(c1)CNCF 34a_100000743036_100015361967 [1,2,0,0,0,0|1,0,0]=4 12647 B11R1.24 Oc1cccc(c1)CSCF 62a_100011660834_100015361967 [1,2,0,0,0,0|1,0,0]=4 12648 B11R1.24 Oc1cccc(c1)CSCF 62a_100015361967_100011660834 [1,2,0,0,0,0|1,0,0]=4 12649 B11R1.24 [13CH3]NCCc1cccc(c1)Br 2230a_100011207229_200025704644 [1,2,0,0,0,0|0,0,1]=4 12650 B11R1.24 [13CH3]NCCc1cccc(c1)Br 34a_100011207229_200025704644 [1,2,0,0,0,0|0,0,1]=4 12651 B11R1.24 [13CH3]NCCc1cccc(c1)Cl 2230a_100000185263_200025704644 [1,2,0,0,0,0|0,0,1]=4 12652 B11R1.24 [13CH3]NCCc1cccc(c1)Cl 34a_100000185263_200025704644 [1,2,0,0,0,0|0,0,1]=4 12653 B11R1.24 [13CH3]NCCc1cccc(c1)F 2230a_100000205154_200025704644 [1,2,0,0,0,0|0,0,1]=4 12654 B11R1.24 [13CH3]NCCc1cccc(c1)F 34a_100000205154_200025704644 [1,2,0,0,0,0|0,0,1]=4 12655 B11R1.24 [13CH3]NCCc1cccc(c1)O 2230a_100000747277_200025704644 [1,2,0,0,0,0|0,0,1]=4 12656 B11R1.24 [13CH3]NCCc1cccc(c1)O 34a_100000747277_200025704644 [1,2,0,0,0,0|0,0,1]=4 12657 B11R1.24 [13CH3]OCCc1cccc(c1)Br 34a_100011217444_200025704644 [1,2,0,0,0,0|0,0,1]=4 12658 B11R1.24 [13CH3]OCCc1cccc(c1)Br 7a_100011217444_200025704644 [1,2,0,0,0,0|0,0,1]=4 12659 B11R1.24 [13CH3]OCCc1cccc(c1)Cl 34a_100000754733_200025704644 [1,2,0,0,0,0|0,0,1]=4 12660 B11R1.24 [13CH3]OCCc1cccc(c1)Cl 7a_100000754733_200025704644 [1,2,0,0,0,0|0,0,1]=4 12661 B11R1.24 [13CH3]OCCc1cccc(c1)F 34a_100000763591_200025704644 [1,2,0,0,0,0|0,0,1]=4 12662 B11R1.24 [13CH3]OCCc1cccc(c1)F 7a_100000763591_200025704644 [1,2,0,0,0,0|0,0,1]=4 12663 B11R1.24 [13CH3]OCCc1cccc(c1)N 34a_100011996697_200025704644 [1,2,0,0,0,0|0,0,1]=4 12664 B11R1.24 [13CH3]SCCc1cccc(c1)Br 62a_100011740638_200025704644 [1,2,0,0,0,0|0,0,1]=4 12665 B11R1.24 [13CH3]SCCc1cccc(c1)Br 62a_200025704644_100011740638 [1,2,0,0,0,0|0,0,1]=4 12666 B11R1.24 [13CH3]SCCc1cccc(c1)Cl 62a_100011713710_200025704644 [1,2,0,0,0,0|0,0,1]=4 12667 B11R1.24 [13CH3]SCCc1cccc(c1)Cl 62a_200025704644_100011713710 [1,2,0,0,0,0|0,0,1]=4 12668 B11R1.24 [13CH3]SCCc1cccc(c1)F 62a_100011217235_200025704644 [1,2,0,0,0,0|0,0,1]=4 12669 B11R1.24 [13CH3]SCCc1cccc(c1)F 62a_200025704644_100011217235 [1,2,0,0,0,0|0,0,1]=4 12670 B11R1.34 CC=Cc1cc(cc(c1)Br)Br 271570a_100016259895_100009814770 [1,2,0,0,0,0|0,0,1]=4 12671 B11R1.34 CC=Cc1cc(cc(c1)Br)Cl 271570a_100016259895_100009814755 [1,2,0,0,0,0|0,0,1]=4 12672 B11R1.34 CC=Cc1cc(cc(c1)Br)F 271570a_100016259895_100009814764 [1,2,0,0,0,0|0,0,1]=4 12673 B11R1.34 CC=Cc1cc(cc(c1)Br)N 271570a_100016259895_100009814763 [1,2,0,0,0,0|0,0,1]=4 12674 B11R1.34 CC=Cc1cc(cc(c1)Br)O 271570a_100016259895_100010068917 [1,2,0,0,0,0|0,0,1]=4 12675 B11R1.34 CC=Cc1cc(cc(c1)C)C 271570a_100016259895_100011215608 [1,2,0,0,0,0|0,0,1]=4 12676 B11R1.34 CC=Cc1cc(cc(c1)Cl)C 271570a_100016259895_100010172791 [1,2,0,0,0,0|0,0,1]=4 12677 B11R1.34 CC=Cc1cc(cc(c1)Cl)Cl 271570a_100016259895_100000747138 [1,2,0,0,0,0|0,0,1]=4 12678 B11R1.34 CC=Cc1cc(cc(c1)Cl)F 271570a_100016259895_100013859453 [1,2,0,0,0,0|0,0,1]=4 12679 B11R1.34 CC=Cc1cc(cc(c1)Cl)N 271570a_100016259895_100010147676 [1,2,0,0,0,0|0,0,1]=4 12680 B11R1.34 CC=Cc1cc(cc(c1)Cl)O 271570a_100016259895_100010068924 [1,2,0,0,0,0|0,0,1]=4 12681 B11R1.34 CC=Cc1cc(cc(c1)F)C 271570a_100016259895_100011356977 [1,2,0,0,0,0|0,0,1]=4 12682 B11R1.34 CC=Cc1cc(cc(c1)F)F 271570a_100016259895_100011218498 [1,2,0,0,0,0|0,0,1]=4 12683 B11R1.34 CC=Cc1cc(cc(c1)F)N 271570a_100016259895_100011356972 [1,2,0,0,0,0|0,0,1]=4 12684 B11R1.34 CC=Cc1cc(cc(c1)F)O 271570a_100016259895_100000717995 [1,2,0,0,0,0|0,0,1]=4 12685 B11R1.34 CC=Cc1cc(cc(c1)N)C 271570a_100016259895_100000695972 [1,2,0,0,0,0|0,0,1]=4 12686 B11R1.34 CC=Cc1cc(cc(c1)N)N 271570a_100016259895_100011999608 [1,2,0,0,0,0|0,0,1]=4 12687 B11R1.34 CC=Cc1cc(cc(c1)O)C 271570a_100016259895_100011999630 [1,2,0,0,0,0|0,0,1]=4 12688 B11R1.34 CC=Cc1cc(cc(c1)O)O 271570a_100016259895_100009868816 [1,2,0,0,0,0|0,0,1]=4 12689 B11R1.34 CNCc1cc(cc(c1)Br)Br 207a_100102657272_100000719502 [1,2,0,0,0,0|1,0,0]=4 12690 B11R1.34 CNCc1cc(cc(c1)Br)Br 2230a_100015211796_200000210301 [1,2,0,0,0,0|1,0,0]=4 12691 B11R1.34 CNCc1cc(cc(c1)Br)Br 2230a_106832991635_100011216082 [1,2,0,0,0,0|1,0,0]=4 12692 B11R1.34 CNCc1cc(cc(c1)Br)Br 269862a_106832991636_100000719502 [1,2,0,0,0,0|1,0,0]=4 12693 B11R1.34 CNCc1cc(cc(c1)Br)Br 26a_100102657272_100010167048 [1,2,0,0,0,0|1,0,0]=4 12694 B11R1.34 CNCc1cc(cc(c1)Br)Br 270004a_106832991635_100000719502 [1,2,0,0,0,0|1,0,0]=4 12695 B11R1.34 CNCc1cc(cc(c1)Br)Br 34a_100015211796_200000210301 [1,2,0,0,0,0|1,0,0]=4 12696 B11R1.34 CNCc1cc(cc(c1)Br)Br 34a_100102657272_100011216082 [1,2,0,0,0,0|1,0,0]=4 12697 B11R1.34 CNCc1cc(cc(c1)Br)Br 7a_106832991635_100011216082 [1,2,0,0,0,0|1,0,0]=4 12698 B11R1.34 CNCc1cc(cc(c1)Br)C 207a_100102657272_100000686105 [1,2,0,0,0,0|1,0,0]=4 12699 B11R1.34 CNCc1cc(cc(c1)Br)C 2230a_106832991635_100012348363 [1,2,0,0,0,0|1,0,0]=4 12700 B11R1.34 CNCc1cc(cc(c1)Br)C 269862a_106832991636_100000686105 [1,2,0,0,0,0|1,0,0]=4 12701 B11R1.34 CNCc1cc(cc(c1)Br)C 26a_100102657272_100011999630 [1,2,0,0,0,0|1,0,0]=4 12702 B11R1.34 CNCc1cc(cc(c1)Br)C 270004a_106832991635_100000686105 [1,2,0,0,0,0|1,0,0]=4 12703 B11R1.34 CNCc1cc(cc(c1)Br)C 34a_100102657272_100012348363 [1,2,0,0,0,0|1,0,0]=4 12704 B11R1.34 CNCc1cc(cc(c1)Br)C 7a_106832991635_100012348363 [1,2,0,0,0,0|1,0,0]=4 12705 B11R1.34 CNCc1cc(cc(c1)Br)Cl 207a_100102657272_100011934515 [1,2,0,0,0,0|1,0,0]=4 12706 B11R1.34 CNCc1cc(cc(c1)Br)Cl 269862a_106832991636_100011934515 [1,2,0,0,0,0|1,0,0]=4 12707 B11R1.34 CNCc1cc(cc(c1)Br)Cl 26a_100102657272_100010185897 [1,2,0,0,0,0|1,0,0]=4 12708 B11R1.34 CNCc1cc(cc(c1)Br)Cl 270004a_106832991635_100011934515 [1,2,0,0,0,0|1,0,0]=4 12709 B11R1.34 CNCc1cc(cc(c1)Br)F 207a_100102657272_100011794424 [1,2,0,0,0,0|1,0,0]=4 12710 B11R1.34 CNCc1cc(cc(c1)Br)F 2230a_100020611034_200000210301 [1,2,0,0,0,0|1,0,0]=4 12711 B11R1.34 CNCc1cc(cc(c1)Br)F 2230a_106832991635_100000766940 [1,2,0,0,0,0|1,0,0]=4 12712 B11R1.34 CNCc1cc(cc(c1)Br)F 269862a_106832991636_100011794424 [1,2,0,0,0,0|1,0,0]=4 12713 B11R1.34 CNCc1cc(cc(c1)Br)F 26a_100102657272_100000688818 [1,2,0,0,0,0|1,0,0]=4 12714 B11R1.34 CNCc1cc(cc(c1)Br)F 270004a_106832991635_100011794424 [1,2,0,0,0,0|1,0,0]=4 12715 B11R1.34 CNCc1cc(cc(c1)Br)F 34a_100020611034_200000210301 [1,2,0,0,0,0|1,0,0]=4 12716 B11R1.34 CNCc1cc(cc(c1)Br)F 34a_100102657272_100000766940 [1,2,0,0,0,0|1,0,0]=4 12717 B11R1.34 CNCc1cc(cc(c1)Br)F 7a_106832991635_100000766940 [1,2,0,0,0,0|1,0,0]=4 12718 B11R1.34 CNCc1cc(cc(c1)Br)O 207a_100102657272_100010176088 [1,2,0,0,0,0|1,0,0]=4 12719 B11R1.34 CNCc1cc(cc(c1)Br)O 270004a_106832991635_100010176088 [1,2,0,0,0,0|1,0,0]=4 12720 B11R1.34 CNCc1cc(cc(c1)C)C 207a_100102657272_100000745632 [1,2,0,0,0,0|1,0,0]=4 12721 B11R1.34 CNCc1cc(cc(c1)C)C 2230a_100020591340_200000210301 [1,2,0,0,0,0|1,0,0]=4 12722 B11R1.34 CNCc1cc(cc(c1)C)C 2230a_106832991635_100000181317 [1,2,0,0,0,0|1,0,0]=4 12723 B11R1.34 CNCc1cc(cc(c1)C)C 270004a_106832991635_100000745632 [1,2,0,0,0,0|1,0,0]=4 12724 B11R1.34 CNCc1cc(cc(c1)C)C 34a_100020591340_200000210301 [1,2,0,0,0,0|1,0,0]=4 12725 B11R1.34 CNCc1cc(cc(c1)C)C 34a_100102657272_100000181317 [1,2,0,0,0,0|1,0,0]=4 12726 B11R1.34 CNCc1cc(cc(c1)C)C 7a_106832991635_100000181317 [1,2,0,0,0,0|1,0,0]=4 12727 B11R1.34 CNCc1cc(cc(c1)Cl)C 207a_100102657272_100000684525 [1,2,0,0,0,0|1,0,0]=4 12728 B11R1.34 CNCc1cc(cc(c1)Cl)C 270004a_106832991635_100000684525 [1,2,0,0,0,0|1,0,0]=4 12729 B11R1.34 CNCc1cc(cc(c1)Cl)Cl 207a_100102657272_100000741761 [1,2,0,0,0,0|1,0,0]=4 12730 B11R1.34 CNCc1cc(cc(c1)Cl)Cl 2230a_100011211636_200000210301 [1,2,0,0,0,0|1,0,0]=4 12731 B11R1.34 CNCc1cc(cc(c1)Cl)Cl 2230a_106832991635_100000685807 [1,2,0,0,0,0|1,0,0]=4 12732 B11R1.34 CNCc1cc(cc(c1)Cl)Cl 26a_100102657272_100000181315 [1,2,0,0,0,0|1,0,0]=4 12733 B11R1.34 CNCc1cc(cc(c1)Cl)Cl 270004a_106832991635_100000741761 [1,2,0,0,0,0|1,0,0]=4 12734 B11R1.34 CNCc1cc(cc(c1)Cl)Cl 34a_100011211636_200000210301 [1,2,0,0,0,0|1,0,0]=4 12735 B11R1.34 CNCc1cc(cc(c1)Cl)Cl 7a_106832991635_100011219208 [1,2,0,0,0,0|1,0,0]=4 12736 B11R1.34 CNCc1cc(cc(c1)Cl)F 207a_100102657272_100000703917 [1,2,0,0,0,0|1,0,0]=4 12737 B11R1.34 CNCc1cc(cc(c1)Cl)F 2230a_100137329012_200000210301 [1,2,0,0,0,0|1,0,0]=4 12738 B11R1.34 CNCc1cc(cc(c1)Cl)F 2230a_106832991635_100011219885 [1,2,0,0,0,0|1,0,0]=4 12739 B11R1.34 CNCc1cc(cc(c1)Cl)F 269862a_106832991636_100000703917 [1,2,0,0,0,0|1,0,0]=4 12740 B11R1.34 CNCc1cc(cc(c1)Cl)F 270004a_106832991635_100000703917 [1,2,0,0,0,0|1,0,0]=4 12741 B11R1.34 CNCc1cc(cc(c1)Cl)F 34a_100102657272_100011219885 [1,2,0,0,0,0|1,0,0]=4 12742 B11R1.34 CNCc1cc(cc(c1)Cl)F 34a_100137329012_200000210301 [1,2,0,0,0,0|1,0,0]=4 12743 B11R1.34 CNCc1cc(cc(c1)Cl)F 7a_106832991635_100011219885 [1,2,0,0,0,0|1,0,0]=4 12744 B11R1.34 CNCc1cc(cc(c1)Cl)O 207a_100102657272_100000050827 [1,2,0,0,0,0|1,0,0]=4 12745 B11R1.34 CNCc1cc(cc(c1)Cl)O 2230a_107254831445_200000210301 [1,2,0,0,0,0|1,0,0]=4 12746 B11R1.34 CNCc1cc(cc(c1)Cl)O 270004a_106832991635_100000050827 [1,2,0,0,0,0|1,0,0]=4 12747 B11R1.34 CNCc1cc(cc(c1)Cl)O 34a_107254831445_200000210301 [1,2,0,0,0,0|1,0,0]=4 12748 B11R1.34 CNCc1cc(cc(c1)F)C 207a_100102657272_100011217087 [1,2,0,0,0,0|1,0,0]=4 12749 B11R1.34 CNCc1cc(cc(c1)F)C 2230a_100011830484_200000210301 [1,2,0,0,0,0|1,0,0]=4 12750 B11R1.34 CNCc1cc(cc(c1)F)C 2230a_106832991635_100011219130 [1,2,0,0,0,0|1,0,0]=4 12751 B11R1.34 CNCc1cc(cc(c1)F)C 270004a_106832991635_100011217087 [1,2,0,0,0,0|1,0,0]=4 12752 B11R1.34 CNCc1cc(cc(c1)F)C 34a_100011830484_200000210301 [1,2,0,0,0,0|1,0,0]=4 12753 B11R1.34 CNCc1cc(cc(c1)F)C 34a_100102657272_100011219130 [1,2,0,0,0,0|1,0,0]=4 12754 B11R1.34 CNCc1cc(cc(c1)F)C 7a_106832991635_100011219130 [1,2,0,0,0,0|1,0,0]=4 12755 B11R1.34 CNCc1cc(cc(c1)F)F 207a_100102657272_100000743029 [1,2,0,0,0,0|1,0,0]=4 12756 B11R1.34 CNCc1cc(cc(c1)F)F 2230a_100000737602_200000210301 [1,2,0,0,0,0|1,0,0]=4 12757 B11R1.34 CNCc1cc(cc(c1)F)F 2230a_106832991635_100000697002 [1,2,0,0,0,0|1,0,0]=4 12758 B11R1.34 CNCc1cc(cc(c1)F)F 269862a_106832991636_100000743029 [1,2,0,0,0,0|1,0,0]=4 12759 B11R1.34 CNCc1cc(cc(c1)F)F 270004a_106832991635_100000743029 [1,2,0,0,0,0|1,0,0]=4 12760 B11R1.34 CNCc1cc(cc(c1)F)F 34a_100000737602_200000210301 [1,2,0,0,0,0|1,0,0]=4 12761 B11R1.34 CNCc1cc(cc(c1)F)F 34a_100102657272_100000697002 [1,2,0,0,0,0|1,0,0]=4 12762 B11R1.34 CNCc1cc(cc(c1)F)F 7a_106832991635_100000697002 [1,2,0,0,0,0|1,0,0]=4 12763 B11R1.34 CNCc1cc(cc(c1)F)O 207a_100102657272_100000703664 [1,2,0,0,0,0|1,0,0]=4 12764 B11R1.34 CNCc1cc(cc(c1)F)O 2230a_100160469513_200000210301 [1,2,0,0,0,0|1,0,0]=4 12765 B11R1.34 CNCc1cc(cc(c1)F)O 270004a_106832991635_100000703664 [1,2,0,0,0,0|1,0,0]=4 12766 B11R1.34 CNCc1cc(cc(c1)F)O 34a_100160469513_200000210301 [1,2,0,0,0,0|1,0,0]=4 12767 B11R1.34 CNCc1cc(cc(c1)I)Br 207a_100102657272_100010185649 [1,2,0,0,0,0|1,0,0]=4 12768 B11R1.34 CNCc1cc(cc(c1)I)Br 2230a_106832991635_100010146614 [1,2,0,0,0,0|1,0,0]=4 12769 B11R1.34 CNCc1cc(cc(c1)I)Br 269862a_106832991636_100010185649 [1,2,0,0,0,0|1,0,0]=4 12770 B11R1.34 CNCc1cc(cc(c1)I)Br 26a_100102657272_100010068917 [1,2,0,0,0,0|1,0,0]=4 12771 B11R1.34 CNCc1cc(cc(c1)I)Br 270004a_106832991635_100010185649 [1,2,0,0,0,0|1,0,0]=4 12772 B11R1.34 CNCc1cc(cc(c1)I)Br 34a_100102657272_100010146614 [1,2,0,0,0,0|1,0,0]=4 12773 B11R1.34 CNCc1cc(cc(c1)I)Br 7a_106832991635_100010146614 [1,2,0,0,0,0|1,0,0]=4 12774 B11R1.34 CNCc1cc(cc(c1)I)F 207a_100102657272_100010185655 [1,2,0,0,0,0|1,0,0]=4 12775 B11R1.34 CNCc1cc(cc(c1)I)F 2230a_106832991635_100010149605 [1,2,0,0,0,0|1,0,0]=4 12776 B11R1.34 CNCc1cc(cc(c1)I)F 269862a_106832991636_100010185655 [1,2,0,0,0,0|1,0,0]=4 12777 B11R1.34 CNCc1cc(cc(c1)I)F 270004a_106832991635_100010185655 [1,2,0,0,0,0|1,0,0]=4 12778 B11R1.34 CNCc1cc(cc(c1)I)F 34a_100102657272_100010149605 [1,2,0,0,0,0|1,0,0]=4 12779 B11R1.34 CNCc1cc(cc(c1)I)F 7a_106832991635_100010149605 [1,2,0,0,0,0|1,0,0]=4 12780 B11R1.34 CNCc1cc(cc(c1)I)I 207a_100102657272_100010185653 [1,2,0,0,0,0|1,0,0]=4 12781 B11R1.34 CNCc1cc(cc(c1)I)I 269862a_106832991636_100010185653 [1,2,0,0,0,0|1,0,0]=4 12782 B11R1.34 CNCc1cc(cc(c1)O)C 207a_100102657272_100009853434 [1,2,0,0,0,0|1,0,0]=4 12783 B11R1.34 CNCc1cc(cc(c1)O)C 270004a_106832991635_100009853434 [1,2,0,0,0,0|1,0,0]=4 12784 B11R1.34 CNCc1cc(cc(c1)O)O 207a_100102657272_100000043415 [1,2,0,0,0,0|1,0,0]=4 12785 B11R1.34 CNCc1cc(cc(c1)O)O 2230a_100159270720_200000210301 [1,2,0,0,0,0|1,0,0]=4 12786 B11R1.34 CNCc1cc(cc(c1)O)O 34a_100159270720_200000210301 [1,2,0,0,0,0|1,0,0]=4 12787 B11R1.34 COCc1cc(cc(c1)Br)Br 34a_100011218366_200000210301 [1,2,0,0,0,0|1,0,0]=4 12788 B11R1.34 COCc1cc(cc(c1)Br)Br 34a_100138415774_100011216082 [1,2,0,0,0,0|1,0,0]=4 12789 B11R1.34 COCc1cc(cc(c1)Br)Br 7a_100011218366_200000210301 [1,2,0,0,0,0|1,0,0]=4 12790 B11R1.34 COCc1cc(cc(c1)Br)C 34a_100000720511_200000210301 [1,2,0,0,0,0|1,0,0]=4 12791 B11R1.34 COCc1cc(cc(c1)Br)C 34a_100138415774_100012348363 [1,2,0,0,0,0|1,0,0]=4 12792 B11R1.34 COCc1cc(cc(c1)Br)C 7a_100000720511_200000210301 [1,2,0,0,0,0|1,0,0]=4 12793 B11R1.34 COCc1cc(cc(c1)Br)Cl 34a_100012353933_200000210301 [1,2,0,0,0,0|1,0,0]=4 12794 B11R1.34 COCc1cc(cc(c1)Br)Cl 7a_100012353933_200000210301 [1,2,0,0,0,0|1,0,0]=4 12795 B11R1.34 COCc1cc(cc(c1)Br)F 34a_100000766897_200000210301 [1,2,0,0,0,0|1,0,0]=4 12796 B11R1.34 COCc1cc(cc(c1)Br)F 34a_100138415774_100000766940 [1,2,0,0,0,0|1,0,0]=4 12797 B11R1.34 COCc1cc(cc(c1)Br)F 7a_100000766897_200000210301 [1,2,0,0,0,0|1,0,0]=4 12798 B11R1.34 COCc1cc(cc(c1)C)C 34a_100011216556_200000210301 [1,2,0,0,0,0|1,0,0]=4 12799 B11R1.34 COCc1cc(cc(c1)C)C 34a_100138415774_100000181317 [1,2,0,0,0,0|1,0,0]=4 12800 B11R1.34 COCc1cc(cc(c1)C)C 7a_100011216556_200000210301 [1,2,0,0,0,0|1,0,0]=4 12801 B11R1.34 COCc1cc(cc(c1)Cl)Cl 34a_100011218629_200000210301 [1,2,0,0,0,0|1,0,0]=4 12802 B11R1.34 COCc1cc(cc(c1)Cl)Cl 7a_100011218629_200000210301 [1,2,0,0,0,0|1,0,0]=4 12803 B11R1.34 COCc1cc(cc(c1)Cl)F 34a_100011217560_200000210301 [1,2,0,0,0,0|1,0,0]=4 12804 B11R1.34 COCc1cc(cc(c1)Cl)F 34a_100138415774_100011219885 [1,2,0,0,0,0|1,0,0]=4 12805 B11R1.34 COCc1cc(cc(c1)Cl)F 7a_100011217560_200000210301 [1,2,0,0,0,0|1,0,0]=4 12806 B11R1.34 COCc1cc(cc(c1)Cl)N 34a_100012002482_200000210301 [1,2,0,0,0,0|1,0,0]=4 12807 B11R1.34 COCc1cc(cc(c1)Cl)N 7a_100012002482_200000210301 [1,2,0,0,0,0|1,0,0]=4 12808 B11R1.34 COCc1cc(cc(c1)F)C 34a_100011217934_200000210301 [1,2,0,0,0,0|1,0,0]=4 12809 B11R1.34 COCc1cc(cc(c1)F)C 34a_100138415774_100011219130 [1,2,0,0,0,0|1,0,0]=4 12810 B11R1.34 COCc1cc(cc(c1)F)C 7a_100011217934_200000210301 [1,2,0,0,0,0|1,0,0]=4 12811 B11R1.34 COCc1cc(cc(c1)F)F 34a_100011215443_200000210301 [1,2,0,0,0,0|1,0,0]=4 12812 B11R1.34 COCc1cc(cc(c1)F)F 34a_100138415774_100000697002 [1,2,0,0,0,0|1,0,0]=4 12813 B11R1.34 COCc1cc(cc(c1)F)F 7a_100011215443_200000210301 [1,2,0,0,0,0|1,0,0]=4 12814 B11R1.34 COCc1cc(cc(c1)F)O 271570a_203496583355_100012630430 [1,2,0,0,0,0|1,0,0]=4 12815 B11R1.34 COCc1cc(cc(c1)I)Br 34a_100138415774_100010146614 [1,2,0,0,0,0|1,0,0]=4 12816 B11R1.34 COCc1cc(cc(c1)I)Br 7a_100009814756_200000210301 [1,2,0,0,0,0|1,0,0]=4 12817 B11R1.34 COCc1cc(cc(c1)I)F 34a_100010149598_200000210301 [1,2,0,0,0,0|1,0,0]=4 12818 B11R1.34 COCc1cc(cc(c1)I)F 34a_100138415774_100010149605 [1,2,0,0,0,0|1,0,0]=4 12819 B11R1.34 COCc1cc(cc(c1)I)F 7a_100010149598_200000210301 [1,2,0,0,0,0|1,0,0]=4 12820 B11R1.34 COCc1cc(cc(c1)I)I 7a_100010205817_200000210301 [1,2,0,0,0,0|1,0,0]=4 12821 B11R1.34 COCc1cc(cc(c1)N)N 34a_100000032468_200000210301 [1,2,0,0,0,0|1,0,0]=4 12822 B11R1.34 CSCc1cc(cc(c1)Br)Br 62a_100011216082_200000210301 [1,2,0,0,0,0|1,0,0]=4 12823 B11R1.34 CSCc1cc(cc(c1)Br)Br 62a_200000210301_100011216082 [1,2,0,0,0,0|1,0,0]=4 12824 B11R1.34 CSCc1cc(cc(c1)Br)C 62a_100012348363_200000210301 [1,2,0,0,0,0|1,0,0]=4 12825 B11R1.34 CSCc1cc(cc(c1)Br)C 62a_200000210301_100012348363 [1,2,0,0,0,0|1,0,0]=4 12826 B11R1.34 CSCc1cc(cc(c1)Br)F 62a_100000766940_200000210301 [1,2,0,0,0,0|1,0,0]=4 12827 B11R1.34 CSCc1cc(cc(c1)Br)F 62a_200000210301_100000766940 [1,2,0,0,0,0|1,0,0]=4 12828 B11R1.34 CSCc1cc(cc(c1)C)C 62a_100000181317_200000210301 [1,2,0,0,0,0|1,0,0]=4 12829 B11R1.34 CSCc1cc(cc(c1)C)C 62a_200000210301_100000181317 [1,2,0,0,0,0|1,0,0]=4 12830 B11R1.34 CSCc1cc(cc(c1)Cl)Cl 62a_100011219208_200000210301 [1,2,0,0,0,0|1,0,0]=4 12831 B11R1.34 CSCc1cc(cc(c1)Cl)Cl 62a_200000210301_100011219208 [1,2,0,0,0,0|1,0,0]=4 12832 B11R1.34 CSCc1cc(cc(c1)Cl)F 62a_100011219885_200000210301 [1,2,0,0,0,0|1,0,0]=4 12833 B11R1.34 CSCc1cc(cc(c1)Cl)F 62a_200000210301_100011219885 [1,2,0,0,0,0|1,0,0]=4 12834 B11R1.34 CSCc1cc(cc(c1)F)C 62a_100011219130_200000210301 [1,2,0,0,0,0|1,0,0]=4 12835 B11R1.34 CSCc1cc(cc(c1)F)C 62a_200000210301_100011219130 [1,2,0,0,0,0|1,0,0]=4 12836 B11R1.34 CSCc1cc(cc(c1)F)F 62a_100000697002_200000210301 [1,2,0,0,0,0|1,0,0]=4 12837 B11R1.34 CSCc1cc(cc(c1)F)F 62a_200000210301_100000697002 [1,2,0,0,0,0|1,0,0]=4 12838 B11R1.34 CSCc1cc(cc(c1)I)Br 62a_100010146614_200000210301 [1,2,0,0,0,0|1,0,0]=4 12839 B11R1.34 CSCc1cc(cc(c1)I)Br 62a_200000210301_100010146614 [1,2,0,0,0,0|1,0,0]=4 12840 B11R1.34 CSCc1cc(cc(c1)I)F 62a_100010149605_200000210301 [1,2,0,0,0,0|1,0,0]=4 12841 B11R1.34 CSCc1cc(cc(c1)I)F 62a_200000210301_100010149605 [1,2,0,0,0,0|1,0,0]=4 12842 B11R1.34 Cc1cc(cc(c1)CN[13CH3])C 2230a_100020591340_200025704644 [1,2,0,0,0,0|1,0,0]=4 12843 B11R1.34 Cc1cc(cc(c1)CN[13CH3])C 34a_100020591340_200025704644 [1,2,0,0,0,0|1,0,0]=4 12844 B11R1.34 Cc1cc(cc(c1)CN[13CH3])F 2230a_100011830484_200025704644 [1,2,0,0,0,0|1,0,0]=4 12845 B11R1.34 Cc1cc(cc(c1)CN[13CH3])F 34a_100011830484_200025704644 [1,2,0,0,0,0|1,0,0]=4 12846 B11R1.34 Cc1cc(cc(c1)CO[13CH3])Br 34a_100000720511_200025704644 [1,2,0,0,0,0|1,0,0]=4 12847 B11R1.34 Cc1cc(cc(c1)CO[13CH3])Br 7a_100000720511_200025704644 [1,2,0,0,0,0|1,0,0]=4 12848 B11R1.34 Cc1cc(cc(c1)CO[13CH3])C 34a_100011216556_200025704644 [1,2,0,0,0,0|1,0,0]=4 12849 B11R1.34 Cc1cc(cc(c1)CO[13CH3])C 7a_100011216556_200025704644 [1,2,0,0,0,0|1,0,0]=4 12850 B11R1.34 Cc1cc(cc(c1)CO[13CH3])F 34a_100011217934_200025704644 [1,2,0,0,0,0|1,0,0]=4 12851 B11R1.34 Cc1cc(cc(c1)CO[13CH3])F 7a_100011217934_200025704644 [1,2,0,0,0,0|1,0,0]=4 12852 B11R1.34 Cc1cc(cc(c1)CS[13CH3])Br 62a_100012348363_200025704644 [1,2,0,0,0,0|1,0,0]=4 12853 B11R1.34 Cc1cc(cc(c1)CS[13CH3])Br 62a_200025704644_100012348363 [1,2,0,0,0,0|1,0,0]=4 12854 B11R1.34 Cc1cc(cc(c1)CS[13CH3])C 62a_100000181317_200025704644 [1,2,0,0,0,0|1,0,0]=4 12855 B11R1.34 Cc1cc(cc(c1)CS[13CH3])C 62a_200025704644_100000181317 [1,2,0,0,0,0|1,0,0]=4 12856 B11R1.34 Cc1cc(cc(c1)CS[13CH3])F 62a_100011219130_200025704644 [1,2,0,0,0,0|1,0,0]=4 12857 B11R1.34 Cc1cc(cc(c1)CS[13CH3])F 62a_200025704644_100011219130 [1,2,0,0,0,0|1,0,0]=4 12858 B11R1.34 [13CH3]NCc1cc(cc(c1)Br)Br 2230a_100015211796_200025704644 [1,2,0,0,0,0|1,0,0]=4 12859 B11R1.34 [13CH3]NCc1cc(cc(c1)Br)Br 34a_100015211796_200025704644 [1,2,0,0,0,0|1,0,0]=4 12860 B11R1.34 [13CH3]NCc1cc(cc(c1)Br)F 2230a_100020611034_200025704644 [1,2,0,0,0,0|1,0,0]=4 12861 B11R1.34 [13CH3]NCc1cc(cc(c1)Br)F 34a_100020611034_200025704644 [1,2,0,0,0,0|1,0,0]=4 12862 B11R1.34 [13CH3]NCc1cc(cc(c1)Cl)Cl 2230a_100011211636_200025704644 [1,2,0,0,0,0|1,0,0]=4 12863 B11R1.34 [13CH3]NCc1cc(cc(c1)Cl)Cl 34a_100011211636_200025704644 [1,2,0,0,0,0|1,0,0]=4 12864 B11R1.34 [13CH3]NCc1cc(cc(c1)Cl)F 2230a_100137329012_200025704644 [1,2,0,0,0,0|1,0,0]=4 12865 B11R1.34 [13CH3]NCc1cc(cc(c1)Cl)F 34a_100137329012_200025704644 [1,2,0,0,0,0|1,0,0]=4 12866 B11R1.34 [13CH3]NCc1cc(cc(c1)Cl)O 2230a_107254831445_200025704644 [1,2,0,0,0,0|1,0,0]=4 12867 B11R1.34 [13CH3]NCc1cc(cc(c1)Cl)O 34a_107254831445_200025704644 [1,2,0,0,0,0|1,0,0]=4 12868 B11R1.34 [13CH3]NCc1cc(cc(c1)F)F 2230a_100000737602_200025704644 [1,2,0,0,0,0|1,0,0]=4 12869 B11R1.34 [13CH3]NCc1cc(cc(c1)F)F 34a_100000737602_200025704644 [1,2,0,0,0,0|1,0,0]=4 12870 B11R1.34 [13CH3]NCc1cc(cc(c1)F)O 2230a_100160469513_200025704644 [1,2,0,0,0,0|1,0,0]=4 12871 B11R1.34 [13CH3]NCc1cc(cc(c1)F)O 34a_100160469513_200025704644 [1,2,0,0,0,0|1,0,0]=4 12872 B11R1.34 [13CH3]NCc1cc(cc(c1)O)O 2230a_100159270720_200025704644 [1,2,0,0,0,0|1,0,0]=4 12873 B11R1.34 [13CH3]NCc1cc(cc(c1)O)O 34a_100159270720_200025704644 [1,2,0,0,0,0|1,0,0]=4 12874 B11R1.34 [13CH3]OCc1cc(cc(c1)Br)Br 34a_100011218366_200025704644 [1,2,0,0,0,0|1,0,0]=4 12875 B11R1.34 [13CH3]OCc1cc(cc(c1)Br)Br 7a_100011218366_200025704644 [1,2,0,0,0,0|1,0,0]=4 12876 B11R1.34 [13CH3]OCc1cc(cc(c1)Br)Cl 34a_100012353933_200025704644 [1,2,0,0,0,0|1,0,0]=4 12877 B11R1.34 [13CH3]OCc1cc(cc(c1)Br)Cl 7a_100012353933_200025704644 [1,2,0,0,0,0|1,0,0]=4 12878 B11R1.34 [13CH3]OCc1cc(cc(c1)Br)F 34a_100000766897_200025704644 [1,2,0,0,0,0|1,0,0]=4 12879 B11R1.34 [13CH3]OCc1cc(cc(c1)Br)F 7a_100000766897_200025704644 [1,2,0,0,0,0|1,0,0]=4 12880 B11R1.34 [13CH3]OCc1cc(cc(c1)Cl)Cl 34a_100011218629_200025704644 [1,2,0,0,0,0|1,0,0]=4 12881 B11R1.34 [13CH3]OCc1cc(cc(c1)Cl)Cl 7a_100011218629_200025704644 [1,2,0,0,0,0|1,0,0]=4 12882 B11R1.34 [13CH3]OCc1cc(cc(c1)Cl)F 34a_100011217560_200025704644 [1,2,0,0,0,0|1,0,0]=4 12883 B11R1.34 [13CH3]OCc1cc(cc(c1)Cl)F 7a_100011217560_200025704644 [1,2,0,0,0,0|1,0,0]=4 12884 B11R1.34 [13CH3]OCc1cc(cc(c1)Cl)N 34a_100012002482_200025704644 [1,2,0,0,0,0|1,0,0]=4 12885 B11R1.34 [13CH3]OCc1cc(cc(c1)Cl)N 7a_100012002482_200025704644 [1,2,0,0,0,0|1,0,0]=4 12886 B11R1.34 [13CH3]OCc1cc(cc(c1)F)F 34a_100011215443_200025704644 [1,2,0,0,0,0|1,0,0]=4 12887 B11R1.34 [13CH3]OCc1cc(cc(c1)F)F 7a_100011215443_200025704644 [1,2,0,0,0,0|1,0,0]=4 12888 B11R1.34 [13CH3]OCc1cc(cc(c1)I)Br 7a_100009814756_200025704644 [1,2,0,0,0,0|1,0,0]=4 12889 B11R1.34 [13CH3]OCc1cc(cc(c1)I)F 34a_100010149598_200025704644 [1,2,0,0,0,0|1,0,0]=4 12890 B11R1.34 [13CH3]OCc1cc(cc(c1)I)F 7a_100010149598_200025704644 [1,2,0,0,0,0|1,0,0]=4 12891 B11R1.34 [13CH3]OCc1cc(cc(c1)I)I 7a_100010205817_200025704644 [1,2,0,0,0,0|1,0,0]=4 12892 B11R1.34 [13CH3]OCc1cc(cc(c1)N)N 34a_100000032468_200025704644 [1,2,0,0,0,0|1,0,0]=4 12893 B11R1.34 [13CH3]SCc1cc(cc(c1)Br)Br 62a_100011216082_200025704644 [1,2,0,0,0,0|1,0,0]=4 12894 B11R1.34 [13CH3]SCc1cc(cc(c1)Br)Br 62a_200025704644_100011216082 [1,2,0,0,0,0|1,0,0]=4 12895 B11R1.34 [13CH3]SCc1cc(cc(c1)Br)F 62a_100000766940_200025704644 [1,2,0,0,0,0|1,0,0]=4 12896 B11R1.34 [13CH3]SCc1cc(cc(c1)Br)F 62a_200025704644_100000766940 [1,2,0,0,0,0|1,0,0]=4 12897 B11R1.34 [13CH3]SCc1cc(cc(c1)Cl)Cl 62a_100011219208_200025704644 [1,2,0,0,0,0|1,0,0]=4 12898 B11R1.34 [13CH3]SCc1cc(cc(c1)Cl)Cl 62a_200025704644_100011219208 [1,2,0,0,0,0|1,0,0]=4 12899 B11R1.34 [13CH3]SCc1cc(cc(c1)Cl)F 62a_100011219885_200025704644 [1,2,0,0,0,0|1,0,0]=4 12900 B11R1.34 [13CH3]SCc1cc(cc(c1)Cl)F 62a_200025704644_100011219885 [1,2,0,0,0,0|1,0,0]=4 12901 B11R1.34 [13CH3]SCc1cc(cc(c1)F)F 62a_100000697002_200025704644 [1,2,0,0,0,0|1,0,0]=4 12902 B11R1.34 [13CH3]SCc1cc(cc(c1)F)F 62a_200025704644_100000697002 [1,2,0,0,0,0|1,0,0]=4 12903 B11R1.34 [13CH3]SCc1cc(cc(c1)I)Br 62a_100010146614_200025704644 [1,2,0,0,0,0|1,0,0]=4 12904 B11R1.34 [13CH3]SCc1cc(cc(c1)I)Br 62a_200025704644_100010146614 [1,2,0,0,0,0|1,0,0]=4 12905 B11R1.34 [13CH3]SCc1cc(cc(c1)I)F 62a_100010149605_200025704644 [1,2,0,0,0,0|1,0,0]=4 12906 B11R1.34 [13CH3]SCc1cc(cc(c1)I)F 62a_200025704644_100010149605 [1,2,0,0,0,0|1,0,0]=4 12907 B11R1.189 C#Cc1cccc(c1)CNC 207a_100102657272_100011361529 [1,2,0,0,0,0|1,0,0]=4 12908 B11R1.189 C#Cc1cccc(c1)COC 34a_100010272118_200000210301 [1,2,0,0,0,0|1,0,0]=4 12909 B11R1.189 C#Cc1cccc(c1)COC 7a_100010272118_200000210301 [1,2,0,0,0,0|1,0,0]=4 12910 B11R1.189 C#Cc1cccc(c1)CO[13CH3] 34a_100010272118_200025704644 [1,2,0,0,0,0|1,0,0]=4 12911 B11R1.189 C#Cc1cccc(c1)CO[13CH3] 7a_100010272118_200025704644 [1,2,0,0,0,0|1,0,0]=4 12912 B11R1.189 C=CCc1cccc(c1)C=C 271570a_100011290941_100009816576 [1,2,0,0,0,0|0,0,0]=3 12913 B11R1.189 C=CCc1cccc(c1)SC 62a_100009816576_200000210301 [1,2,0,0,0,0|0,0,0]=3 12914 B11R1.189 C=CCc1cccc(c1)SC 62a_200000210301_100009816576 [1,2,0,0,0,0|0,0,0]=3 12915 B11R1.189 C=CCc1cccc(c1)S[13CH3] 62a_100009816576_200025704644 [1,2,0,0,0,0|0,0,0]=3 12916 B11R1.189 C=CCc1cccc(c1)S[13CH3] 62a_200025704644_100009816576 [1,2,0,0,0,0|0,0,0]=3 12917 B11R1.189 C=Cc1cccc(c1)CC=O 271570a_100011290941_200000698211 [1,2,0,0,0,0|1,0,0]=4 12918 B11R1.189 C=Cc1cccc(c1)CCC 271570a_100011290941_100000694964 [1,2,0,0,0,0|0,0,1]=4 12919 B11R1.189 C=Cc1cccc(c1)CNC 26a_100102657272_100011309434 [1,2,0,0,0,0|1,0,0]=4 12920 B11R1.189 C=Cc1cccc(c1)CNC 270004a_106832991635_100011218069 [1,2,0,0,0,0|1,0,0]=4 12921 B11R1.189 C=Cc1cccc(c1)CNC 271570a_100011290941_100000187585 [1,2,0,0,0,0|1,0,0]=4 12922 B11R1.189 C=Cc1cccc(c1)COC 271570a_100011290941_100011493687 [1,2,0,0,0,0|1,0,0]=4 12923 B11R1.189 CC=Cc1cccc(c1)C#N 271570a_100016259895_100000189340 [1,2,0,0,0,0|0,0,1]=4 12924 B11R1.189 CC=Cc1cccc(c1)C=O 271570a_100016259895_100000014684 [1,2,0,0,0,0|0,0,1]=4 12925 B11R1.189 CC=Cc1cccc(c1)CC 271570a_100016259895_100000684523 [1,2,0,0,0,0|0,0,1]=4 12926 B11R1.189 CC=Cc1cccc(c1)CF 271570a_100016259895_100010878472 [1,2,0,0,0,0|0,0,1]=4 12927 B11R1.189 CC=Cc1cccc(c1)CN 271570a_100016259895_100000106179 [1,2,0,0,0,0|0,0,1]=4 12928 B11R1.189 CC=Cc1cccc(c1)CO 271570a_100016259895_100000687537 [1,2,0,0,0,0|0,0,1]=4 12929 B11R1.189 CC=Cc1cccc(c1)NC 271570a_100016259895_100000219648 [1,2,0,0,0,0|0,0,1]=4 12930 B11R1.189 CC=Cc1cccc(c1)NN 271570a_100016259895_100000217339 [1,2,0,0,0,0|0,0,1]=4 12931 B11R1.189 CC=Cc1cccc(c1)OC 271570a_100016259895_100000170001 [1,2,0,0,0,0|0,0,1]=4 12932 B11R1.189 CC=Cc1cccc(c1)SC 271570a_100016259895_100011215954 [1,2,0,0,0,0|0,0,1]=4 12933 B11R1.189 CCCc1cccc(c1)OC 34a_100000039106_200000210301 [1,2,0,0,0,0|0,0,1]=4 12934 B11R1.189 CCCc1cccc(c1)OC 7a_100000039106_200000210301 [1,2,0,0,0,0|0,0,1]=4 12935 B11R1.189 CCCc1cccc(c1)O[13CH3] 34a_100000039106_200025704644 [1,2,0,0,0,0|0,0,1]=4 12936 B11R1.189 CCCc1cccc(c1)O[13CH3] 7a_100000039106_200025704644 [1,2,0,0,0,0|0,0,1]=4 12937 B11R1.189 CCCc1cccc(c1)SC 62a_100000694964_200000210301 [1,2,0,0,0,0|0,0,1]=4 12938 B11R1.189 CCCc1cccc(c1)SC 62a_200000210301_100000694964 [1,2,0,0,0,0|0,0,1]=4 12939 B11R1.189 CCCc1cccc(c1)S[13CH3] 62a_100000694964_200025704644 [1,2,0,0,0,0|0,0,1]=4 12940 B11R1.189 CCCc1cccc(c1)S[13CH3] 62a_200025704644_100000694964 [1,2,0,0,0,0|0,0,1]=4 12941 B11R1.189 CCc1cccc(c1)CNC 207a_100102657272_100011999841 [1,2,0,0,0,0|1,0,0]=4 12942 B11R1.189 CCc1cccc(c1)CNC 26a_100102657272_100000211550 [1,2,0,0,0,0|1,0,0]=4 12943 B11R1.189 CCc1cccc(c1)CNC 270004a_106832991635_100011999841 [1,2,0,0,0,0|1,0,0]=4 12944 B11R1.189 CNCc1cccc(c1)C#N 207a_100102657272_100000241001 [1,2,0,0,0,0|1,0,0]=4 12945 B11R1.189 CNCc1cccc(c1)C#N 2230a_106832991635_100000233786 [1,2,0,0,0,0|1,0,0]=4 12946 B11R1.189 CNCc1cccc(c1)C#N 26a_100102657272_100000184713 [1,2,0,0,0,0|1,0,0]=4 12947 B11R1.189 CNCc1cccc(c1)C#N 270004a_106832991635_100000241001 [1,2,0,0,0,0|1,0,0]=4 12948 B11R1.189 CNCc1cccc(c1)C#N 34a_100000755147_200000210301 [1,2,0,0,0,0|1,0,0]=4 12949 B11R1.189 CNCc1cccc(c1)C#N 34a_100102657272_100000233786 [1,2,0,0,0,0|1,0,0]=4 12950 B11R1.189 CNCc1cccc(c1)C#N 7a_106832991635_100000233786 [1,2,0,0,0,0|1,0,0]=4 12951 B11R1.189 CNCc1cccc(c1)C=O 2230a_106832991635_100009816774 [1,2,0,0,0,0|1,0,0]=4 12952 B11R1.189 CNCc1cccc(c1)C=O 34a_100102657272_100009816774 [1,2,0,0,0,0|1,0,0]=4 12953 B11R1.189 CNCc1cccc(c1)C=O 7a_106832991635_100009816774 [1,2,0,0,0,0|1,0,0]=4 12954 B11R1.189 CNCc1cccc(c1)CBr 26a_100102657272_100011660834 [1,2,0,0,0,0|1,0,0]=4 12955 B11R1.189 CNCc1cccc(c1)CCl 26a_100102657272_100000084143 [1,2,0,0,0,0|1,0,0]=4 12956 B11R1.189 CNCc1cccc(c1)CO 207a_100102657272_200000050894 [1,2,0,0,0,0|1,0,0]=4 12957 B11R1.189 CNCc1cccc(c1)CO 2230a_100011269909_200000210301 [1,2,0,0,0,0|1,0,0]=4 12958 B11R1.189 CNCc1cccc(c1)CO 2230a_106832991635_100010188025 [1,2,0,0,0,0|1,0,0]=4 12959 B11R1.189 CNCc1cccc(c1)CO 26a_100102657272_100011214949 [1,2,0,0,0,0|1,0,0]=4 12960 B11R1.189 CNCc1cccc(c1)CO 270004a_106832991635_200000050894 [1,2,0,0,0,0|1,0,0]=4 12961 B11R1.189 CNCc1cccc(c1)CO 34a_100011269909_200000210301 [1,2,0,0,0,0|1,0,0]=4 12962 B11R1.189 CNCc1cccc(c1)CO 34a_100102657272_100010188025 [1,2,0,0,0,0|1,0,0]=4 12963 B11R1.189 CNCc1cccc(c1)CO 7a_106832991635_100010188025 [1,2,0,0,0,0|1,0,0]=4 12964 B11R1.189 CNCc1cccc(c1)OC 207a_100102657272_100000170238 [1,2,0,0,0,0|1,0,0]=4 12965 B11R1.189 CNCc1cccc(c1)OC 2230a_100000174954_200000210301 [1,2,0,0,0,0|1,0,0]=4 12966 B11R1.189 CNCc1cccc(c1)OC 2230a_106832991635_100000211672 [1,2,0,0,0,0|1,0,0]=4 12967 B11R1.189 CNCc1cccc(c1)OC 26a_100102657272_100000211255 [1,2,0,0,0,0|1,0,0]=4 12968 B11R1.189 CNCc1cccc(c1)OC 270004a_106832991635_100000170238 [1,2,0,0,0,0|1,0,0]=4 12969 B11R1.189 CNCc1cccc(c1)OC 34a_100000174954_200000210301 [1,2,0,0,0,0|1,0,0]=4 12970 B11R1.189 CNCc1cccc(c1)OC 34a_100000207540_200000210301 [1,2,0,0,0,0|1,0,0]=4 12971 B11R1.189 CNCc1cccc(c1)OC 34a_100102657272_100000688526 [1,2,0,0,0,0|1,0,0]=4 12972 B11R1.189 CNCc1cccc(c1)OC 7a_106832991635_100000211672 [1,2,0,0,0,0|1,0,0]=4 12973 B11R1.189 CNCc1cccc(c1)O[13CH3] 34a_100000207540_200025704644 [1,2,0,0,0,0|1,0,0]=4 12974 B11R1.189 CNCc1cccc(c1)SC 207a_100102657272_100011935093 [1,2,0,0,0,0|1,0,0]=4 12975 B11R1.189 CNCc1cccc(c1)SC 26a_100102657272_100011265683 [1,2,0,0,0,0|1,0,0]=4 12976 B11R1.189 CNCc1cccc(c1)SC 270004a_106832991635_100011935093 [1,2,0,0,0,0|1,0,0]=4 12977 B11R1.189 CNCc1cccc(c1)SC 62a_100000187585_200000210301 [1,2,0,0,0,0|1,0,0]=4 12978 B11R1.189 CNCc1cccc(c1)SC 62a_200000210301_100000187585 [1,2,0,0,0,0|1,0,0]=4 12979 B11R1.189 CNCc1cccc(c1)S[13CH3] 62a_100000187585_200025704644 [1,2,0,0,0,0|1,0,0]=4 12980 B11R1.189 CNCc1cccc(c1)S[13CH3] 62a_200025704644_100000187585 [1,2,0,0,0,0|1,0,0]=4 12981 B11R1.189 CNc1cccc(c1)COC 2230a_100000737370_200000210301 [1,2,0,0,0,0|1,0,0]=4 12982 B11R1.189 CNc1cccc(c1)COC 34a_100000737370_200000210301 [1,2,0,0,0,0|1,0,0]=4 12983 B11R1.189 COCc1cccc(c1)C#N 34a_100000753308_200000210301 [1,2,0,0,0,0|1,0,0]=4 12984 B11R1.189 COCc1cccc(c1)C#N 34a_100138415774_100000233786 [1,2,0,0,0,0|1,0,0]=4 12985 B11R1.189 COCc1cccc(c1)C#N 7a_100000753308_200000210301 [1,2,0,0,0,0|1,0,0]=4 12986 B11R1.189 COCc1cccc(c1)C=O 34a_100138415774_100009816774 [1,2,0,0,0,0|1,0,0]=4 12987 B11R1.189 COCc1cccc(c1)CBr 34a_100010188025_200000210301 [1,2,0,0,0,0|1,0,0]=4 12988 B11R1.189 COCc1cccc(c1)CBr 7a_100010188025_200000210301 [1,2,0,0,0,0|1,0,0]=4 12989 B11R1.189 COCc1cccc(c1)CCl 34a_200000090956_200000210301 [1,2,0,0,0,0|1,0,0]=4 12990 B11R1.189 COCc1cccc(c1)CCl 7a_200000090956_200000210301 [1,2,0,0,0,0|1,0,0]=4 12991 B11R1.189 COCc1cccc(c1)CN 34a_100011269909_200000210301 [1,2,0,0,0,0|1,0,0]=4 12992 B11R1.189 COCc1cccc(c1)CO 34a_100138415774_100010188025 [1,2,0,0,0,0|1,0,0]=4 12993 B11R1.189 COCc1cccc(c1)N[13CH3] 2230a_100000737370_200025704644 [1,2,0,0,0,0|1,0,0]=4 12994 B11R1.189 COCc1cccc(c1)N[13CH3] 34a_100000737370_200025704644 [1,2,0,0,0,0|1,0,0]=4 12995 B11R1.189 COCc1cccc(c1)OC 34a_100000198976_200000210301 [1,2,0,0,0,0|1,0,0]=4 12996 B11R1.189 COCc1cccc(c1)OC 34a_100138415774_100000688526 [1,2,0,0,0,0|1,0,0]=4 12997 B11R1.189 COCc1cccc(c1)SC 62a_100011493687_200000210301 [1,2,0,0,0,0|1,0,0]=4 12998 B11R1.189 COCc1cccc(c1)SC 62a_200000210301_100011493687 [1,2,0,0,0,0|1,0,0]=4 12999 B11R1.189 COCc1cccc(c1)S[13CH3] 62a_100011493687_200025704644 [1,2,0,0,0,0|1,0,0]=4 13000 B11R1.189 COCc1cccc(c1)S[13CH3] 62a_200025704644_100011493687 [1,2,0,0,0,0|1,0,0]=4 13001 B11R1.189 COc1cccc(c1)CN[13CH3] 2230a_100000174954_200025704644 [1,2,0,0,0,0|1,0,0]=4 13002 B11R1.189 COc1cccc(c1)CN[13CH3] 34a_100000174954_200025704644 [1,2,0,0,0,0|1,0,0]=4 13003 B11R1.189 COc1cccc(c1)CO[13CH3] 34a_100000198976_200025704644 [1,2,0,0,0,0|1,0,0]=4 13004 B11R1.189 COc1cccc(c1)CSC 62a_100000688526_200000210301 [1,2,0,0,0,0|1,0,0]=4 13005 B11R1.189 COc1cccc(c1)CSC 62a_200000210301_100000211672 [1,2,0,0,0,0|1,0,0]=4 13006 B11R1.189 COc1cccc(c1)CS[13CH3] 62a_100000688526_200025704644 [1,2,0,0,0,0|1,0,0]=4 13007 B11R1.189 COc1cccc(c1)CS[13CH3] 62a_200025704644_100000211672 [1,2,0,0,0,0|1,0,0]=4 13008 B11R1.189 CSCc1cccc(c1)C#N 62a_200000210301_100000233786 [1,2,0,0,0,0|1,0,0]=4 13009 B11R1.189 CSCc1cccc(c1)C=O 62a_100009816774_200000210301 [1,2,0,0,0,0|1,0,0]=4 13010 B11R1.189 CSCc1cccc(c1)C=O 62a_200000210301_100009816774 [1,2,0,0,0,0|1,0,0]=4 13011 B11R1.189 CSCc1cccc(c1)CO 62a_100010188025_200000210301 [1,2,0,0,0,0|1,0,0]=4 13012 B11R1.189 CSCc1cccc(c1)CO 62a_200000210301_100010188025 [1,2,0,0,0,0|1,0,0]=4 13013 B11R1.189 CSc1cccc(c1)CC=O 62a_200000210301_200000698211 [1,2,0,0,0,0|1,0,0]=4 13014 B11R1.189 CSc1cccc(c1)CC=O 62a_200000698211_200000210301 [1,2,0,0,0,0|1,0,0]=4 13015 B11R1.189 [13CH3]NCc1cccc(c1)C#N 34a_100000755147_200025704644 [1,2,0,0,0,0|1,0,0]=4 13016 B11R1.189 [13CH3]NCc1cccc(c1)CO 2230a_100011269909_200025704644 [1,2,0,0,0,0|1,0,0]=4 13017 B11R1.189 [13CH3]NCc1cccc(c1)CO 34a_100011269909_200025704644 [1,2,0,0,0,0|1,0,0]=4 13018 B11R1.189 [13CH3]OCc1cccc(c1)C#N 34a_100000753308_200025704644 [1,2,0,0,0,0|1,0,0]=4 13019 B11R1.189 [13CH3]OCc1cccc(c1)C#N 7a_100000753308_200025704644 [1,2,0,0,0,0|1,0,0]=4 13020 B11R1.189 [13CH3]OCc1cccc(c1)CBr 34a_100010188025_200025704644 [1,2,0,0,0,0|1,0,0]=4 13021 B11R1.189 [13CH3]OCc1cccc(c1)CBr 7a_100010188025_200025704644 [1,2,0,0,0,0|1,0,0]=4 13022 B11R1.189 [13CH3]OCc1cccc(c1)CCl 34a_200000090956_200025704644 [1,2,0,0,0,0|1,0,0]=4 13023 B11R1.189 [13CH3]OCc1cccc(c1)CCl 7a_200000090956_200025704644 [1,2,0,0,0,0|1,0,0]=4 13024 B11R1.189 [13CH3]OCc1cccc(c1)CN 34a_100011269909_200025704644 [1,2,0,0,0,0|1,0,0]=4 13025 B11R1.189 [13CH3]SCc1cccc(c1)C#N 62a_200025704644_100000233786 [1,2,0,0,0,0|1,0,0]=4 13026 B11R1.189 [13CH3]SCc1cccc(c1)C=O 62a_100009816774_200025704644 [1,2,0,0,0,0|1,0,0]=4 13027 B11R1.189 [13CH3]SCc1cccc(c1)C=O 62a_200025704644_100009816774 [1,2,0,0,0,0|1,0,0]=4 13028 B11R1.189 [13CH3]SCc1cccc(c1)CO 62a_100010188025_200025704644 [1,2,0,0,0,0|1,0,0]=4 13029 B11R1.189 [13CH3]SCc1cccc(c1)CO 62a_200025704644_100010188025 [1,2,0,0,0,0|1,0,0]=4 13030 B11R1.189 [13CH3]Sc1cccc(c1)CC=O 62a_200000698211_200025704644 [1,2,0,0,0,0|1,0,0]=4 13031 B11R1.189 [13CH3]Sc1cccc(c1)CC=O 62a_200025704644_200000698211 [1,2,0,0,0,0|1,0,0]=4 13032 B11R1.7 CC(C)(N[13CH3])c1ccccc1 2230a_100011218174_200025704644 [1,2,0,0,0,0|1,0,0]=4 13033 B11R1.7 CC(C)(O[13CH3])c1ccccc1 7a_100000694644_200025704644 [1,2,0,0,0,0|1,0,0]=4 13034 B11R1.7 CC(C)(S[13CH3])c1ccccc1 62a_100000034625_200025704644 [1,2,0,0,0,0|1,0,0]=4 13035 B11R1.7 CC(C)(S[13CH3])c1ccccc1 62a_200025704644_100000034625 [1,2,0,0,0,0|1,0,0]=4 13036 B11R1.7 CNC(C)(C)c1ccccc1 2230a_100011218174_200000210301 [1,2,0,0,0,0|1,0,0]=4 13037 B11R1.7 CNC(C)(C)c1ccccc1 2230a_106832991635_100000034625 [1,2,0,0,0,0|1,0,0]=4 13038 B11R1.7 CNC(F)(F)c1ccccc1 7a_106832991635_100000036403 [1,2,0,0,0,0|1,0,0]=4 13039 B11R1.7 COC(C)(C)c1ccccc1 7a_100000694644_200000210301 [1,2,0,0,0,0|1,0,0]=4 13040 B11R1.7 CSC(C)(C)c1ccccc1 62a_100000034625_200000210301 [1,2,0,0,0,0|1,0,0]=4 13041 B11R1.7 CSC(C)(C)c1ccccc1 62a_200000210301_100000034625 [1,2,0,0,0,0|1,0,0]=4 13042 B11R1.7 CSC(F)(F)c1ccccc1 62a_200000210301_100000036403 [1,2,0,0,0,0|1,0,0]=4 13043 B11R1.7 [13CH3]SC(F)(F)c1ccccc1 62a_200025704644_100000036403 [1,2,0,0,0,0|1,0,0]=4 13044 B11R1.12 C#CC(OC)c1ccccc1 34a_100011219616_200000210301 [1,2,0,0,0,0|1,0,0]=4 13045 B11R1.12 C#CC(OC)c1ccccc1 7a_100011219616_200000210301 [1,2,0,0,0,0|1,0,0]=4 13046 B11R1.12 C#CC(O[13CH3])c1ccccc1 34a_100011219616_200025704644 [1,2,0,0,0,0|1,0,0]=4 13047 B11R1.12 C#CC(O[13CH3])c1ccccc1 7a_100011219616_200025704644 [1,2,0,0,0,0|1,0,0]=4 13048 B11R1.12 C=CC(NC)c1ccccc1 2230a_106832991635_200000085779 [1,2,0,0,0,0|0,0,0]=3 13049 B11R1.12 C=CC(OC)c1ccccc1 34a_100011215659_200000210301 [1,2,0,0,0,0|0,0,0]=3 13050 B11R1.12 C=CC(OC)c1ccccc1 7a_100011215659_200000210301 [1,2,0,0,0,0|0,0,0]=3 13051 B11R1.12 C=CC(O[13CH3])c1ccccc1 34a_100011215659_200025704644 [1,2,0,0,0,0|0,0,0]=3 13052 B11R1.12 C=CC(O[13CH3])c1ccccc1 7a_100011215659_200025704644 [1,2,0,0,0,0|0,0,0]=3 13053 B11R1.12 C=CC(SC)c1ccccc1 62a_200000085779_200000210301 [1,2,0,0,0,0|0,0,0]=3 13054 B11R1.12 C=CC(SC)c1ccccc1 62a_200000210301_200000085779 [1,2,0,0,0,0|0,0,0]=3 13055 B11R1.12 C=CC(S[13CH3])c1ccccc1 62a_200000085779_200025704644 [1,2,0,0,0,0|0,0,0]=3 13056 B11R1.12 C=CC(S[13CH3])c1ccccc1 62a_200025704644_200000085779 [1,2,0,0,0,0|0,0,0]=3 13057 B11R1.12 CCC(NC)c1ccccc1 2230a_100000737752_200000210301 [1,2,0,0,0,0|0,0,1]=4 13058 B11R1.12 CCC(NC)c1ccccc1 269862a_106832991636_100000210124 [1,2,0,0,0,0|0,0,1]=4 13059 B11R1.12 CCC(N[13CH3])c1ccccc1 2230a_100000737752_200025704644 [1,2,0,0,0,0|0,0,1]=4 13060 B11R1.12 CCC(OC)c1ccccc1 34a_100000698172_200000210301 [1,2,0,0,0,0|0,0,1]=4 13061 B11R1.12 CCC(OC)c1ccccc1 7a_100000698172_200000210301 [1,2,0,0,0,0|0,0,1]=4 13062 B11R1.12 CCC(O[13CH3])c1ccccc1 34a_100000698172_200025704644 [1,2,0,0,0,0|0,0,1]=4 13063 B11R1.12 CCC(O[13CH3])c1ccccc1 7a_100000698172_200025704644 [1,2,0,0,0,0|0,0,1]=4 13064 B11R1.12 CN[C@H](CO)c1ccccc1 2230a_100000751927_200000210301 [1,2,0,0,0,0|1,0,0]=4 13065 B11R1.12 CN[C@H](CO)c1ccccc1 34a_100000751927_200000210301 [1,2,0,0,0,0|1,0,0]=4 13066 B11R1.12 COC(C#N)c1ccccc1 7a_100011217353_200000210301 [1,2,0,0,0,0|1,0,0]=4 13067 B11R1.12 COC(CBr)c1ccccc1 7a_100000185958_200000210301 [1,2,0,0,0,0|1,0,0]=4 13068 B11R1.12 COC(CN)c1ccccc1 34a_100000210709_200000210301 [1,2,0,0,0,0|1,0,0]=4 13069 B11R1.12 CO[C@H](CCl)c1ccccc1 34a_100011933945_200000210301 [1,2,0,0,0,0|1,0,0]=4 13070 B11R1.12 CO[C@H](CCl)c1ccccc1 7a_100011933945_200000210301 [1,2,0,0,0,0|1,0,0]=4 13071 B11R1.12 [13CH3]N[C@H](CO)c1ccccc1 2230a_100000751927_200025704644 [1,2,0,0,0,0|1,0,0]=4 13072 B11R1.12 [13CH3]N[C@H](CO)c1ccccc1 34a_100000751927_200025704644 [1,2,0,0,0,0|1,0,0]=4 13073 B11R1.12 [13CH3]OC(C#N)c1ccccc1 7a_100011217353_200025704644 [1,2,0,0,0,0|1,0,0]=4 13074 B11R1.12 [13CH3]OC(CBr)c1ccccc1 7a_100000185958_200025704644 [1,2,0,0,0,0|1,0,0]=4 13075 B11R1.12 [13CH3]OC(CN)c1ccccc1 34a_100000210709_200025704644 [1,2,0,0,0,0|1,0,0]=4 13076 B11R1.12 [13CH3]O[C@H](CCl)c1ccccc1 34a_100011933945_200025704644 [1,2,0,0,0,0|1,0,0]=4 13077 B11R1.12 [13CH3]O[C@H](CCl)c1ccccc1 7a_100011933945_200025704644 [1,2,0,0,0,0|1,0,0]=4 13078 B11R1.16 C=CCC(=O)c1ccccc1 1458a_100000185807_100000210623 [1,2,0,0,0,0|0,0,0]=3 13079 B11R1.16 C=CCN(C)c1ccccc1 2230a_100000210012_100000210623 [1,2,0,0,0,0|0,0,0]=3 13080 B11R1.16 C=CCN(C)c1ccccc1 2230a_100000211662_200000210301 [1,2,0,0,0,0|0,0,0]=3 13081 B11R1.16 C=CCN(C)c1ccccc1 269982a_100000210012_100000210623 [1,2,0,0,0,0|0,0,0]=3 13082 B11R1.16 C=CCN(C)c1ccccc1 269982a_100000211662_200000210301 [1,2,0,0,0,0|0,0,0]=3 13083 B11R1.16 C=CCN(C)c1ccccc1 34a_100000210012_100015514636 [1,2,0,0,0,0|0,0,0]=3 13084 B11R1.16 C=CCN(C)c1ccccc1 34a_100000211662_200000210301 [1,2,0,0,0,0|0,0,0]=3 13085 B11R1.16 C=CCN([13CH3])c1ccccc1 2230a_100000211662_200025704644 [1,2,0,0,0,0|0,0,0]=3 13086 B11R1.16 C=CCN([13CH3])c1ccccc1 269982a_100000211662_200025704644 [1,2,0,0,0,0|0,0,0]=3 13087 B11R1.16 C=CCN([13CH3])c1ccccc1 34a_100000211662_200025704644 [1,2,0,0,0,0|0,0,0]=3 13088 B11R1.16 CC(CN[13CH3])c1ccccc1 2230a_100000701038_200025704644 [1,2,0,0,0,0|0,0,1]=4 13089 B11R1.16 CC(CN[13CH3])c1ccccc1 34a_100000701038_200025704644 [1,2,0,0,0,0|0,0,1]=4 13090 B11R1.16 CC(CO[13CH3])c1ccccc1 34a_100011215166_200025704644 [1,2,0,0,0,0|0,0,1]=4 13091 B11R1.16 CC(CO[13CH3])c1ccccc1 7a_100011215166_200025704644 [1,2,0,0,0,0|0,0,1]=4 13092 B11R1.16 CC(CS[13CH3])c1ccccc1 62a_100000756946_200025704644 [1,2,0,0,0,0|0,0,1]=4 13093 B11R1.16 CC(CS[13CH3])c1ccccc1 62a_200025704644_100000756946 [1,2,0,0,0,0|0,0,1]=4 13094 B11R1.16 CC(SCF)c1ccccc1 62a_100000230085_100015361967 [1,2,0,0,0,0|1,0,0]=4 13095 B11R1.16 CC(SCF)c1ccccc1 62a_100015361967_100000230085 [1,2,0,0,0,0|1,0,0]=4 13096 B11R1.16 CCCC(=O)c1ccccc1 1458a_100000185807_100000210303 [1,2,0,0,0,0|0,0,1]=4 13097 B11R1.16 CCCN(C)c1ccccc1 2230a_100000210012_100000210303 [1,2,0,0,0,0|0,0,1]=4 13098 B11R1.16 CCCN(C)c1ccccc1 2230a_200011218496_200000210301 [1,2,0,0,0,0|0,0,1]=4 13099 B11R1.16 CCCN(C)c1ccccc1 269982a_100000210012_100000210303 [1,2,0,0,0,0|0,0,1]=4 13100 B11R1.16 CCCN(C)c1ccccc1 269982a_200011218496_200000210301 [1,2,0,0,0,0|0,0,1]=4 13101 B11R1.16 CCCN(C)c1ccccc1 34a_100000210012_100000210303 [1,2,0,0,0,0|0,0,1]=4 13102 B11R1.16 CCCN(C)c1ccccc1 34a_200011218496_200000210301 [1,2,0,0,0,0|0,0,1]=4 13103 B11R1.16 CCCN([13CH3])c1ccccc1 2230a_200011218496_200025704644 [1,2,0,0,0,0|0,0,1]=4 13104 B11R1.16 CCCN([13CH3])c1ccccc1 269982a_200011218496_200025704644 [1,2,0,0,0,0|0,0,1]=4 13105 B11R1.16 CCCN([13CH3])c1ccccc1 34a_200011218496_200025704644 [1,2,0,0,0,0|0,0,1]=4 13106 B11R1.16 CCNC(C)c1ccccc1 2230a_100015525214_100000230085 [1,2,0,0,0,0|0,0,1]=4 13107 B11R1.16 CCNC(C)c1ccccc1 269862a_100015525214_100000185851 [1,2,0,0,0,0|0,0,1]=4 13108 B11R1.16 CCN[C@H](C)c1ccccc1 2230a_100000751104_100000210202 [1,2,0,0,0,0|0,0,1]=4 13109 B11R1.16 CCOC(C)c1ccccc1 34a_100121572206_100000211855 [1,2,0,0,0,0|0,0,1]=4 13110 B11R1.16 CCO[C@H](C)c1ccccc1 34a_100000761318_100000210202 [1,2,0,0,0,0|0,0,1]=4 13111 B11R1.16 CCO[C@H](C)c1ccccc1 7a_100000761318_100000210202 [1,2,0,0,0,0|0,0,1]=4 13112 B11R1.16 CCSC(C)c1ccccc1 62a_100000210202_100000230085 [1,2,0,0,0,0|0,0,1]=4 13113 B11R1.16 CCSC(C)c1ccccc1 62a_100000230085_100000210202 [1,2,0,0,0,0|0,0,1]=4 13114 B11R1.16 CN(CC=O)c1ccccc1 2230a_100000210012_200015260668 [1,2,0,0,0,0|1,0,0]=4 13115 B11R1.16 CN(CC=O)c1ccccc1 269982a_100000210012_200015260668 [1,2,0,0,0,0|1,0,0]=4 13116 B11R1.16 CN(CC=O)c1ccccc1 34a_100000210012_200009817547 [1,2,0,0,0,0|1,0,0]=4 13117 B11R1.16 CNCC(=O)c1ccccc1 7a_106832991635_100000211460 [1,2,0,0,0,0|1,0,0]=4 13118 B11R1.16 CNCC(C)c1ccccc1 2230a_100000701038_200000210301 [1,2,0,0,0,0|0,0,1]=4 13119 B11R1.16 CNCC(C)c1ccccc1 2230a_106832991635_100000756946 [1,2,0,0,0,0|0,0,1]=4 13120 B11R1.16 CNCC(C)c1ccccc1 270004a_106832991635_100000212034 [1,2,0,0,0,0|0,0,1]=4 13121 B11R1.16 CNCC(C)c1ccccc1 34a_100000701038_200000210301 [1,2,0,0,0,0|0,0,1]=4 13122 B11R1.16 CNCC(C)c1ccccc1 34a_100102657272_100000756946 [1,2,0,0,0,0|0,0,1]=4 13123 B11R1.16 CNCC(C)c1ccccc1 7a_106832991635_100000756946 [1,2,0,0,0,0|0,0,1]=4 13124 B11R1.16 CNCC(O)c1ccccc1 2230a_100000210709_200000210301 [1,2,0,0,0,0|0,0,1]=4 13125 B11R1.16 CNCC(O)c1ccccc1 2230a_106832991635_100000185958 [1,2,0,0,0,0|0,0,1]=4 13126 B11R1.16 CNCC(O)c1ccccc1 34a_100102657272_100000185958 [1,2,0,0,0,0|0,0,1]=4 13127 B11R1.16 CNCC(O)c1ccccc1 7a_106832991635_100000185958 [1,2,0,0,0,0|0,0,1]=4 13128 B11R1.16 CNC[C@@H](O)c1ccccc1 2230a_106832991635_100011933945 [1,2,0,0,0,0|0,0,1]=4 13129 B11R1.16 CNC[C@@H](O)c1ccccc1 34a_100102657272_100011933945 [1,2,0,0,0,0|0,0,1]=4 13130 B11R1.16 CNC[C@@H](O)c1ccccc1 7a_106832991635_100011933945 [1,2,0,0,0,0|0,0,1]=4 13131 B11R1.16 COCC(C)c1ccccc1 34a_100011215166_200000210301 [1,2,0,0,0,0|0,0,1]=4 13132 B11R1.16 COCC(C)c1ccccc1 34a_100138415774_100000756946 [1,2,0,0,0,0|0,0,1]=4 13133 B11R1.16 COCC(C)c1ccccc1 7a_100011215166_200000210301 [1,2,0,0,0,0|0,0,1]=4 13134 B11R1.16 COCC(O)c1ccccc1 34a_100138415774_100000185958 [1,2,0,0,0,0|0,0,1]=4 13135 B11R1.16 COCN(C)c1ccccc1 2230a_100000210012_100000766300 [1,2,0,0,0,0|1,0,0]=4 13136 B11R1.16 COCN(C)c1ccccc1 269982a_100000210012_100000766300 [1,2,0,0,0,0|1,0,0]=4 13137 B11R1.16 COC[C@@H](N)c1ccccc1 34a_100000751927_200000210301 [1,2,0,0,0,0|0,0,1]=4 13138 B11R1.16 COC[C@@H](O)c1ccccc1 34a_100138415774_100011933945 [1,2,0,0,0,0|0,0,1]=4 13139 B11R1.16 CSCC(=O)c1ccccc1 62a_100000211460_200000210301 [1,2,0,0,0,0|1,0,0]=4 13140 B11R1.16 CSCC(=O)c1ccccc1 62a_200000210301_100000211460 [1,2,0,0,0,0|1,0,0]=4 13141 B11R1.16 CSCC(C)c1ccccc1 62a_100000756946_200000210301 [1,2,0,0,0,0|0,0,1]=4 13142 B11R1.16 CSCC(C)c1ccccc1 62a_200000210301_100000756946 [1,2,0,0,0,0|0,0,1]=4 13143 B11R1.16 CSCC(O)c1ccccc1 62a_100000185958_200000210301 [1,2,0,0,0,0|0,0,1]=4 13144 B11R1.16 CSCC(O)c1ccccc1 62a_200000210301_100000185958 [1,2,0,0,0,0|0,0,1]=4 13145 B11R1.16 CSCN(C)c1ccccc1 2230a_100000210012_100011218213 [1,2,0,0,0,0|1,0,0]=4 13146 B11R1.16 CSCN(C)c1ccccc1 269982a_100000210012_100011218213 [1,2,0,0,0,0|1,0,0]=4 13147 B11R1.16 CSCN(C)c1ccccc1 34a_100000210012_100011218213 [1,2,0,0,0,0|1,0,0]=4 13148 B11R1.16 CSCS(=O)c1ccccc1 62a_200000210301_100000031784 [1,2,0,0,0,0|1,0,0]=4 13149 B11R1.16 CSC[C@@H](O)c1ccccc1 62a_100011933945_200000210301 [1,2,0,0,0,0|0,0,1]=4 13150 B11R1.16 CSC[C@@H](O)c1ccccc1 62a_200000210301_100011933945 [1,2,0,0,0,0|0,0,1]=4 13151 B11R1.16 C[C@@H](OCF)c1ccccc1 34a_100000761318_100015361967 [1,2,0,0,0,0|1,0,0]=4 13152 B11R1.16 C[C@@H](OCF)c1ccccc1 7a_100000761318_100015361967 [1,2,0,0,0,0|1,0,0]=4 13153 B11R1.16 [13CH3]NCC(O)c1ccccc1 2230a_100000210709_200025704644 [1,2,0,0,0,0|0,0,1]=4 13154 B11R1.16 [13CH3]OC[C@@H](N)c1ccccc1 34a_100000751927_200025704644 [1,2,0,0,0,0|0,0,1]=4 13155 B11R1.16 [13CH3]SCC(=O)c1ccccc1 62a_100000211460_200025704644 [1,2,0,0,0,0|1,0,0]=4 13156 B11R1.16 [13CH3]SCC(=O)c1ccccc1 62a_200025704644_100000211460 [1,2,0,0,0,0|1,0,0]=4 13157 B11R1.16 [13CH3]SCC(O)c1ccccc1 62a_100000185958_200025704644 [1,2,0,0,0,0|0,0,1]=4 13158 B11R1.16 [13CH3]SCC(O)c1ccccc1 62a_200025704644_100000185958 [1,2,0,0,0,0|0,0,1]=4 13159 B11R1.16 [13CH3]SCS(=O)c1ccccc1 62a_200025704644_100000031784 [1,2,0,0,0,0|1,0,0]=4 13160 B11R1.16 [13CH3]SC[C@@H](O)c1ccccc1 62a_100011933945_200025704644 [1,2,0,0,0,0|0,0,1]=4 13161 B11R1.16 [13CH3]SC[C@@H](O)c1ccccc1 62a_200025704644_100011933945 [1,2,0,0,0,0|0,0,1]=4 13162 B11R1.28 BrCCOCc1ccccc1 34a_100000211926_100015291786 [1,2,0,0,0,0|0,0,1]=4 13163 B11R1.28 C#CCNCc1ccccc1 2230a_100015324214_100000038162 [1,2,0,0,0,0|1,0,0]=4 13164 B11R1.28 C#CCNCc1ccccc1 34a_100000212058_100015291786 [1,2,0,0,0,0|1,0,0]=4 13165 B11R1.28 C#CCNCc1ccccc1 34a_100015324214_100000184674 [1,2,0,0,0,0|1,0,0]=4 13166 B11R1.28 C#CCOCc1ccccc1 34a_100000210247_100015291786 [1,2,0,0,0,0|1,0,0]=4 13167 B11R1.28 C#CCOCc1ccccc1 34a_100000210790_100000184674 [1,2,0,0,0,0|1,0,0]=4 13168 B11R1.28 C#CCOCc1ccccc1 7a_100000210790_100000038162 [1,2,0,0,0,0|1,0,0]=4 13169 B11R1.28 C#CCSCc1ccccc1 62a_100000038162_100015291786 [1,2,0,0,0,0|1,0,0]=4 13170 B11R1.28 C/C=C/CNc1ccccc1 34a_100000106764_100102629194 [1,2,0,0,0,0|0,0,0]=3 13171 B11R1.28 C/C=C/COc1ccccc1 34a_100000210340_100102629194 [1,2,0,0,0,0|0,0,0]=3 13172 B11R1.28 C/C=C/COc1ccccc1 7a_100000210340_100102629194 [1,2,0,0,0,0|0,0,0]=3 13173 B11R1.28 C/C=C/COc1cccnc1 34a_100000210849_100102629194 [1,2,0,0,0,0|1,0,0]=4 13174 B11R1.28 C/C=C/COc1cccnc1 7a_100000210849_100102629194 [1,2,0,0,0,0|1,0,0]=4 13175 B11R1.28 C/C=C/COc1ccncc1 34a_100000212176_100102629194 [1,2,0,0,0,0|1,0,0]=4 13176 B11R1.28 C/C=C/CSc1ccccc1 62a_100000719477_100102629194 [1,2,0,0,0,0|0,0,0]=3 13177 B11R1.28 C/C=C/CSc1ccccc1 62a_100102629194_100000041952 [1,2,0,0,0,0|0,0,0]=3 13178 B11R1.28 C/C=C/CSc1ccccn1 62a_100011216584_100102629194 [1,2,0,0,0,0|1,0,0]=4 13179 B11R1.28 C/C=C/CSc1ccccn1 62a_100102629194_100011216584 [1,2,0,0,0,0|1,0,0]=4 13180 B11R1.28 C/C=C/CSc1cccnc1 62a_100000210063_100102629194 [1,2,0,0,0,0|1,0,0]=4 13181 B11R1.28 C/C=C/CSc1cccnc1 62a_100102629194_100000210063 [1,2,0,0,0,0|1,0,0]=4 13182 B11R1.28 C/C=C/CSc1ccncc1 62a_100000728582_100102629194 [1,2,0,0,0,0|1,0,0]=4 13183 B11R1.28 C/C=C/CSc1ccncc1 62a_100102629194_100000728582 [1,2,0,0,0,0|1,0,0]=4 13184 B11R1.28 C=CCCNc1ccccc1 34a_100000106764_100000754431 [1,2,0,0,0,0|0,0,0]=3 13185 B11R1.28 C=CCCOc1ccccc1 34a_100000210340_100000754431 [1,2,0,0,0,0|0,0,0]=3 13186 B11R1.28 C=CCCOc1ccccc1 7a_100000210340_100000754431 [1,2,0,0,0,0|0,0,0]=3 13187 B11R1.28 C=CCCOc1cccnc1 34a_100000210849_100000754431 [1,2,0,0,0,0|1,0,0]=4 13188 B11R1.28 C=CCCOc1cccnc1 7a_100000210849_100000754431 [1,2,0,0,0,0|1,0,0]=4 13189 B11R1.28 C=CCCOc1ccncc1 34a_100000212176_100000754431 [1,2,0,0,0,0|1,0,0]=4 13190 B11R1.28 C=CCCSc1ccccc1 62a_100000719477_100000754431 [1,2,0,0,0,0|0,0,0]=3 13191 B11R1.28 C=CCCSc1ccccc1 62a_100000754431_100000041952 [1,2,0,0,0,0|0,0,0]=3 13192 B11R1.28 C=CCCSc1ccccn1 62a_100000754431_100011216584 [1,2,0,0,0,0|1,0,0]=4 13193 B11R1.28 C=CCCSc1ccccn1 62a_100011216584_100000754431 [1,2,0,0,0,0|1,0,0]=4 13194 B11R1.28 C=CCCSc1cccnc1 62a_100000210063_100000754431 [1,2,0,0,0,0|1,0,0]=4 13195 B11R1.28 C=CCCSc1cccnc1 62a_100000754431_100000210063 [1,2,0,0,0,0|1,0,0]=4 13196 B11R1.28 C=CCCSc1ccncc1 62a_100000728582_100000754431 [1,2,0,0,0,0|1,0,0]=4 13197 B11R1.28 C=CCCSc1ccncc1 62a_100000754431_100000728582 [1,2,0,0,0,0|1,0,0]=4 13198 B11R1.28 C=CCNCc1ccccc1 2230a_100015324214_100000210623 [1,2,0,0,0,0|0,0,0]=3 13199 B11R1.28 C=CCNCc1ccccc1 2230a_100020586998_100015291786 [1,2,0,0,0,0|0,0,0]=3 13200 B11R1.28 C=CCNCc1ccccc1 270004a_100020586998_100015611070 [1,2,0,0,0,0|0,0,0]=3 13201 B11R1.28 C=CCNCc1ccccc1 34a_100015324214_100015514636 [1,2,0,0,0,0|0,0,0]=3 13202 B11R1.28 C=CCNCc1ccccn1 2230a_100020586998_100000721315 [1,2,0,0,0,0|1,0,0]=4 13203 B11R1.28 C=CCNCc1ccccn1 270004a_100020586998_100000209966 [1,2,0,0,0,0|1,0,0]=4 13204 B11R1.28 C=CCNCc1cccnc1 2230a_100020586998_100000741622 [1,2,0,0,0,0|1,0,0]=4 13205 B11R1.28 C=CCNCc1cccnc1 270004a_100020586998_100000209961 [1,2,0,0,0,0|1,0,0]=4 13206 B11R1.28 C=CCNCc1ccncc1 2230a_100020586998_100015193705 [1,2,0,0,0,0|1,0,0]=4 13207 B11R1.28 C=CCOCc1ccccc1 34a_100000210790_100015514636 [1,2,0,0,0,0|0,0,0]=3 13208 B11R1.28 C=CCOCc1ccccc1 34a_200000210373_100015291786 [1,2,0,0,0,0|0,0,0]=3 13209 B11R1.28 C=CCOCc1ccccc1 7a_100000210790_100015514636 [1,2,0,0,0,0|0,0,0]=3 13210 B11R1.28 C=CCOCc1ccccn1 34a_200000210373_100000721315 [1,2,0,0,0,0|1,0,0]=4 13211 B11R1.28 C=CCOCc1cccnc1 34a_200000210373_100000733263 [1,2,0,0,0,0|1,0,0]=4 13212 B11R1.28 C=CCSCc1ccccc1 62a_100000210623_100015291786 [1,2,0,0,0,0|0,0,0]=3 13213 B11R1.28 C=CCSCc1ccccc1 62a_100000211182_100000210623 [1,2,0,0,0,0|0,0,0]=3 13214 B11R1.28 C=CCSCc1ccccn1 62a_100000210623_100000721315 [1,2,0,0,0,0|1,0,0]=4 13215 B11R1.28 C=CCSCc1ccccn1 62a_100000721315_100000210623 [1,2,0,0,0,0|1,0,0]=4 13216 B11R1.28 C=CCSCc1cccnc1 62a_100000210623_100000741622 [1,2,0,0,0,0|1,0,0]=4 13217 B11R1.28 C=CCSCc1cccnc1 62a_100000741622_100000210623 [1,2,0,0,0,0|1,0,0]=4 13218 B11R1.28 C=CCSCc1ccncc1 62a_100000210623_100015193705 [1,2,0,0,0,0|1,0,0]=4 13219 B11R1.28 C=CCSCc1ccncc1 62a_100015193705_100000210623 [1,2,0,0,0,0|1,0,0]=4 13220 B11R1.28 CC#CCNc1ccccc1 34a_100000106764_100000748600 [1,2,0,0,0,0|0,0,1]=4 13221 B11R1.28 CC#CCOc1ccccc1 34a_100000210340_100000748600 [1,2,0,0,0,0|0,0,1]=4 13222 B11R1.28 CC#CCOc1ccccc1 7a_100000210340_100000748600 [1,2,0,0,0,0|0,0,1]=4 13223 B11R1.28 CC#CCSc1ccccc1 62a_100000719477_100000748600 [1,2,0,0,0,0|0,0,1]=4 13224 B11R1.28 CC#CCSc1ccccc1 62a_100000748600_100000041952 [1,2,0,0,0,0|0,0,1]=4 13225 B11R1.28 CC=CCNc1ccccc1 34a_100000106764_100000070051 [1,2,0,0,0,0|0,0,0]=3 13226 B11R1.28 CC=CCOc1ccccc1 34a_100000210340_100000070051 [1,2,0,0,0,0|0,0,0]=3 13227 B11R1.28 CC=CCOc1ccccc1 7a_100000210340_100000070051 [1,2,0,0,0,0|0,0,0]=3 13228 B11R1.28 CC=CCOc1cccnc1 34a_100000210849_100000070051 [1,2,0,0,0,0|1,0,0]=4 13229 B11R1.28 CC=CCOc1cccnc1 7a_100000210849_100000070051 [1,2,0,0,0,0|1,0,0]=4 13230 B11R1.28 CC=CCOc1ccncc1 34a_100000212176_100000070051 [1,2,0,0,0,0|1,0,0]=4 13231 B11R1.28 CC=CCSc1ccccc1 62a_100000070051_100000041952 [1,2,0,0,0,0|0,0,0]=3 13232 B11R1.28 CC=CCSc1ccccc1 62a_100000719477_100000070051 [1,2,0,0,0,0|0,0,0]=3 13233 B11R1.28 CC=CCSc1ccccn1 62a_100000070051_100011216584 [1,2,0,0,0,0|1,0,0]=4 13234 B11R1.28 CC=CCSc1ccccn1 62a_100011216584_100000070051 [1,2,0,0,0,0|1,0,0]=4 13235 B11R1.28 CC=CCSc1cccnc1 62a_100000070051_100000210063 [1,2,0,0,0,0|1,0,0]=4 13236 B11R1.28 CC=CCSc1cccnc1 62a_100000210063_100000070051 [1,2,0,0,0,0|1,0,0]=4 13237 B11R1.28 CC=CCSc1ccncc1 62a_100000070051_100000728582 [1,2,0,0,0,0|1,0,0]=4 13238 B11R1.28 CC=CCSc1ccncc1 62a_100000728582_100000070051 [1,2,0,0,0,0|1,0,0]=4 13239 B11R1.28 CC=NNCc1ccccc1 4a_100000007032_200000210099 [1,2,0,0,0,0|0,0,0]=3 13240 B11R1.28 CC=NNCc1ccccn1 4a_100000736832_200000210099 [1,2,0,0,0,0|1,0,0]=4 13241 B11R1.28 CC=NNCc1cccnc1 4a_100000738295_200000210099 [1,2,0,0,0,0|1,0,0]=4 13242 B11R1.28 CC=NNCc1ccncc1 4a_100000736929_200000210099 [1,2,0,0,0,0|1,0,0]=4 13243 B11R1.28 CCC=NNc1ccccc1 4a_100015195140_100000210100 [1,2,0,0,0,0|1,0,0]=4 13244 B11R1.28 CCCC=Cc1ccccc1 271570a_100016258520_100000210277 [1,2,0,0,0,0|0,0,1]=4 13245 B11R1.28 CCCCNc1ccccc1 34a_100000106764_100000210210 [1,2,0,0,0,0|0,0,1]=4 13246 B11R1.28 CCCCOc1ccccc1 34a_100000210340_100000210210 [1,2,0,0,0,0|0,0,1]=4 13247 B11R1.28 CCCCOc1ccccc1 7a_100000210340_100000210211 [1,2,0,0,0,0|0,0,1]=4 13248 B11R1.28 CCCCSc1ccccc1 62a_100000210211_100000041952 [1,2,0,0,0,0|0,0,1]=4 13249 B11R1.28 CCCCSc1ccccc1 62a_100000719477_100000210210 [1,2,0,0,0,0|0,0,1]=4 13250 B11R1.28 CCCNCc1ccccc1 207a_100020643023_100015611070 [1,2,0,0,0,0|0,0,1]=4 13251 B11R1.28 CCCNCc1ccccc1 2230a_100015324214_100000210303 [1,2,0,0,0,0|0,0,1]=4 13252 B11R1.28 CCCNCc1ccccc1 270004a_100020643023_100015611070 [1,2,0,0,0,0|0,0,1]=4 13253 B11R1.28 CCCNCc1ccccc1 34a_100015324214_100000210303 [1,2,0,0,0,0|0,0,1]=4 13254 B11R1.28 CCCOCc1ccccc1 34a_100000210258_100015291786 [1,2,0,0,0,0|0,0,1]=4 13255 B11R1.28 CCCOCc1ccccc1 34a_100000210790_100000210303 [1,2,0,0,0,0|0,0,1]=4 13256 B11R1.28 CCCOCc1ccccc1 7a_100000210790_100000210303 [1,2,0,0,0,0|0,0,1]=4 13257 B11R1.28 CCCSCc1ccccc1 62a_100000210303_100015291786 [1,2,0,0,0,0|0,0,1]=4 13258 B11R1.28 CCCSCc1ccccc1 62a_100000211182_100000210303 [1,2,0,0,0,0|0,0,1]=4 13259 B11R1.28 CCNCCc1ccccc1 2230a_100000106460_100000210202 [1,2,0,0,0,0|0,0,1]=4 13260 B11R1.28 CCNCCc1ccccc1 2230a_100015525214_100000765856 [1,2,0,0,0,0|0,0,1]=4 13261 B11R1.28 CCNCCc1ccccc1 34a_100000106460_100000210202 [1,2,0,0,0,0|0,0,1]=4 13262 B11R1.28 CCNCSc1ccccc1 2230a_100015525214_100011218342 [1,2,0,0,0,0|0,0,1]=4 13263 B11R1.28 CCOC=Cc1ccccc1 271570a_100016256518_100000210277 [1,2,0,0,0,0|0,0,1]=4 13264 B11R1.28 CCOCCc1ccccc1 34a_100000210268_100000210202 [1,2,0,0,0,0|0,0,1]=4 13265 B11R1.28 CCOCCc1ccccc1 34a_100121572206_100000765856 [1,2,0,0,0,0|0,0,1]=4 13266 B11R1.28 CCOCCc1ccccc1 7a_100000210268_100000210202 [1,2,0,0,0,0|0,0,1]=4 13267 B11R1.28 CCOCSc1ccccc1 62a_100000719477_100000739092 [1,2,0,0,0,0|0,0,1]=4 13268 B11R1.28 CCOCSc1ccccc1 62a_100000739092_100000041952 [1,2,0,0,0,0|0,0,1]=4 13269 B11R1.28 CCSCCc1ccccc1 62a_100000210202_100011218657 [1,2,0,0,0,0|0,0,1]=4 13270 B11R1.28 CCSCCc1ccccc1 62a_100000765856_100000210202 [1,2,0,0,0,0|0,0,1]=4 13271 B11R1.28 CCSCSc1ccccc1 62a_100000210202_100011218342 [1,2,0,0,0,0|0,0,1]=4 13272 B11R1.28 CCSCSc1ccccc1 62a_100011218342_100000210202 [1,2,0,0,0,0|0,0,1]=4 13273 B11R1.28 CNC/C=C/c1ccccc1 2230a_100020603302_200000210301 [1,2,0,0,0,0|0,0,1]=4 13274 B11R1.28 CNC/C=C/c1ccccc1 2230a_106832991635_100016265936 [1,2,0,0,0,0|0,0,1]=4 13275 B11R1.28 CNC/C=C/c1ccccc1 34a_100020603302_200000210301 [1,2,0,0,0,0|0,0,1]=4 13276 B11R1.28 CNC/C=C/c1ccccc1 34a_100102657272_100016265936 [1,2,0,0,0,0|0,0,1]=4 13277 B11R1.28 CNC/C=C/c1ccccc1 7a_106832991635_100016265936 [1,2,0,0,0,0|0,0,1]=4 13278 B11R1.28 CNCC#Cc1ccccc1 2230a_106832991635_100011352542 [1,2,0,0,0,0|1,0,0]=4 13279 B11R1.28 CNCC#Cc1ccccc1 34a_100000735379_200000210301 [1,2,0,0,0,0|1,0,0]=4 13280 B11R1.28 CNCC#Cc1ccccc1 34a_100102657272_100011352542 [1,2,0,0,0,0|1,0,0]=4 13281 B11R1.28 CNCC#Cc1ccccc1 7a_106832991635_100011352542 [1,2,0,0,0,0|1,0,0]=4 13282 B11R1.28 CNCC=Cc1ccccc1 270004a_106832991635_100000210105 [1,2,0,0,0,0|0,0,1]=4 13283 B11R1.28 CNCCCc1ccccc1 2230a_100000211184_200000210301 [1,2,0,0,0,0|0,0,1]=4 13284 B11R1.28 CNCCCc1ccccc1 2230a_106832991635_100000211621 [1,2,0,0,0,0|0,0,1]=4 13285 B11R1.28 CNCCCc1ccccc1 34a_100000211184_200000210301 [1,2,0,0,0,0|0,0,1]=4 13286 B11R1.28 CNCCCc1ccccc1 34a_100102657272_100000211621 [1,2,0,0,0,0|0,0,1]=4 13287 B11R1.28 CNCCCc1ccccc1 7a_106832991635_100000211621 [1,2,0,0,0,0|0,0,1]=4 13288 B11R1.28 CNCCOc1ccccc1 2230a_100000174943_200000210301 [1,2,0,0,0,0|0,0,1]=4 13289 B11R1.28 CNCCOc1ccccc1 2230a_106832991635_100000184471 [1,2,0,0,0,0|0,0,1]=4 13290 B11R1.28 CNCCOc1ccccc1 270004a_106832991635_100000758736 [1,2,0,0,0,0|0,0,1]=4 13291 B11R1.28 CNCCOc1ccccc1 34a_100000174943_200000210301 [1,2,0,0,0,0|0,0,1]=4 13292 B11R1.28 CNCCOc1ccccc1 34a_100102657272_100000184471 [1,2,0,0,0,0|0,0,1]=4 13293 B11R1.28 CNCCOc1ccccc1 7a_106832991635_100000184471 [1,2,0,0,0,0|0,0,1]=4 13294 B11R1.28 CNCCSc1ccccc1 2230a_100000189519_200000210301 [1,2,0,0,0,0|0,0,1]=4 13295 B11R1.28 CNCCSc1ccccc1 2230a_106832991635_100000246102 [1,2,0,0,0,0|0,0,1]=4 13296 B11R1.28 CNCCSc1ccccc1 34a_100102657272_100000246102 [1,2,0,0,0,0|0,0,1]=4 13297 B11R1.28 CNCCSc1ccccc1 7a_106832991635_100000246102 [1,2,0,0,0,0|0,0,1]=4 13298 B11R1.28 CNCOCc1ccccc1 2230a_106832991635_100000763385 [1,2,0,0,0,0|0,0,1]=4 13299 B11R1.28 CNCOCc1ccccc1 34a_100102657272_100000763385 [1,2,0,0,0,0|0,0,1]=4 13300 B11R1.28 CNCSCc1ccccc1 2230a_106832991635_200011217039 [1,2,0,0,0,0|0,0,1]=4 13301 B11R1.28 CNCSCc1ccccc1 34a_100102657272_200011217039 [1,2,0,0,0,0|0,0,1]=4 13302 B11R1.28 COC/C=C/c1ccccc1 34a_100000210256_200000210301 [1,2,0,0,0,0|0,0,1]=4 13303 B11R1.28 COC/C=C/c1ccccc1 34a_100138415774_100016265936 [1,2,0,0,0,0|0,0,1]=4 13304 B11R1.28 COCC#Cc1ccccc1 34a_100011217464_200000210301 [1,2,0,0,0,0|1,0,0]=4 13305 B11R1.28 COCC#Cc1ccccc1 34a_100138415774_100011352542 [1,2,0,0,0,0|1,0,0]=4 13306 B11R1.28 COCC#Cc1ccccc1 7a_100011217464_200000210301 [1,2,0,0,0,0|1,0,0]=4 13307 B11R1.28 COCC=Cc1ccccc1 271570a_100016286323_100000210277 [1,2,0,0,0,0|0,0,1]=4 13308 B11R1.28 COCCCc1ccccc1 34a_100000210828_200000210301 [1,2,0,0,0,0|0,0,1]=4 13309 B11R1.28 COCCCc1ccccc1 34a_100138415774_100000211621 [1,2,0,0,0,0|0,0,1]=4 13310 B11R1.28 COCCCc1ccccc1 7a_100000210828_200000210301 [1,2,0,0,0,0|0,0,1]=4 13311 B11R1.28 COCCNc1ccccc1 34a_100000106764_100011201679 [1,2,0,0,0,0|0,0,1]=4 13312 B11R1.28 COCCNc1ccccc1 34a_100000211345_200000210301 [1,2,0,0,0,0|0,0,1]=4 13313 B11R1.28 COCCOc1ccccc1 34a_100000210260_200000210301 [1,2,0,0,0,0|0,0,1]=4 13314 B11R1.28 COCCOc1ccccc1 34a_100000210340_100011201679 [1,2,0,0,0,0|0,0,1]=4 13315 B11R1.28 COCCOc1ccccc1 34a_100138415774_100000184471 [1,2,0,0,0,0|0,0,1]=4 13316 B11R1.28 COCCOc1ccccc1 7a_100000210260_200000210301 [1,2,0,0,0,0|0,0,1]=4 13317 B11R1.28 COCCOc1ccccc1 7a_100000210340_100000233755 [1,2,0,0,0,0|0,0,1]=4 13318 B11R1.28 COCCSc1ccccc1 34a_100138415774_100000246102 [1,2,0,0,0,0|0,0,1]=4 13319 B11R1.28 COCCSc1ccccc1 62a_100000233755_100000041952 [1,2,0,0,0,0|0,0,1]=4 13320 B11R1.28 COCCSc1ccccc1 62a_100000719477_100000233755 [1,2,0,0,0,0|0,0,1]=4 13321 B11R1.28 COCCSc1ccccc1 7a_100000230494_200000210301 [1,2,0,0,0,0|0,0,1]=4 13322 B11R1.28 COCNCc1ccccc1 2230a_100015324214_100000766300 [1,2,0,0,0,0|0,0,1]=4 13323 B11R1.28 COCOCc1ccccc1 34a_100138415774_100000763385 [1,2,0,0,0,0|0,0,1]=4 13324 B11R1.28 COCSCc1ccccc1 34a_100138415774_200011217039 [1,2,0,0,0,0|0,0,1]=4 13325 B11R1.28 COCSCc1ccccc1 62a_100000211182_100000766300 [1,2,0,0,0,0|0,0,1]=4 13326 B11R1.28 COCSCc1ccccc1 62a_100000766300_100015291786 [1,2,0,0,0,0|0,0,1]=4 13327 B11R1.28 CSC/C=C/c1ccccc1 62a_100016265936_200000210301 [1,2,0,0,0,0|0,0,1]=4 13328 B11R1.28 CSC/C=C/c1ccccc1 62a_200000210301_100016265936 [1,2,0,0,0,0|0,0,1]=4 13329 B11R1.28 CSCC#Cc1ccccc1 62a_200000210301_100011352542 [1,2,0,0,0,0|1,0,0]=4 13330 B11R1.28 CSCCCc1ccccc1 62a_100000211621_200000210301 [1,2,0,0,0,0|0,0,1]=4 13331 B11R1.28 CSCCCc1ccccc1 62a_200000210301_100000211621 [1,2,0,0,0,0|0,0,1]=4 13332 B11R1.28 CSCCNc1ccccc1 34a_100000106764_100000212216 [1,2,0,0,0,0|0,0,1]=4 13333 B11R1.28 CSCCOc1ccccc1 34a_100000210340_100000212216 [1,2,0,0,0,0|0,0,1]=4 13334 B11R1.28 CSCCOc1ccccc1 62a_100000184471_200000210301 [1,2,0,0,0,0|0,0,1]=4 13335 B11R1.28 CSCCOc1ccccc1 62a_200000210301_100000184471 [1,2,0,0,0,0|0,0,1]=4 13336 B11R1.28 CSCCOc1ccccc1 7a_100000210340_100000212216 [1,2,0,0,0,0|0,0,1]=4 13337 B11R1.28 CSCCSc1ccccc1 62a_100000212216_100000041952 [1,2,0,0,0,0|0,0,1]=4 13338 B11R1.28 CSCCSc1ccccc1 62a_100000246102_200000210301 [1,2,0,0,0,0|0,0,1]=4 13339 B11R1.28 CSCCSc1ccccc1 62a_100000719477_100000751147 [1,2,0,0,0,0|0,0,1]=4 13340 B11R1.28 CSCCSc1ccccc1 62a_200000210301_100000246102 [1,2,0,0,0,0|0,0,1]=4 13341 B11R1.28 CSCNCc1ccccc1 2230a_100015324214_100011218213 [1,2,0,0,0,0|0,0,1]=4 13342 B11R1.28 CSCNCc1ccccc1 34a_100015324214_100011218213 [1,2,0,0,0,0|0,0,1]=4 13343 B11R1.28 CSCOCc1ccccc1 34a_100000210790_100011218213 [1,2,0,0,0,0|0,0,1]=4 13344 B11R1.28 CSCOCc1ccccc1 62a_100000763385_200000210301 [1,2,0,0,0,0|0,0,1]=4 13345 B11R1.28 CSCOCc1ccccc1 62a_200000210301_100000763385 [1,2,0,0,0,0|0,0,1]=4 13346 B11R1.28 CSCSCc1ccccc1 62a_100000211182_100011218213 [1,2,0,0,0,0|0,0,1]=4 13347 B11R1.28 CSCSCc1ccccc1 62a_100011218213_100015291786 [1,2,0,0,0,0|0,0,1]=4 13348 B11R1.28 CSCSCc1ccccc1 62a_200000210301_200011217039 [1,2,0,0,0,0|0,0,1]=4 13349 B11R1.28 CSCSCc1ccccc1 62a_200011217039_200000210301 [1,2,0,0,0,0|0,0,1]=4 13350 B11R1.28 FCCCNc1ccccc1 34a_100000106764_100011934791 [1,2,0,0,0,0|0,0,1]=4 13351 B11R1.28 FCCCOc1ccccc1 34a_100000210340_100011934791 [1,2,0,0,0,0|0,0,1]=4 13352 B11R1.28 FCCCOc1ccccc1 7a_100000210340_100011934791 [1,2,0,0,0,0|0,0,1]=4 13353 B11R1.28 FCCCSc1ccccc1 62a_100000719477_100011934791 [1,2,0,0,0,0|0,0,1]=4 13354 B11R1.28 FCCCSc1ccccc1 62a_100011934791_100000041952 [1,2,0,0,0,0|0,0,1]=4 13355 B11R1.28 FCCNCc1ccccc1 2230a_100015324214_100011217306 [1,2,0,0,0,0|0,0,1]=4 13356 B11R1.28 FCCNCc1ccccc1 34a_100000724931_100015291786 [1,2,0,0,0,0|0,0,1]=4 13357 B11R1.28 FCCNCc1ccccc1 34a_100015324214_100011217306 [1,2,0,0,0,0|0,0,1]=4 13358 B11R1.28 FCCOCc1ccccc1 34a_100000210790_100011217306 [1,2,0,0,0,0|0,0,1]=4 13359 B11R1.28 FCCOCc1ccccc1 7a_100000210790_100011217306 [1,2,0,0,0,0|0,0,1]=4 13360 B11R1.28 FCCSCc1ccccc1 62a_100000211182_100011217306 [1,2,0,0,0,0|0,0,1]=4 13361 B11R1.28 FCCSCc1ccccc1 62a_100011217306_100015291786 [1,2,0,0,0,0|0,0,1]=4 13362 B11R1.28 FCNCCc1ccccc1 34a_100000106460_100015361967 [1,2,0,0,0,0|0,0,1]=4 13363 B11R1.28 FCOCCc1ccccc1 34a_100000210268_100015361967 [1,2,0,0,0,0|0,0,1]=4 13364 B11R1.28 FCOCCc1ccccc1 7a_100000210268_100015361967 [1,2,0,0,0,0|0,0,1]=4 13365 B11R1.28 FCSCCc1ccccc1 62a_100000765856_100015361967 [1,2,0,0,0,0|0,0,1]=4 13366 B11R1.28 FCSCCc1ccccc1 62a_100015361967_100011218657 [1,2,0,0,0,0|0,0,1]=4 13367 B11R1.28 FCSCSc1ccccc1 62a_100011218342_100015361967 [1,2,0,0,0,0|1,0,0]=4 13368 B11R1.28 FCSCSc1ccccc1 62a_100015361967_100011218342 [1,2,0,0,0,0|1,0,0]=4 13369 B11R1.28 N#CCNCc1ccccc1 2230a_100015324214_100011215382 [1,2,0,0,0,0|1,0,0]=4 13370 B11R1.28 N#CCOCc1ccccc1 7a_100000210790_100011215382 [1,2,0,0,0,0|1,0,0]=4 13371 B11R1.28 N#CCSCc1ccccc1 62a_100000211182_100011215382 [1,2,0,0,0,0|1,0,0]=4 13372 B11R1.28 N#CCSCc1ccccc1 62a_100011215382_100015291786 [1,2,0,0,0,0|1,0,0]=4 13373 B11R1.28 NCCOCc1ccccc1 34a_100000210304_100015291786 [1,2,0,0,0,0|0,0,1]=4 13374 B11R1.28 O=CCNCc1ccccc1 2230a_100015324214_200015260668 [1,2,0,0,0,0|0,0,1]=4 13375 B11R1.28 O=CCNCc1ccccc1 34a_100015324214_200009817547 [1,2,0,0,0,0|0,0,1]=4 13376 B11R1.28 O=CCOCc1ccccc1 34a_100000210790_200009817547 [1,2,0,0,0,0|0,0,1]=4 13377 B11R1.28 O=CCOCc1ccccc1 7a_100000210790_200015260668 [1,2,0,0,0,0|0,0,1]=4 13378 B11R1.28 O=CCSCc1ccccc1 62a_100000211182_200015260668 [1,2,0,0,0,0|0,0,1]=4 13379 B11R1.28 O=CCSCc1ccccc1 62a_200015260668_100015291786 [1,2,0,0,0,0|0,0,1]=4 13380 B11R1.28 OCCCNc1ccccc1 34a_100000106764_100000230001 [1,2,0,0,0,0|0,0,1]=4 13381 B11R1.28 OCCCOc1ccccc1 34a_100000210340_100000230001 [1,2,0,0,0,0|0,0,1]=4 13382 B11R1.28 OCCCOc1ccccc1 7a_100000210340_100011215043 [1,2,0,0,0,0|0,0,1]=4 13383 B11R1.28 OCCCSc1ccccc1 62a_100000719477_100011215043 [1,2,0,0,0,0|0,0,1]=4 13384 B11R1.28 OCCCSc1ccccc1 62a_100011215043_100000041952 [1,2,0,0,0,0|0,0,1]=4 13385 B11R1.28 OCCNCc1ccccc1 207a_100000210304_100015611070 [1,2,0,0,0,0|0,0,1]=4 13386 B11R1.28 OCCNCc1ccccc1 2230a_100015324214_100000211926 [1,2,0,0,0,0|0,0,1]=4 13387 B11R1.28 OCCNCc1ccccc1 2230a_100016997473_100015291786 [1,2,0,0,0,0|0,0,1]=4 13388 B11R1.28 OCCNCc1ccccc1 270004a_100000210304_100015611070 [1,2,0,0,0,0|0,0,1]=4 13389 B11R1.28 OCCNCc1ccccc1 34a_100015324214_100000211926 [1,2,0,0,0,0|0,0,1]=4 13390 B11R1.28 OCCNCc1ccccc1 34a_100016990907_100015291786 [1,2,0,0,0,0|0,0,1]=4 13391 B11R1.28 OCCOCc1ccccc1 34a_100000210790_100000211926 [1,2,0,0,0,0|0,0,1]=4 13392 B11R1.28 OCCOCc1ccccc1 7a_100000210790_100000211926 [1,2,0,0,0,0|0,0,1]=4 13393 B11R1.28 OCCSCc1ccccc1 62a_100000211182_100000211926 [1,2,0,0,0,0|0,0,1]=4 13394 B11R1.28 OCCSCc1ccccc1 62a_100000211926_100015291786 [1,2,0,0,0,0|0,0,1]=4 13395 B11R1.28 [13CH3]NC/C=C/c1ccccc1 2230a_100020603302_200025704644 [1,2,0,0,0,0|0,0,1]=4 13396 B11R1.28 [13CH3]NC/C=C/c1ccccc1 34a_100020603302_200025704644 [1,2,0,0,0,0|0,0,1]=4 13397 B11R1.28 [13CH3]NCC#Cc1ccccc1 34a_100000735379_200025704644 [1,2,0,0,0,0|1,0,0]=4 13398 B11R1.28 [13CH3]NCCCc1ccccc1 2230a_100000211184_200025704644 [1,2,0,0,0,0|0,0,1]=4 13399 B11R1.28 [13CH3]NCCCc1ccccc1 34a_100000211184_200025704644 [1,2,0,0,0,0|0,0,1]=4 13400 B11R1.28 [13CH3]NCCOc1ccccc1 2230a_100000174943_200025704644 [1,2,0,0,0,0|0,0,1]=4 13401 B11R1.28 [13CH3]NCCOc1ccccc1 34a_100000174943_200025704644 [1,2,0,0,0,0|0,0,1]=4 13402 B11R1.28 [13CH3]NCCSc1ccccc1 2230a_100000189519_200025704644 [1,2,0,0,0,0|0,0,1]=4 13403 B11R1.28 [13CH3]OC/C=C/c1ccccc1 34a_100000210256_200025704644 [1,2,0,0,0,0|0,0,1]=4 13404 B11R1.28 [13CH3]OCC#Cc1ccccc1 34a_100011217464_200025704644 [1,2,0,0,0,0|1,0,0]=4 13405 B11R1.28 [13CH3]OCC#Cc1ccccc1 7a_100011217464_200025704644 [1,2,0,0,0,0|1,0,0]=4 13406 B11R1.28 [13CH3]OCCCc1ccccc1 34a_100000210828_200025704644 [1,2,0,0,0,0|0,0,1]=4 13407 B11R1.28 [13CH3]OCCCc1ccccc1 7a_100000210828_200025704644 [1,2,0,0,0,0|0,0,1]=4 13408 B11R1.28 [13CH3]OCCNc1ccccc1 34a_100000211345_200025704644 [1,2,0,0,0,0|0,0,1]=4 13409 B11R1.28 [13CH3]OCCOc1ccccc1 34a_100000210260_200025704644 [1,2,0,0,0,0|0,0,1]=4 13410 B11R1.28 [13CH3]OCCOc1ccccc1 7a_100000210260_200025704644 [1,2,0,0,0,0|0,0,1]=4 13411 B11R1.28 [13CH3]OCCSc1ccccc1 7a_100000230494_200025704644 [1,2,0,0,0,0|0,0,1]=4 13412 B11R1.28 [13CH3]SC/C=C/c1ccccc1 62a_100016265936_200025704644 [1,2,0,0,0,0|0,0,1]=4 13413 B11R1.28 [13CH3]SC/C=C/c1ccccc1 62a_200025704644_100016265936 [1,2,0,0,0,0|0,0,1]=4 13414 B11R1.28 [13CH3]SCC#Cc1ccccc1 62a_200025704644_100011352542 [1,2,0,0,0,0|1,0,0]=4 13415 B11R1.28 [13CH3]SCCCc1ccccc1 62a_100000211621_200025704644 [1,2,0,0,0,0|0,0,1]=4 13416 B11R1.28 [13CH3]SCCCc1ccccc1 62a_200025704644_100000211621 [1,2,0,0,0,0|0,0,1]=4 13417 B11R1.28 [13CH3]SCCOc1ccccc1 62a_100000184471_200025704644 [1,2,0,0,0,0|0,0,1]=4 13418 B11R1.28 [13CH3]SCCOc1ccccc1 62a_200025704644_100000184471 [1,2,0,0,0,0|0,0,1]=4 13419 B11R1.28 [13CH3]SCCSc1ccccc1 62a_100000246102_200025704644 [1,2,0,0,0,0|0,0,1]=4 13420 B11R1.28 [13CH3]SCCSc1ccccc1 62a_200025704644_100000246102 [1,2,0,0,0,0|0,0,1]=4 13421 B11R1.28 [13CH3]SCOCc1ccccc1 62a_100000763385_200025704644 [1,2,0,0,0,0|0,0,1]=4 13422 B11R1.28 [13CH3]SCOCc1ccccc1 62a_200025704644_100000763385 [1,2,0,0,0,0|0,0,1]=4 13423 B11R1.28 [13CH3]SCSCc1ccccc1 62a_200011217039_200025704644 [1,2,0,0,0,0|0,0,1]=4 13424 B11R1.28 [13CH3]SCSCc1ccccc1 62a_200025704644_200011217039 [1,2,0,0,0,0|0,0,1]=4 13425 B11R1.3 C#Cc1ccc(cc1)C(=O)C 1458a_100011217615_200000210301 [0,2,0,0,1,0|1,0,0]=4 13426 B11R1.3 C#Cc1ccc(cc1)C(=O)[13CH3] 1458a_100011217615_200025704644 [0,2,0,0,1,0|1,0,0]=4 13427 B11R1.3 C=C(C)c1ccc(cc1)C#N 271570a_100000694244_100000179745 [0,2,0,0,1,0|0,0,0]=3 13428 B11R1.3 C=C(C)c1ccc(cc1)C=O 271570a_100000694244_100000186029 [0,2,0,0,1,0|0,0,0]=3 13429 B11R1.3 C=C(C)c1ccc(cc1)CC 271570a_100000694244_100011215824 [0,2,0,0,1,0|0,0,0]=3 13430 B11R1.3 C=C(C)c1ccc(cc1)CF 271570a_100000694244_100010268989 [0,2,0,0,1,0|0,0,0]=3 13431 B11R1.3 C=C(C)c1ccc(cc1)CN 271570a_100000694244_100016989417 [0,2,0,0,1,0|0,0,0]=3 13432 B11R1.3 C=C(C)c1ccc(cc1)CO 271570a_100000694244_100000690907 [0,2,0,0,1,0|0,0,0]=3 13433 B11R1.3 C=C(C)c1ccc(cc1)NC 271570a_100000694244_100000219623 [0,2,0,0,1,0|0,0,0]=3 13434 B11R1.3 C=C(C)c1ccc(cc1)NN 271570a_100000694244_100016988836 [0,2,0,0,1,0|0,0,0]=3 13435 B11R1.3 C=C(C)c1ccc(cc1)OC 271570a_100000694244_100000171711 [0,2,0,0,1,0|0,0,0]=3 13436 B11R1.3 C=C(C)c1ccc(cc1)OC 34a_100009880102_200000210301 [0,2,0,0,1,0|0,0,0]=3 13437 B11R1.3 C=C(C)c1ccc(cc1)OC 7a_100009880102_200000210301 [0,2,0,0,1,0|0,0,0]=3 13438 B11R1.3 C=C(C)c1ccc(cc1)O[13CH3] 34a_100009880102_200025704644 [0,2,0,0,1,0|0,0,0]=3 13439 B11R1.3 C=C(C)c1ccc(cc1)O[13CH3] 7a_100009880102_200025704644 [0,2,0,0,1,0|0,0,0]=3 13440 B11R1.3 C=C(C)c1ccc(cc1)SC 271570a_100000694244_100011263217 [0,2,0,0,1,0|0,0,0]=3 13441 B11R1.3 C=C(C)c1ccc(cc1)SC 62a_100000185454_200000210301 [0,2,0,0,1,0|0,0,0]=3 13442 B11R1.3 C=C(C)c1ccc(cc1)SC 62a_200000210301_100000185454 [0,2,0,0,1,0|0,0,0]=3 13443 B11R1.3 C=C(C)c1ccc(cc1)S[13CH3] 62a_100000185454_200025704644 [0,2,0,0,1,0|0,0,0]=3 13444 B11R1.3 C=C(C)c1ccc(cc1)S[13CH3] 62a_200025704644_100000185454 [0,2,0,0,1,0|0,0,0]=3 13445 B11R1.3 C=C(C)c1ccc(cn1)C#N 271570a_100000694244_100000241038 [0,2,0,0,1,0|1,0,0]=4 13446 B11R1.3 C=C(C)c1ccc(cn1)C=O 271570a_100000694244_100000766901 [0,2,0,0,1,0|1,0,0]=4 13447 B11R1.3 C=C(C)c1ccc(cn1)CC 271570a_100000694244_100009843584 [0,2,0,0,1,0|1,0,0]=4 13448 B11R1.3 C=C(C)c1ccc(cn1)CN 271570a_100000694244_100009817727 [0,2,0,0,1,0|1,0,0]=4 13449 B11R1.3 C=C(C)c1ccc(cn1)CO 271570a_100000694244_100009816760 [0,2,0,0,1,0|1,0,0]=4 13450 B11R1.3 C=C(C)c1ccc(cn1)NC 271570a_100000694244_100000764248 [0,2,0,0,1,0|1,0,0]=4 13451 B11R1.3 C=C(C)c1ccc(cn1)NN 271570a_100000694244_100000119030 [0,2,0,0,1,0|1,0,0]=4 13452 B11R1.3 C=C(C)c1ccc(cn1)OC 271570a_100000694244_100000755202 [0,2,0,0,1,0|1,0,0]=4 13453 B11R1.3 C=C(C)c1ccc(cn1)SC 271570a_100000694244_100009820866 [0,2,0,0,1,0|1,0,0]=4 13454 B11R1.3 C=C(C)c1ccc(nc1)C#N 271570a_100000694244_100000760455 [0,2,0,0,1,0|1,0,0]=4 13455 B11R1.3 C=C(C)c1ccc(nc1)C=O 271570a_100000694244_100000754260 [0,2,0,0,1,0|1,0,0]=4 13456 B11R1.3 C=C(C)c1ccc(nc1)CC 271570a_100000694244_100009820025 [0,2,0,0,1,0|1,0,0]=4 13457 B11R1.3 C=C(C)c1ccc(nc1)CN 271570a_100000694244_100015188789 [0,2,0,0,1,0|1,0,0]=4 13458 B11R1.3 C=C(C)c1ccc(nc1)CO 271570a_100000694244_100000754261 [0,2,0,0,1,0|1,0,0]=4 13459 B11R1.3 C=C(C)c1ccc(nc1)NC 271570a_100000694244_100000741341 [0,2,0,0,1,0|1,0,0]=4 13460 B11R1.3 C=C(C)c1ccc(nc1)NN 271570a_100000694244_100000750576 [0,2,0,0,1,0|1,0,0]=4 13461 B11R1.3 C=C(C)c1ccc(nc1)OC 271570a_100000694244_100000047065 [0,2,0,0,1,0|1,0,0]=4 13462 B11R1.3 C=C(C)c1ccc(nc1)SC 271570a_100000694244_100011408404 [0,2,0,0,1,0|1,0,0]=4 13463 B11R1.3 C=Cc1ccc(cc1)C(=C)C 271570a_100011290941_100000185454 [0,2,0,0,1,0|0,0,0]=3 13464 B11R1.3 C=Cc1ccc(cc1)C(=O)C 1458a_100000687532_200000210301 [0,2,0,0,1,0|1,0,0]=4 13465 B11R1.3 C=Cc1ccc(cc1)C(=O)C 271570a_100011290941_100000185465 [0,2,0,0,1,0|1,0,0]=4 13466 B11R1.3 C=Cc1ccc(cc1)C(=O)[13CH3] 1458a_100000687532_200025704644 [0,2,0,0,1,0|1,0,0]=4 13467 B11R1.3 CC(=O)c1ccc(cc1)C#N 1458a_100000210717_200000210301 [0,2,0,0,1,0|1,0,0]=4 13468 B11R1.3 CC(=O)c1ccc(cc1)CO 1458a_100000183892_200000210301 [0,2,0,0,1,0|1,0,0]=4 13469 B11R1.3 CC(=O)c1ccc(cc1)O[13CH3] 34a_100000185113_200025704644 [0,2,0,0,1,0|1,0,0]=4 13470 B11R1.3 CC(=O)c1ccc(cc1)O[13CH3] 7a_100000185113_200025704644 [0,2,0,0,1,0|1,0,0]=4 13471 B11R1.3 CC(=O)c1ccc(cc1)S[13CH3] 62a_100000185465_200025704644 [0,2,0,0,1,0|1,0,0]=4 13472 B11R1.3 CC(=O)c1ccc(cc1)S[13CH3] 62a_200025704644_100000185465 [0,2,0,0,1,0|1,0,0]=4 13473 B11R1.3 CCc1ccc(cc1)C(=O)C 1458a_100000211226_200000210301 [0,2,0,0,1,0|1,0,0]=4 13474 B11R1.3 CCc1ccc(cc1)C(=O)[13CH3] 1458a_100000211226_200025704644 [0,2,0,0,1,0|1,0,0]=4 13475 B11R1.3 COc1ccc(cc1)C(=O)C 1458a_100000184203_200000210301 [0,2,0,0,1,0|1,0,0]=4 13476 B11R1.3 COc1ccc(cc1)C(=O)C 34a_100000185113_200000210301 [0,2,0,0,1,0|1,0,0]=4 13477 B11R1.3 COc1ccc(cc1)C(=O)C 7a_100000185113_200000210301 [0,2,0,0,1,0|1,0,0]=4 13478 B11R1.3 COc1ccc(cc1)C(=O)[13CH3] 1458a_100000184203_200025704644 [0,2,0,0,1,0|1,0,0]=4 13479 B11R1.3 CSc1ccc(cc1)C(=O)C 1458a_100000189692_200000210301 [0,2,0,0,1,0|1,0,0]=4 13480 B11R1.3 CSc1ccc(cc1)C(=O)C 62a_100000185465_200000210301 [0,2,0,0,1,0|1,0,0]=4 13481 B11R1.3 CSc1ccc(cc1)C(=O)C 62a_200000210301_100000185465 [0,2,0,0,1,0|1,0,0]=4 13482 B11R1.3 CSc1ccc(cc1)C(=O)[13CH3] 1458a_100000189692_200025704644 [0,2,0,0,1,0|1,0,0]=4 13483 B11R1.3 [13CH3]C(=O)c1ccc(cc1)C#N 1458a_100000210717_200025704644 [0,2,0,0,1,0|1,0,0]=4 13484 B11R1.3 [13CH3]C(=O)c1ccc(cc1)CO 1458a_100000183892_200025704644 [0,2,0,0,1,0|1,0,0]=4 13485 B11R1.21 C=C(C)c1c[nH]c(=O)c(c1)Br 271570a_100000694244_100010125443 [0,2,0,0,1,0|1,0,0]=4 13486 B11R1.21 C=C(C)c1c[nH]c(=O)c(c1)F 271570a_100000694244_100000723523 [0,2,0,0,1,0|1,0,0]=4 13487 B11R1.21 C=C(C)c1c[nH]c(=O)c(c1)O 271570a_100000694244_100009814561 [0,2,0,0,1,0|1,0,0]=4 13488 B11R1.21 C=C(C)c1cc(c(cn1)Br)C 271570a_100000694244_100012356354 [0,2,0,0,1,0|1,0,0]=4 13489 B11R1.21 C=C(C)c1cc(c(cn1)C)C 271570a_100000694244_100009850809 [0,2,0,0,1,0|1,0,0]=4 13490 B11R1.21 C=C(C)c1cc(c(cn1)C)F 271570a_100000694244_100009841206 [0,2,0,0,1,0|1,0,0]=4 13491 B11R1.21 C=C(C)c1cc(c(cn1)C)N 271570a_100000694244_100000690170 [0,2,0,0,1,0|1,0,0]=4 13492 B11R1.21 C=C(C)c1cc(c(cn1)C)O 271570a_100000694244_100000704368 [0,2,0,0,1,0|1,0,0]=4 13493 B11R1.21 C=C(C)c1cc(c(cn1)F)C 271570a_100000694244_100009818257 [0,2,0,0,1,0|1,0,0]=4 13494 B11R1.21 C=C(C)c1cc(c(cn1)F)N 271570a_100000694244_100000126464 [0,2,0,0,1,0|1,0,0]=4 13495 B11R1.21 C=C(C)c1cc(c(cn1)F)O 271570a_100000694244_100009854642 [0,2,0,0,1,0|1,0,0]=4 13496 B11R1.21 C=C(C)c1cc(c(cn1)N)C 271570a_100000694244_100000765520 [0,2,0,0,1,0|1,0,0]=4 13497 B11R1.21 C=C(C)c1cc(c(cn1)N)N 271570a_100000694244_100000067514 [0,2,0,0,1,0|1,0,0]=4 13498 B11R1.21 C=C(C)c1cc(c(cn1)O)C 271570a_100000694244_100000692680 [0,2,0,0,1,0|1,0,0]=4 13499 B11R1.21 C=C(C)c1cc(c(cn1)O)N 271570a_100000694244_100009819941 [0,2,0,0,1,0|1,0,0]=4 13500 B11R1.21 C=C(C)c1ccc(=O)n(c1)C 271570a_100000694244_100011245003 [0,2,0,0,1,0|1,0,0]=4 13501 B11R1.21 C=C(C)c1ccc([n+](c1)[O-])C 271570a_100000694244_100000703231 [0,2,0,0,1,0|1,0,0]=4 13502 B11R1.21 C=C(C)c1ccc(c(=S)[nH]1)N 271570a_100000694244_100116329207 [0,2,0,0,1,0|1,0,0]=4 13503 B11R1.21 C=C(C)c1ccc(c(c1)Br)Br 271570a_100000694244_100012356285 [0,2,0,0,1,0|0,0,0]=3 13504 B11R1.21 C=C(C)c1ccc(c(c1)Br)C 271570a_100000694244_100011847877 [0,2,0,0,1,0|0,0,0]=3 13505 B11R1.21 C=C(C)c1ccc(c(c1)Br)Cl 271570a_100000694244_100012353702 [0,2,0,0,1,0|0,0,0]=3 13506 B11R1.21 C=C(C)c1ccc(c(c1)Br)F 271570a_100000694244_100012047266 [0,2,0,0,1,0|0,0,0]=3 13507 B11R1.21 C=C(C)c1ccc(c(c1)Br)N 271570a_100000694244_100000750455 [0,2,0,0,1,0|0,0,0]=3 13508 B11R1.21 C=C(C)c1ccc(c(c1)Br)O 271570a_100000694244_100012361655 [0,2,0,0,1,0|0,0,0]=3 13509 B11R1.21 C=C(C)c1ccc(c(c1)C)Br 271570a_100000694244_100009813585 [0,2,0,0,1,0|0,0,0]=3 13510 B11R1.21 C=C(C)c1ccc(c(c1)C)C 271570a_100000694244_100011215607 [0,2,0,0,1,0|0,0,0]=3 13511 B11R1.21 C=C(C)c1ccc(c(c1)C)Cl 271570a_100000694244_100000049509 [0,2,0,0,1,0|0,0,0]=3 13512 B11R1.21 C=C(C)c1ccc(c(c1)C)F 271570a_100000694244_100011218330 [0,2,0,0,1,0|0,0,0]=3 13513 B11R1.21 C=C(C)c1ccc(c(c1)C)N 271570a_100000694244_100000211769 [0,2,0,0,1,0|0,0,0]=3 13514 B11R1.21 C=C(C)c1ccc(c(c1)C)O 271570a_100000694244_100000186361 [0,2,0,0,1,0|0,0,0]=3 13515 B11R1.21 C=C(C)c1ccc(c(c1)Cl)Br 271570a_100000694244_100012047281 [0,2,0,0,1,0|0,0,0]=3 13516 B11R1.21 C=C(C)c1ccc(c(c1)Cl)C 271570a_100000694244_100011216363 [0,2,0,0,1,0|0,0,0]=3 13517 B11R1.21 C=C(C)c1ccc(c(c1)Cl)Cl 271570a_100000694244_100011214914 [0,2,0,0,1,0|0,0,0]=3 13518 B11R1.21 C=C(C)c1ccc(c(c1)Cl)F 271570a_100000694244_100011215976 [0,2,0,0,1,0|0,0,0]=3 13519 B11R1.21 C=C(C)c1ccc(c(c1)Cl)N 271570a_100000694244_100011218065 [0,2,0,0,1,0|0,0,0]=3 13520 B11R1.21 C=C(C)c1ccc(c(c1)Cl)O 271570a_100000694244_100012360047 [0,2,0,0,1,0|0,0,0]=3 13521 B11R1.21 C=C(C)c1ccc(c(c1)F)Br 271570a_100000694244_100000685389 [0,2,0,0,1,0|0,0,0]=3 13522 B11R1.21 C=C(C)c1ccc(c(c1)F)C 271570a_100000694244_100000720648 [0,2,0,0,1,0|0,0,0]=3 13523 B11R1.21 C=C(C)c1ccc(c(c1)F)Cl 271570a_100000694244_100011216805 [0,2,0,0,1,0|0,0,0]=3 13524 B11R1.21 C=C(C)c1ccc(c(c1)F)F 271570a_100000694244_100000750028 [0,2,0,0,1,0|0,0,0]=3 13525 B11R1.21 C=C(C)c1ccc(c(c1)F)N 271570a_100000694244_100011215594 [0,2,0,0,1,0|0,0,0]=3 13526 B11R1.21 C=C(C)c1ccc(c(c1)F)O 271570a_100000694244_100000185481 [0,2,0,0,1,0|0,0,0]=3 13527 B11R1.21 C=C(C)c1ccc(c(c1)N)Br 271570a_100000694244_100000750456 [0,2,0,0,1,0|0,0,0]=3 13528 B11R1.21 C=C(C)c1ccc(c(c1)N)C 271570a_100000694244_100000761890 [0,2,0,0,1,0|0,0,0]=3 13529 B11R1.21 C=C(C)c1ccc(c(c1)N)Cl 271570a_100000694244_200000761891 [0,2,0,0,1,0|0,0,0]=3 13530 B11R1.21 C=C(C)c1ccc(c(c1)N)F 271570a_100000694244_100000740924 [0,2,0,0,1,0|0,0,0]=3 13531 B11R1.21 C=C(C)c1ccc(c(c1)N)N 271570a_100000694244_100000741789 [0,2,0,0,1,0|0,0,0]=3 13532 B11R1.21 C=C(C)c1ccc(c(c1)N)O 271570a_100000694244_100000752626 [0,2,0,0,1,0|0,0,0]=3 13533 B11R1.21 C=C(C)c1ccc(c(c1)O)Br 271570a_100000694244_100012356990 [0,2,0,0,1,0|0,0,0]=3 13534 B11R1.21 C=C(C)c1ccc(c(c1)O)C 271570a_100000694244_100000766334 [0,2,0,0,1,0|0,0,0]=3 13535 B11R1.21 C=C(C)c1ccc(c(c1)O)Cl 271570a_100000694244_100011356854 [0,2,0,0,1,0|0,0,0]=3 13536 B11R1.21 C=C(C)c1ccc(c(c1)O)F 271570a_100000694244_100000686035 [0,2,0,0,1,0|0,0,0]=3 13537 B11R1.21 C=C(C)c1ccc(c(c1)O)N 271570a_100000694244_100000739049 [0,2,0,0,1,0|0,0,0]=3 13538 B11R1.21 C=C(C)c1ccc(c(c1)O)O 271570a_100000694244_100009813601 [0,2,0,0,1,0|0,0,0]=3 13539 B11R1.21 C=C(C)c1ccc(c(n1)Br)O 271570a_100000694244_100000725334 [0,2,0,0,1,0|1,0,0]=4 13540 B11R1.21 C=C(C)c1ccc(c(n1)C)Br 271570a_100000694244_100012360386 [0,2,0,0,1,0|1,0,0]=4 13541 B11R1.21 C=C(C)c1ccc(c(n1)C)C 271570a_100000694244_100000103781 [0,2,0,0,1,0|1,0,0]=4 13542 B11R1.21 C=C(C)c1ccc(c(n1)C)F 271570a_100000694244_100009814307 [0,2,0,0,1,0|1,0,0]=4 13543 B11R1.21 C=C(C)c1ccc(c(n1)C)N 271570a_100000694244_100000760127 [0,2,0,0,1,0|1,0,0]=4 13544 B11R1.21 C=C(C)c1ccc(c(n1)C)O 271570a_100000694244_100010233687 [0,2,0,0,1,0|1,0,0]=4 13545 B11R1.21 C=C(C)c1ccc(c(n1)Cl)N 271570a_100000694244_200010233646 [0,2,0,0,1,0|1,0,0]=4 13546 B11R1.21 C=C(C)c1ccc(c(n1)Cl)O 271570a_100000694244_100000721234 [0,2,0,0,1,0|1,0,0]=4 13547 B11R1.21 C=C(C)c1ccc(c(n1)F)Br 271570a_100000694244_100010134343 [0,2,0,0,1,0|1,0,0]=4 13548 B11R1.21 C=C(C)c1ccc(c(n1)F)N 271570a_100000694244_100009856439 [0,2,0,0,1,0|1,0,0]=4 13549 B11R1.21 C=C(C)c1ccc(c(n1)F)O 271570a_100000694244_100009819667 [0,2,0,0,1,0|1,0,0]=4 13550 B11R1.21 C=C(C)c1ccc(c(n1)N)C 271570a_100000694244_100009857032 [0,2,0,0,1,0|1,0,0]=4 13551 B11R1.21 C=C(C)c1ccc(c(n1)N)F 271570a_100000694244_100016091773 [0,2,0,0,1,0|1,0,0]=4 13552 B11R1.21 C=C(C)c1ccc(c(n1)N)N 271570a_100000694244_100000747239 [0,2,0,0,1,0|1,0,0]=4 13553 B11R1.21 C=C(C)c1ccc(c(n1)N)O 271570a_100000694244_100000685527 [0,2,0,0,1,0|1,0,0]=4 13554 B11R1.21 C=C(C)c1ccc(c(n1)O)F 271570a_100000694244_100010729010 [0,2,0,0,1,0|1,0,0]=4 13555 B11R1.21 C=C(C)c1ccc(c(n1)O)N 271570a_100000694244_100000718904 [0,2,0,0,1,0|1,0,0]=4 13556 B11R1.21 C=C(C)c1ccn(c(=O)c1)C 271570a_100000694244_100009820031 [0,2,0,0,1,0|1,0,0]=4 13557 B11R1.21 C=C(C)c1cnc(c(c1)Br)Cl 271570a_100000694244_100010172733 [0,2,0,0,1,0|1,0,0]=4 13558 B11R1.21 C=C(C)c1cnc(c(c1)Br)N 271570a_100000694244_100012353989 [0,2,0,0,1,0|1,0,0]=4 13559 B11R1.21 C=C(C)c1cnc(c(c1)C)Br 271570a_100000694244_100009816107 [0,2,0,0,1,0|1,0,0]=4 13560 B11R1.21 C=C(C)c1cnc(c(c1)C)C 271570a_100000694244_100000697892 [0,2,0,0,1,0|1,0,0]=4 13561 B11R1.21 C=C(C)c1cnc(c(c1)C)Cl 271570a_100000694244_100009922867 [0,2,0,0,1,0|1,0,0]=4 13562 B11R1.21 C=C(C)c1cnc(c(c1)C)F 271570a_100000694244_100000709442 [0,2,0,0,1,0|1,0,0]=4 13563 B11R1.21 C=C(C)c1cnc(c(c1)C)N 271570a_100000694244_100000186686 [0,2,0,0,1,0|1,0,0]=4 13564 B11R1.21 C=C(C)c1cnc(c(c1)C)O 271570a_100000694244_100000685391 [0,2,0,0,1,0|1,0,0]=4 13565 B11R1.21 C=C(C)c1cnc(c(c1)Cl)N 271570a_100000694244_100012356299 [0,2,0,0,1,0|1,0,0]=4 13566 B11R1.21 C=C(C)c1cnc(c(c1)Cl)O 271570a_100000694244_100010238531 [0,2,0,0,1,0|1,0,0]=4 13567 B11R1.21 C=C(C)c1cnc(c(c1)F)C 271570a_100000694244_100009845756 [0,2,0,0,1,0|1,0,0]=4 13568 B11R1.21 C=C(C)c1cnc(c(c1)F)F 271570a_100000694244_100009817721 [0,2,0,0,1,0|1,0,0]=4 13569 B11R1.21 C=C(C)c1cnc(c(c1)F)N 271570a_100000694244_100000693161 [0,2,0,0,1,0|1,0,0]=4 13570 B11R1.21 C=C(C)c1cnc(c(c1)N)C 271570a_100000694244_100011999542 [0,2,0,0,1,0|1,0,0]=4 13571 B11R1.21 C=C(C)c1cnc(c(c1)N)Cl 271570a_100000694244_100009828400 [0,2,0,0,1,0|1,0,0]=4 13572 B11R1.21 C=C(C)c1cnc(c(c1)N)F 271570a_100000694244_100009816798 [0,2,0,0,1,0|1,0,0]=4 13573 B11R1.21 C=C(C)c1cnc(c(c1)N)N 271570a_100000694244_100000184470 [0,2,0,0,1,0|1,0,0]=4 13574 B11R1.21 C=C(C)c1cnc(c(c1)N)O 271570a_100000694244_100000743729 [0,2,0,0,1,0|1,0,0]=4 13575 B11R1.21 C=C(C)c1cnc(c(c1)O)C 271570a_100000694244_100009864810 [0,2,0,0,1,0|1,0,0]=4 13576 B11R1.21 C=C(C)c1cnc(c(c1)O)F 271570a_100000694244_100009819871 [0,2,0,0,1,0|1,0,0]=4 13577 B11R1.21 C=C(C)c1cnc(c(c1)O)N 271570a_100000694244_100009819042 [0,2,0,0,1,0|1,0,0]=4 13578 B11R1.21 CC(=O)c1ccc(c(c1)Br)Br 1458a_100012339404_200000210301 [0,2,0,0,1,0|1,0,0]=4 13579 B11R1.21 CC(=O)c1ccc(c(c1)Br)C 1458a_100000186397_200000210301 [0,2,0,0,1,0|1,0,0]=4 13580 B11R1.21 CC(=O)c1ccc(c(c1)Br)Cl 1458a_100000691181_200000210301 [0,2,0,0,1,0|1,0,0]=4 13581 B11R1.21 CC(=O)c1ccc(c(c1)Br)F 1458a_100000760357_200000210301 [0,2,0,0,1,0|1,0,0]=4 13582 B11R1.21 CC(=O)c1ccc(c(c1)Br)I 1458a_100000739115_200000210301 [0,2,0,0,1,0|1,0,0]=4 13583 B11R1.21 CC(=O)c1ccc(c(c1)Br)O 1458a_100000189672_200000210301 [0,2,0,0,1,0|1,0,0]=4 13584 B11R1.21 CC(=O)c1ccc(c(c1)Br)O 271570a_203496583355_100010146554 [0,2,0,0,1,0|1,0,0]=4 13585 B11R1.21 CC(=O)c1ccc(c(c1)C)Br 1458a_100000692631_200000210301 [0,2,0,0,1,0|1,0,0]=4 13586 B11R1.21 CC(=O)c1ccc(c(c1)C)C 1458a_100000210898_200000210301 [0,2,0,0,1,0|1,0,0]=4 13587 B11R1.21 CC(=O)c1ccc(c(c1)C)Cl 1458a_100000686306_200000210301 [0,2,0,0,1,0|1,0,0]=4 13588 B11R1.21 CC(=O)c1ccc(c(c1)C)F 1458a_100000751819_200000210301 [0,2,0,0,1,0|1,0,0]=4 13589 B11R1.21 CC(=O)c1ccc(c(c1)C)I 1458a_100000751300_200000210301 [0,2,0,0,1,0|1,0,0]=4 13590 B11R1.21 CC(=O)c1ccc(c(c1)C)O 1458a_100000685612_200000210301 [0,2,0,0,1,0|1,0,0]=4 13591 B11R1.21 CC(=O)c1ccc(c(c1)C)O 271570a_203496583355_100000697869 [0,2,0,0,1,0|1,0,0]=4 13592 B11R1.21 CC(=O)c1ccc(c(c1)Cl)Br 1458a_100000687082_200000210301 [0,2,0,0,1,0|1,0,0]=4 13593 B11R1.21 CC(=O)c1ccc(c(c1)Cl)C 1458a_100000751740_200000210301 [0,2,0,0,1,0|1,0,0]=4 13594 B11R1.21 CC(=O)c1ccc(c(c1)Cl)Cl 1458a_100000210401_200000210301 [0,2,0,0,1,0|1,0,0]=4 13595 B11R1.21 CC(=O)c1ccc(c(c1)Cl)F 1458a_100000686462_200000210301 [0,2,0,0,1,0|1,0,0]=4 13596 B11R1.21 CC(=O)c1ccc(c(c1)Cl)I 1458a_100000684831_200000210301 [0,2,0,0,1,0|1,0,0]=4 13597 B11R1.21 CC(=O)c1ccc(c(c1)Cl)O 1458a_100000212196_200000210301 [0,2,0,0,1,0|1,0,0]=4 13598 B11R1.21 CC(=O)c1ccc(c(c1)F)Br 1458a_100000743946_200000210301 [0,2,0,0,1,0|1,0,0]=4 13599 B11R1.21 CC(=O)c1ccc(c(c1)F)C 1458a_100000212313_200000210301 [0,2,0,0,1,0|1,0,0]=4 13600 B11R1.21 CC(=O)c1ccc(c(c1)F)Cl 1458a_100000743183_200000210301 [0,2,0,0,1,0|1,0,0]=4 13601 B11R1.21 CC(=O)c1ccc(c(c1)F)F 1458a_100000209822_200000210301 [0,2,0,0,1,0|1,0,0]=4 13602 B11R1.21 CC(=O)c1ccc(c(c1)F)I 1458a_100000062624_200000210301 [0,2,0,0,1,0|1,0,0]=4 13603 B11R1.21 CC(=O)c1ccc(c(c1)F)O 1458a_100000185466_200000210301 [0,2,0,0,1,0|1,0,0]=4 13604 B11R1.21 CC(=O)c1ccc(c(c1)F)O 271570a_203496583355_100000690002 [0,2,0,0,1,0|1,0,0]=4 13605 B11R1.21 CC(=O)c1ccc(c(c1)I)Br 1458a_100012343876_200000210301 [0,2,0,0,1,0|1,0,0]=4 13606 B11R1.21 CC(=O)c1ccc(c(c1)I)C 1458a_100000751299_200000210301 [0,2,0,0,1,0|1,0,0]=4 13607 B11R1.21 CC(=O)c1ccc(c(c1)I)Cl 1458a_100000739381_200000210301 [0,2,0,0,1,0|1,0,0]=4 13608 B11R1.21 CC(=O)c1ccc(c(c1)I)F 1458a_100000688015_200000210301 [0,2,0,0,1,0|1,0,0]=4 13609 B11R1.21 CC(=O)c1ccc(c(c1)I)I 1458a_100000725830_200000210301 [0,2,0,0,1,0|1,0,0]=4 13610 B11R1.21 CC(=O)c1ccc(c(c1)I)O 1458a_100000037485_200000210301 [0,2,0,0,1,0|1,0,0]=4 13611 B11R1.21 CC(=O)c1ccc(c(c1)N)O 271570a_203496583355_100009816534 [0,2,0,0,1,0|1,0,0]=4 13612 B11R1.21 CC(=O)c1ccc(c(c1)O)Br 1458a_100000689001_200000210301 [0,2,0,0,1,0|1,0,0]=4 13613 B11R1.21 CC(=O)c1ccc(c(c1)O)Br 271570a_203496583355_100010146556 [0,2,0,0,1,0|1,0,0]=4 13614 B11R1.21 CC(=O)c1ccc(c(c1)O)C 1458a_100000233767_200000210301 [0,2,0,0,1,0|1,0,0]=4 13615 B11R1.21 CC(=O)c1ccc(c(c1)O)C 271570a_203496583355_100011934287 [0,2,0,0,1,0|1,0,0]=4 13616 B11R1.21 CC(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_200000210301 [0,2,0,0,1,0|1,0,0]=4 13617 B11R1.21 CC(=O)c1ccc(c(c1)O)F 1458a_100000035894_200000210301 [0,2,0,0,1,0|1,0,0]=4 13618 B11R1.21 CC(=O)c1ccc(c(c1)O)F 271570a_203496583355_100000239719 [0,2,0,0,1,0|1,0,0]=4 13619 B11R1.21 CC(=O)c1ccc(c(c1)O)I 1458a_100000239334_200000210301 [0,2,0,0,1,0|1,0,0]=4 13620 B11R1.21 CC(=O)c1ccc(c(c1)O)N 271570a_203496583355_100012029215 [0,2,0,0,1,0|1,0,0]=4 13621 B11R1.21 CC(=O)c1ccc(c(c1)O)O 1458a_100000212155_200000210301 [0,2,0,0,1,0|1,0,0]=4 13622 B11R1.21 CC(=O)c1ccc(c(c1)O)O 271570a_203496583355_100011772453 [0,2,0,0,1,0|1,0,0]=4 13623 B11R1.21 Cc1cc(ccc1Br)C(=O)[13CH3] 1458a_100000692631_200025704644 [0,2,0,0,1,0|1,0,0]=4 13624 B11R1.21 Cc1cc(ccc1Cl)C(=O)[13CH3] 1458a_100000686306_200025704644 [0,2,0,0,1,0|1,0,0]=4 13625 B11R1.21 Cc1cc(ccc1F)C(=O)[13CH3] 1458a_100000751819_200025704644 [0,2,0,0,1,0|1,0,0]=4 13626 B11R1.21 Cc1cc(ccc1I)C(=O)[13CH3] 1458a_100000751300_200025704644 [0,2,0,0,1,0|1,0,0]=4 13627 B11R1.21 Cc1cc(ccc1O)C(=O)[13CH3] 1458a_100000685612_200025704644 [0,2,0,0,1,0|1,0,0]=4 13628 B11R1.21 Cc1ccc(cc1Br)C(=O)[13CH3] 1458a_100000186397_200025704644 [0,2,0,0,1,0|1,0,0]=4 13629 B11R1.21 Cc1ccc(cc1C)C(=O)[13CH3] 1458a_100000210898_200025704644 [0,2,0,0,1,0|1,0,0]=4 13630 B11R1.21 Cc1ccc(cc1Cl)C(=O)[13CH3] 1458a_100000751740_200025704644 [0,2,0,0,1,0|1,0,0]=4 13631 B11R1.21 Cc1ccc(cc1F)C(=O)[13CH3] 1458a_100000212313_200025704644 [0,2,0,0,1,0|1,0,0]=4 13632 B11R1.21 Cc1ccc(cc1I)C(=O)[13CH3] 1458a_100000751299_200025704644 [0,2,0,0,1,0|1,0,0]=4 13633 B11R1.21 Cc1ccc(cc1O)C(=O)[13CH3] 1458a_100000233767_200025704644 [0,2,0,0,1,0|1,0,0]=4 13634 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Br)Br 1458a_100012339404_200025704644 [0,2,0,0,1,0|1,0,0]=4 13635 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Br)Cl 1458a_100000691181_200025704644 [0,2,0,0,1,0|1,0,0]=4 13636 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Br)F 1458a_100000760357_200025704644 [0,2,0,0,1,0|1,0,0]=4 13637 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Br)I 1458a_100000739115_200025704644 [0,2,0,0,1,0|1,0,0]=4 13638 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Br)O 1458a_100000189672_200025704644 [0,2,0,0,1,0|1,0,0]=4 13639 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Cl)Br 1458a_100000687082_200025704644 [0,2,0,0,1,0|1,0,0]=4 13640 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Cl)Cl 1458a_100000210401_200025704644 [0,2,0,0,1,0|1,0,0]=4 13641 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Cl)F 1458a_100000686462_200025704644 [0,2,0,0,1,0|1,0,0]=4 13642 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Cl)I 1458a_100000684831_200025704644 [0,2,0,0,1,0|1,0,0]=4 13643 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Cl)O 1458a_100000212196_200025704644 [0,2,0,0,1,0|1,0,0]=4 13644 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)F)Br 1458a_100000743946_200025704644 [0,2,0,0,1,0|1,0,0]=4 13645 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)F)Cl 1458a_100000743183_200025704644 [0,2,0,0,1,0|1,0,0]=4 13646 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)F)F 1458a_100000209822_200025704644 [0,2,0,0,1,0|1,0,0]=4 13647 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)F)I 1458a_100000062624_200025704644 [0,2,0,0,1,0|1,0,0]=4 13648 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)F)O 1458a_100000185466_200025704644 [0,2,0,0,1,0|1,0,0]=4 13649 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)I)Br 1458a_100012343876_200025704644 [0,2,0,0,1,0|1,0,0]=4 13650 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)I)Cl 1458a_100000739381_200025704644 [0,2,0,0,1,0|1,0,0]=4 13651 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)I)F 1458a_100000688015_200025704644 [0,2,0,0,1,0|1,0,0]=4 13652 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)I)I 1458a_100000725830_200025704644 [0,2,0,0,1,0|1,0,0]=4 13653 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)I)O 1458a_100000037485_200025704644 [0,2,0,0,1,0|1,0,0]=4 13654 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)O)Br 1458a_100000689001_200025704644 [0,2,0,0,1,0|1,0,0]=4 13655 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_200025704644 [0,2,0,0,1,0|1,0,0]=4 13656 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)O)F 1458a_100000035894_200025704644 [0,2,0,0,1,0|1,0,0]=4 13657 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)O)I 1458a_100000239334_200025704644 [0,2,0,0,1,0|1,0,0]=4 13658 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)O)O 1458a_100000212155_200025704644 [0,2,0,0,1,0|1,0,0]=4 13659 B11R1.166 C=C(C)c1c[nH]c(=O)cc1F 271570a_100000694244_100015631685 [0,2,0,0,1,0|1,0,0]=4 13660 B11R1.166 C=C(C)c1cc[n+](cc1C)[O-] 271570a_100000694244_100000074940 [0,2,0,0,1,0|1,0,0]=4 13661 B11R1.166 C=C(C)c1ccc(=O)[nH]c1N 271570a_100000694244_100009884077 [0,2,0,0,1,0|1,0,0]=4 13662 B11R1.166 C=C(C)c1ccc(c[n+]1[O-])C 271570a_100000694244_100009819918 [0,2,0,0,1,0|1,0,0]=4 13663 B11R1.166 C=C(C)c1ccc(c[n+]1[O-])F 271570a_100000694244_100009817261 [0,2,0,0,1,0|1,0,0]=4 13664 B11R1.166 C=C(C)c1ccc(cc1Br)Br 271570a_100000694244_100011484698 [0,2,0,0,1,0|0,0,0]=3 13665 B11R1.166 C=C(C)c1ccc(cc1Br)C 271570a_100000694244_100009813563 [0,2,0,0,1,0|0,0,0]=3 13666 B11R1.166 C=C(C)c1ccc(cc1Br)Cl 271570a_100000694244_100011219703 [0,2,0,0,1,0|0,0,0]=3 13667 B11R1.166 C=C(C)c1ccc(cc1Br)F 271570a_100000694244_100011217111 [0,2,0,0,1,0|0,0,0]=3 13668 B11R1.166 C=C(C)c1ccc(cc1Br)N 271570a_100000694244_100000750458 [0,2,0,0,1,0|0,0,0]=3 13669 B11R1.166 C=C(C)c1ccc(cc1Br)O 271570a_100000694244_100000701344 [0,2,0,0,1,0|0,0,0]=3 13670 B11R1.166 C=C(C)c1ccc(cc1C)Br 271570a_100000694244_100000701812 [0,2,0,0,1,0|0,0,0]=3 13671 B11R1.166 C=C(C)c1ccc(cc1C)C 271570a_100000694244_100011217332 [0,2,0,0,1,0|0,0,0]=3 13672 B11R1.166 C=C(C)c1ccc(cc1C)Cl 271570a_100000694244_100011219607 [0,2,0,0,1,0|0,0,0]=3 13673 B11R1.166 C=C(C)c1ccc(cc1C)F 271570a_100000694244_100011205405 [0,2,0,0,1,0|0,0,0]=3 13674 B11R1.166 C=C(C)c1ccc(cc1C)N 271570a_100000694244_100000210723 [0,2,0,0,1,0|0,0,0]=3 13675 B11R1.166 C=C(C)c1ccc(cc1C)O 271570a_100000694244_100000729255 [0,2,0,0,1,0|0,0,0]=3 13676 B11R1.166 C=C(C)c1ccc(cc1Cl)Br 271570a_100000694244_100011216062 [0,2,0,0,1,0|0,0,0]=3 13677 B11R1.166 C=C(C)c1ccc(cc1Cl)C 271570a_100000694244_100011263221 [0,2,0,0,1,0|0,0,0]=3 13678 B11R1.166 C=C(C)c1ccc(cc1Cl)Cl 271570a_100000694244_100000699841 [0,2,0,0,1,0|0,0,0]=3 13679 B11R1.166 C=C(C)c1ccc(cc1Cl)F 271570a_100000694244_100000733362 [0,2,0,0,1,0|0,0,0]=3 13680 B11R1.166 C=C(C)c1ccc(cc1Cl)N 271570a_100000694244_100000761885 [0,2,0,0,1,0|0,0,0]=3 13681 B11R1.166 C=C(C)c1ccc(cc1Cl)O 271570a_100000694244_100000047559 [0,2,0,0,1,0|0,0,0]=3 13682 B11R1.166 C=C(C)c1ccc(cc1F)Br 271570a_100000694244_100009814013 [0,2,0,0,1,0|0,0,0]=3 13683 B11R1.166 C=C(C)c1ccc(cc1F)C 271570a_100000694244_100011216119 [0,2,0,0,1,0|0,0,0]=3 13684 B11R1.166 C=C(C)c1ccc(cc1F)Cl 271570a_100000694244_100011216042 [0,2,0,0,1,0|0,0,0]=3 13685 B11R1.166 C=C(C)c1ccc(cc1F)F 271570a_100000694244_100000750030 [0,2,0,0,1,0|0,0,0]=3 13686 B11R1.166 C=C(C)c1ccc(cc1F)N 271570a_100000694244_100011356925 [0,2,0,0,1,0|0,0,0]=3 13687 B11R1.166 C=C(C)c1ccc(cc1F)O 271570a_100000694244_100000755031 [0,2,0,0,1,0|0,0,0]=3 13688 B11R1.166 C=C(C)c1ccc(cc1N)Br 271570a_100000694244_100000743836 [0,2,0,0,1,0|0,0,0]=3 13689 B11R1.166 C=C(C)c1ccc(cc1N)C 271570a_100000694244_100011216686 [0,2,0,0,1,0|0,0,0]=3 13690 B11R1.166 C=C(C)c1ccc(cc1N)Cl 271570a_100000694244_100000761886 [0,2,0,0,1,0|0,0,0]=3 13691 B11R1.166 C=C(C)c1ccc(cc1N)F 271570a_100000694244_100011218093 [0,2,0,0,1,0|0,0,0]=3 13692 B11R1.166 C=C(C)c1ccc(cc1N)N 271570a_100000694244_200012175722 [0,2,0,0,1,0|0,0,0]=3 13693 B11R1.166 C=C(C)c1ccc(cc1N)O 271570a_100000694244_100011999798 [0,2,0,0,1,0|0,0,0]=3 13694 B11R1.166 C=C(C)c1ccc(cc1O)Br 271570a_100000694244_100012344904 [0,2,0,0,1,0|0,0,0]=3 13695 B11R1.166 C=C(C)c1ccc(cc1O)C 271570a_100000694244_100012002257 [0,2,0,0,1,0|0,0,0]=3 13696 B11R1.166 C=C(C)c1ccc(cc1O)Cl 271570a_100000694244_100000050036 [0,2,0,0,1,0|0,0,0]=3 13697 B11R1.166 C=C(C)c1ccc(cc1O)F 271570a_100000694244_100000690578 [0,2,0,0,1,0|0,0,0]=3 13698 B11R1.166 C=C(C)c1ccc(cc1O)O 271570a_100000694244_100009813921 [0,2,0,0,1,0|0,0,0]=3 13699 B11R1.166 C=C(C)c1ccc(nc1Br)N 271570a_100000694244_100010734177 [0,2,0,0,1,0|1,0,0]=4 13700 B11R1.166 C=C(C)c1ccc(nc1C)C 271570a_100000694244_100009813853 [0,2,0,0,1,0|1,0,0]=4 13701 B11R1.166 C=C(C)c1ccc(nc1C)Cl 271570a_100000694244_100000062408 [0,2,0,0,1,0|1,0,0]=4 13702 B11R1.166 C=C(C)c1ccc(nc1C)F 271570a_100000694244_100000688911 [0,2,0,0,1,0|1,0,0]=4 13703 B11R1.166 C=C(C)c1ccc(nc1C)N 271570a_100000694244_100000013003 [0,2,0,0,1,0|1,0,0]=4 13704 B11R1.166 C=C(C)c1ccc(nc1C)O 271570a_100000694244_100000691680 [0,2,0,0,1,0|1,0,0]=4 13705 B11R1.166 C=C(C)c1ccc(nc1Cl)Br 271570a_100000694244_100010246183 [0,2,0,0,1,0|1,0,0]=4 13706 B11R1.166 C=C(C)c1ccc(nc1Cl)N 271570a_100000694244_100010270343 [0,2,0,0,1,0|1,0,0]=4 13707 B11R1.166 C=C(C)c1ccc(nc1F)C 271570a_100000694244_100010006597 [0,2,0,0,1,0|1,0,0]=4 13708 B11R1.166 C=C(C)c1ccc(nc1F)Cl 271570a_100000694244_100010168078 [0,2,0,0,1,0|1,0,0]=4 13709 B11R1.166 C=C(C)c1ccc(nc1F)F 271570a_100000694244_100000070099 [0,2,0,0,1,0|1,0,0]=4 13710 B11R1.166 C=C(C)c1ccc(nc1F)N 271570a_100000694244_100009882772 [0,2,0,0,1,0|1,0,0]=4 13711 B11R1.166 C=C(C)c1ccc(nc1F)O 271570a_100000694244_100009879308 [0,2,0,0,1,0|1,0,0]=4 13712 B11R1.166 C=C(C)c1ccc(nc1N)C 271570a_100000694244_100009816662 [0,2,0,0,1,0|1,0,0]=4 13713 B11R1.166 C=C(C)c1ccc(nc1N)Cl 271570a_100000694244_100010171640 [0,2,0,0,1,0|1,0,0]=4 13714 B11R1.166 C=C(C)c1ccc(nc1N)F 271570a_100000694244_100009854977 [0,2,0,0,1,0|1,0,0]=4 13715 B11R1.166 C=C(C)c1ccc(nc1N)N 271570a_100000694244_100011356871 [0,2,0,0,1,0|1,0,0]=4 13716 B11R1.166 C=C(C)c1ccc(nc1O)C 271570a_100000694244_100009817604 [0,2,0,0,1,0|1,0,0]=4 13717 B11R1.166 C=C(C)c1cnc(cc1Br)F 271570a_100000694244_100015451857 [0,2,0,0,1,0|1,0,0]=4 13718 B11R1.166 C=C(C)c1cnc(cc1Br)N 271570a_100000694244_100010074611 [0,2,0,0,1,0|1,0,0]=4 13719 B11R1.166 C=C(C)c1cnc(cc1C)Br 271570a_100000694244_100009816104 [0,2,0,0,1,0|1,0,0]=4 13720 B11R1.166 C=C(C)c1cnc(cc1C)C 271570a_100000694244_100009819613 [0,2,0,0,1,0|1,0,0]=4 13721 B11R1.166 C=C(C)c1cnc(cc1C)Cl 271570a_100000694244_100010172789 [0,2,0,0,1,0|1,0,0]=4 13722 B11R1.166 C=C(C)c1cnc(cc1C)F 271570a_100000694244_100009820716 [0,2,0,0,1,0|1,0,0]=4 13723 B11R1.166 C=C(C)c1cnc(cc1C)N 271570a_100000694244_100000050067 [0,2,0,0,1,0|1,0,0]=4 13724 B11R1.166 C=C(C)c1cnc(cc1C)O 271570a_100000694244_100010114363 [0,2,0,0,1,0|1,0,0]=4 13725 B11R1.166 C=C(C)c1cnc(cc1Cl)Br 271570a_100000694244_100010381092 [0,2,0,0,1,0|1,0,0]=4 13726 B11R1.166 C=C(C)c1cnc(cc1Cl)Cl 271570a_100000694244_100010200927 [0,2,0,0,1,0|1,0,0]=4 13727 B11R1.166 C=C(C)c1cnc(cc1Cl)N 271570a_100000694244_100000694920 [0,2,0,0,1,0|1,0,0]=4 13728 B11R1.166 C=C(C)c1cnc(cc1F)Cl 271570a_100000694244_100010128100 [0,2,0,0,1,0|1,0,0]=4 13729 B11R1.166 C=C(C)c1cnc(cc1F)N 271570a_100000694244_100009844730 [0,2,0,0,1,0|1,0,0]=4 13730 B11R1.166 C=C(C)c1cnc(cc1N)C 271570a_100000694244_100009817891 [0,2,0,0,1,0|1,0,0]=4 13731 B11R1.166 C=C(C)c1cnc(cc1N)N 271570a_100000694244_200009857908 [0,2,0,0,1,0|1,0,0]=4 13732 B11R1.166 C=C(C)c1cnc(cc1O)C 271570a_100000694244_100011016184 [0,2,0,0,1,0|1,0,0]=4 13733 B11R1.166 C=C(C)c1ncc(cc1Br)Cl 271570a_100000694244_100012154958 [0,2,0,0,1,0|1,0,0]=4 13734 B11R1.166 C=C(C)c1ncc(cc1C)Br 271570a_100000694244_100012353652 [0,2,0,0,1,0|1,0,0]=4 13735 B11R1.166 C=C(C)c1ncc(cc1C)C 271570a_100000694244_100009864548 [0,2,0,0,1,0|1,0,0]=4 13736 B11R1.166 C=C(C)c1ncc(cc1C)F 271570a_100000694244_100009817009 [0,2,0,0,1,0|1,0,0]=4 13737 B11R1.166 C=C(C)c1ncc(cc1C)N 271570a_100000694244_100000761747 [0,2,0,0,1,0|1,0,0]=4 13738 B11R1.166 C=C(C)c1ncc(cc1C)O 271570a_100000694244_100012000486 [0,2,0,0,1,0|1,0,0]=4 13739 B11R1.166 C=C(C)c1ncc(cc1F)Br 271570a_100000694244_100012348576 [0,2,0,0,1,0|1,0,0]=4 13740 B11R1.166 C=C(C)c1ncc(cc1F)C 271570a_100000694244_100009819633 [0,2,0,0,1,0|1,0,0]=4 13741 B11R1.166 C=C(C)c1ncc(cc1F)Cl 271570a_100000694244_100012348686 [0,2,0,0,1,0|1,0,0]=4 13742 B11R1.166 C=C(C)c1ncc(cc1F)F 271570a_100000694244_100011219543 [0,2,0,0,1,0|1,0,0]=4 13743 B11R1.166 C=C(C)c1ncc(cc1F)N 271570a_100000694244_100010280766 [0,2,0,0,1,0|1,0,0]=4 13744 B11R1.166 C=C(C)c1ncc(cc1F)O 271570a_100000694244_100000063512 [0,2,0,0,1,0|1,0,0]=4 13745 B11R1.166 C=C(C)c1ncc(cc1N)Br 271570a_100000694244_100010090555 [0,2,0,0,1,0|1,0,0]=4 13746 B11R1.166 C=C(C)c1ncc(cc1N)C 271570a_100000694244_100000733613 [0,2,0,0,1,0|1,0,0]=4 13747 B11R1.166 C=C(C)c1ncc(cc1N)F 271570a_100000694244_100009817643 [0,2,0,0,1,0|1,0,0]=4 13748 B11R1.166 C=C(C)c1ncc(cc1N)N 271570a_100000694244_200000093520 [0,2,0,0,1,0|1,0,0]=4 13749 B11R1.166 C=C(C)c1ncc(cc1O)Br 271570a_100000694244_100010210634 [0,2,0,0,1,0|1,0,0]=4 13750 B11R1.166 C=C(C)c1ncc(cc1O)C 271570a_100000694244_100012000487 [0,2,0,0,1,0|1,0,0]=4 13751 B11R1.166 C=C(C)c1ncc(cc1O)Cl 271570a_100000694244_100010233512 [0,2,0,0,1,0|1,0,0]=4 13752 B11R1.166 C=C(C)c1ncc(cc1O)F 271570a_100000694244_100000079967 [0,2,0,0,1,0|1,0,0]=4 13753 B11R1.166 CC(=O)c1ccc(cc1Br)Br 1458a_100000762965_200000210301 [0,2,0,0,1,0|1,0,0]=4 13754 B11R1.166 CC(=O)c1ccc(cc1Br)C 1458a_100000685072_200000210301 [0,2,0,0,1,0|1,0,0]=4 13755 B11R1.166 CC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_200000210301 [0,2,0,0,1,0|1,0,0]=4 13756 B11R1.166 CC(=O)c1ccc(cc1Br)F 1458a_100000212304_200000210301 [0,2,0,0,1,0|1,0,0]=4 13757 B11R1.166 CC(=O)c1ccc(cc1Br)I 1458a_100012360512_200000210301 [0,2,0,0,1,0|1,0,0]=4 13758 B11R1.166 CC(=O)c1ccc(cc1Br)O 1458a_100012344906_200000210301 [0,2,0,0,1,0|1,0,0]=4 13759 B11R1.166 CC(=O)c1ccc(cc1C)Br 1458a_100000741311_200000210301 [0,2,0,0,1,0|1,0,0]=4 13760 B11R1.166 CC(=O)c1ccc(cc1C)C 1458a_100000211164_200000210301 [0,2,0,0,1,0|1,0,0]=4 13761 B11R1.166 CC(=O)c1ccc(cc1C)Cl 1458a_100000688705_200000210301 [0,2,0,0,1,0|1,0,0]=4 13762 B11R1.166 CC(=O)c1ccc(cc1C)F 1458a_100000686989_200000210301 [0,2,0,0,1,0|1,0,0]=4 13763 B11R1.166 CC(=O)c1ccc(cc1C)I 1458a_100010189873_200000210301 [0,2,0,0,1,0|1,0,0]=4 13764 B11R1.166 CC(=O)c1ccc(cc1C)O 1458a_100000692822_200000210301 [0,2,0,0,1,0|1,0,0]=4 13765 B11R1.166 CC(=O)c1ccc(cc1C)O 271570a_203496583355_100012360112 [0,2,0,0,1,0|1,0,0]=4 13766 B11R1.166 CC(=O)c1ccc(cc1Cl)Br 1458a_100000741628_200000210301 [0,2,0,0,1,0|1,0,0]=4 13767 B11R1.166 CC(=O)c1ccc(cc1Cl)C 1458a_100000766932_200000210301 [0,2,0,0,1,0|1,0,0]=4 13768 B11R1.166 CC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_200000210301 [0,2,0,0,1,0|1,0,0]=4 13769 B11R1.166 CC(=O)c1ccc(cc1Cl)F 1458a_100000211397_200000210301 [0,2,0,0,1,0|1,0,0]=4 13770 B11R1.166 CC(=O)c1ccc(cc1Cl)I 1458a_100000751301_200000210301 [0,2,0,0,1,0|1,0,0]=4 13771 B11R1.166 CC(=O)c1ccc(cc1Cl)O 1458a_100000702456_200000210301 [0,2,0,0,1,0|1,0,0]=4 13772 B11R1.166 CC(=O)c1ccc(cc1F)Br 1458a_100000214689_200000210301 [0,2,0,0,1,0|1,0,0]=4 13773 B11R1.166 CC(=O)c1ccc(cc1F)C 1458a_100000766033_200000210301 [0,2,0,0,1,0|1,0,0]=4 13774 B11R1.166 CC(=O)c1ccc(cc1F)Cl 1458a_100000212326_200000210301 [0,2,0,0,1,0|1,0,0]=4 13775 B11R1.166 CC(=O)c1ccc(cc1F)F 1458a_100000211022_200000210301 [0,2,0,0,1,0|1,0,0]=4 13776 B11R1.166 CC(=O)c1ccc(cc1F)I 1458a_100000037189_200000210301 [0,2,0,0,1,0|1,0,0]=4 13777 B11R1.166 CC(=O)c1ccc(cc1F)O 1458a_100000689029_200000210301 [0,2,0,0,1,0|1,0,0]=4 13778 B11R1.166 CC(=O)c1ccc(cc1F)O 271570a_203496583355_100000690205 [0,2,0,0,1,0|1,0,0]=4 13779 B11R1.166 CC(=O)c1ccc(cc1I)Br 1458a_100000751167_200000210301 [0,2,0,0,1,0|1,0,0]=4 13780 B11R1.166 CC(=O)c1ccc(cc1I)C 1458a_100009999607_200000210301 [0,2,0,0,1,0|1,0,0]=4 13781 B11R1.166 CC(=O)c1ccc(cc1I)Cl 1458a_100000739380_200000210301 [0,2,0,0,1,0|1,0,0]=4 13782 B11R1.166 CC(=O)c1ccc(cc1I)F 1458a_100000739341_200000210301 [0,2,0,0,1,0|1,0,0]=4 13783 B11R1.166 CC(=O)c1ccc(cc1N)O 271570a_203496583355_100011590516 [0,2,0,0,1,0|1,0,0]=4 13784 B11R1.166 CC(=O)c1ccc(cc1O)Br 1458a_100000744433_200000210301 [0,2,0,0,1,0|1,0,0]=4 13785 B11R1.166 CC(=O)c1ccc(cc1O)C 1458a_100000212137_200000210301 [0,2,0,0,1,0|1,0,0]=4 13786 B11R1.166 CC(=O)c1ccc(cc1O)C 271570a_203496583355_100012353930 [0,2,0,0,1,0|1,0,0]=4 13787 B11R1.166 CC(=O)c1ccc(cc1O)Cl 1458a_100000188622_200000210301 [0,2,0,0,1,0|1,0,0]=4 13788 B11R1.166 CC(=O)c1ccc(cc1O)F 1458a_100000746061_200000210301 [0,2,0,0,1,0|1,0,0]=4 13789 B11R1.166 CC(=O)c1ccc(cc1O)F 271570a_203496583355_100000686192 [0,2,0,0,1,0|1,0,0]=4 13790 B11R1.166 CC(=O)c1ccc(cc1O)I 1458a_100000091984_200000210301 [0,2,0,0,1,0|1,0,0]=4 13791 B11R1.166 CC(=O)c1ccc(cc1O)O 1458a_100000212172_200000210301 [0,2,0,0,1,0|1,0,0]=4 13792 B11R1.166 CC(=O)c1ccc(cc1O)O 271570a_203496583355_100000188348 [0,2,0,0,1,0|1,0,0]=4 13793 B11R1.166 CC(=O)c1ccc(cc1O)O 271570a_203496583355_100012340537 [0,2,0,0,1,0|1,0,0]=4 13794 B11R1.166 Cc1cc(ccc1C(=O)[13CH3])Br 1458a_100000741311_200025704644 [0,2,0,0,1,0|1,0,0]=4 13795 B11R1.166 Cc1cc(ccc1C(=O)[13CH3])Cl 1458a_100000688705_200025704644 [0,2,0,0,1,0|1,0,0]=4 13796 B11R1.166 Cc1cc(ccc1C(=O)[13CH3])F 1458a_100000686989_200025704644 [0,2,0,0,1,0|1,0,0]=4 13797 B11R1.166 Cc1cc(ccc1C(=O)[13CH3])I 1458a_100010189873_200025704644 [0,2,0,0,1,0|1,0,0]=4 13798 B11R1.166 Cc1cc(ccc1C(=O)[13CH3])O 1458a_100000692822_200025704644 [0,2,0,0,1,0|1,0,0]=4 13799 B11R1.166 Cc1ccc(c(c1)Br)C(=O)[13CH3] 1458a_100000685072_200025704644 [0,2,0,0,1,0|1,0,0]=4 13800 B11R1.166 Cc1ccc(c(c1)C)C(=O)[13CH3] 1458a_100000211164_200025704644 [0,2,0,0,1,0|1,0,0]=4 13801 B11R1.166 Cc1ccc(c(c1)Cl)C(=O)[13CH3] 1458a_100000766932_200025704644 [0,2,0,0,1,0|1,0,0]=4 13802 B11R1.166 Cc1ccc(c(c1)F)C(=O)[13CH3] 1458a_100000766033_200025704644 [0,2,0,0,1,0|1,0,0]=4 13803 B11R1.166 Cc1ccc(c(c1)I)C(=O)[13CH3] 1458a_100009999607_200025704644 [0,2,0,0,1,0|1,0,0]=4 13804 B11R1.166 Cc1ccc(c(c1)O)C(=O)[13CH3] 1458a_100000212137_200025704644 [0,2,0,0,1,0|1,0,0]=4 13805 B11R1.166 [13CH3]C(=O)c1ccc(cc1Br)Br 1458a_100000762965_200025704644 [0,2,0,0,1,0|1,0,0]=4 13806 B11R1.166 [13CH3]C(=O)c1ccc(cc1Br)Cl 1458a_100000766353_200025704644 [0,2,0,0,1,0|1,0,0]=4 13807 B11R1.166 [13CH3]C(=O)c1ccc(cc1Br)F 1458a_100000212304_200025704644 [0,2,0,0,1,0|1,0,0]=4 13808 B11R1.166 [13CH3]C(=O)c1ccc(cc1Br)I 1458a_100012360512_200025704644 [0,2,0,0,1,0|1,0,0]=4 13809 B11R1.166 [13CH3]C(=O)c1ccc(cc1Br)O 1458a_100012344906_200025704644 [0,2,0,0,1,0|1,0,0]=4 13810 B11R1.166 [13CH3]C(=O)c1ccc(cc1Cl)Br 1458a_100000741628_200025704644 [0,2,0,0,1,0|1,0,0]=4 13811 B11R1.166 [13CH3]C(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_200025704644 [0,2,0,0,1,0|1,0,0]=4 13812 B11R1.166 [13CH3]C(=O)c1ccc(cc1Cl)F 1458a_100000211397_200025704644 [0,2,0,0,1,0|1,0,0]=4 13813 B11R1.166 [13CH3]C(=O)c1ccc(cc1Cl)I 1458a_100000751301_200025704644 [0,2,0,0,1,0|1,0,0]=4 13814 B11R1.166 [13CH3]C(=O)c1ccc(cc1Cl)O 1458a_100000702456_200025704644 [0,2,0,0,1,0|1,0,0]=4 13815 B11R1.166 [13CH3]C(=O)c1ccc(cc1F)Br 1458a_100000214689_200025704644 [0,2,0,0,1,0|1,0,0]=4 13816 B11R1.166 [13CH3]C(=O)c1ccc(cc1F)Cl 1458a_100000212326_200025704644 [0,2,0,0,1,0|1,0,0]=4 13817 B11R1.166 [13CH3]C(=O)c1ccc(cc1F)F 1458a_100000211022_200025704644 [0,2,0,0,1,0|1,0,0]=4 13818 B11R1.166 [13CH3]C(=O)c1ccc(cc1F)I 1458a_100000037189_200025704644 [0,2,0,0,1,0|1,0,0]=4 13819 B11R1.166 [13CH3]C(=O)c1ccc(cc1F)O 1458a_100000689029_200025704644 [0,2,0,0,1,0|1,0,0]=4 13820 B11R1.166 [13CH3]C(=O)c1ccc(cc1I)Br 1458a_100000751167_200025704644 [0,2,0,0,1,0|1,0,0]=4 13821 B11R1.166 [13CH3]C(=O)c1ccc(cc1I)Cl 1458a_100000739380_200025704644 [0,2,0,0,1,0|1,0,0]=4 13822 B11R1.166 [13CH3]C(=O)c1ccc(cc1I)F 1458a_100000739341_200025704644 [0,2,0,0,1,0|1,0,0]=4 13823 B11R1.166 [13CH3]C(=O)c1ccc(cc1O)Br 1458a_100000744433_200025704644 [0,2,0,0,1,0|1,0,0]=4 13824 B11R1.166 [13CH3]C(=O)c1ccc(cc1O)Cl 1458a_100000188622_200025704644 [0,2,0,0,1,0|1,0,0]=4 13825 B11R1.166 [13CH3]C(=O)c1ccc(cc1O)F 1458a_100000746061_200025704644 [0,2,0,0,1,0|1,0,0]=4 13826 B11R1.166 [13CH3]C(=O)c1ccc(cc1O)I 1458a_100000091984_200025704644 [0,2,0,0,1,0|1,0,0]=4 13827 B11R1.166 [13CH3]C(=O)c1ccc(cc1O)O 1458a_100000212172_200025704644 [0,2,0,0,1,0|1,0,0]=4 13828 B11R1.53 C#Cc1ccccc1C(=O)C 1458a_100011243808_200000210301 [0,2,0,0,1,0|1,0,0]=4 13829 B11R1.53 C#Cc1ccccc1C(=O)[13CH3] 1458a_100011243808_200025704644 [0,2,0,0,1,0|1,0,0]=4 13830 B11R1.53 C=C(C)c1ccccc1C#N 271570a_100000694244_100000188569 [0,2,0,0,1,0|0,0,0]=3 13831 B11R1.53 C=C(C)c1ccccc1C=O 271570a_100000694244_100000211189 [0,2,0,0,1,0|0,0,0]=3 13832 B11R1.53 C=C(C)c1ccccc1CC 271570a_100000694244_100011215823 [0,2,0,0,1,0|0,0,0]=3 13833 B11R1.53 C=C(C)c1ccccc1CN 271570a_100000694244_100000689332 [0,2,0,0,1,0|0,0,0]=3 13834 B11R1.53 C=C(C)c1ccccc1CO 271570a_100000694244_100000187465 [0,2,0,0,1,0|0,0,0]=3 13835 B11R1.53 C=C(C)c1ccccc1NC 271570a_100000694244_100020606079 [0,2,0,0,1,0|0,0,0]=3 13836 B11R1.53 C=C(C)c1ccccc1NC 34a_100000037685_200000210301 [0,2,0,0,1,0|0,0,0]=3 13837 B11R1.53 C=C(C)c1ccccc1NN 271570a_100000694244_100000241748 [0,2,0,0,1,0|0,0,0]=3 13838 B11R1.53 C=C(C)c1ccccc1N[13CH3] 34a_100000037685_200025704644 [0,2,0,0,1,0|0,0,0]=3 13839 B11R1.53 C=C(C)c1ccccc1OC 271570a_100000694244_100000174000 [0,2,0,0,1,0|0,0,0]=3 13840 B11R1.53 C=C(C)c1ccccc1SC 271570a_100000694244_100011217816 [0,2,0,0,1,0|0,0,0]=3 13841 B11R1.53 C=C(C)c1cccnc1C#N 271570a_100000694244_100000685805 [0,2,0,0,1,0|1,0,0]=4 13842 B11R1.53 C=C(C)c1cccnc1C=O 271570a_100000694244_100011934733 [0,2,0,0,1,0|1,0,0]=4 13843 B11R1.53 C=C(C)c1cccnc1CC 271570a_100000694244_100009877225 [0,2,0,0,1,0|1,0,0]=4 13844 B11R1.53 C=C(C)c1cccnc1CN 271570a_100000694244_100020591323 [0,2,0,0,1,0|1,0,0]=4 13845 B11R1.53 C=C(C)c1cccnc1CO 271570a_100000694244_100011996772 [0,2,0,0,1,0|1,0,0]=4 13846 B11R1.53 C=C(C)c1cccnc1NC 271570a_100000694244_100000700899 [0,2,0,0,1,0|1,0,0]=4 13847 B11R1.53 C=C(C)c1cccnc1NN 271570a_100000694244_100011464834 [0,2,0,0,1,0|1,0,0]=4 13848 B11R1.53 C=C(C)c1cccnc1OC 271570a_100000694244_100000047025 [0,2,0,0,1,0|1,0,0]=4 13849 B11R1.53 C=C(C)c1cccnc1SC 271570a_100000694244_100011465278 [0,2,0,0,1,0|1,0,0]=4 13850 B11R1.53 C=C(C)c1ccncc1C#N 271570a_100000694244_100000687039 [0,2,0,0,1,0|1,0,0]=4 13851 B11R1.53 C=C(C)c1ccncc1C=O 271570a_100000694244_100000050567 [0,2,0,0,1,0|1,0,0]=4 13852 B11R1.53 C=C(C)c1ccncc1CC 271570a_100000694244_100025704421 [0,2,0,0,1,0|1,0,0]=4 13853 B11R1.53 C=C(C)c1ccncc1CO 271570a_100000694244_100000117392 [0,2,0,0,1,0|1,0,0]=4 13854 B11R1.53 C=C(C)c1ccncc1OC 271570a_100000694244_100016988167 [0,2,0,0,1,0|1,0,0]=4 13855 B11R1.53 C=C(C)c1cnccc1C#N 271570a_100000694244_100000684818 [0,2,0,0,1,0|1,0,0]=4 13856 B11R1.53 C=C(C)c1cnccc1C=O 271570a_100000694244_100011934409 [0,2,0,0,1,0|1,0,0]=4 13857 B11R1.53 C=C(C)c1cnccc1CC 271570a_100000694244_100009819861 [0,2,0,0,1,0|1,0,0]=4 13858 B11R1.53 C=C(C)c1cnccc1CN 271570a_100000694244_100020640021 [0,2,0,0,1,0|1,0,0]=4 13859 B11R1.53 C=C(C)c1cnccc1CO 271570a_100000694244_100009873359 [0,2,0,0,1,0|1,0,0]=4 13860 B11R1.53 C=C(C)c1cnccc1NC 271570a_100000694244_100010069531 [0,2,0,0,1,0|1,0,0]=4 13861 B11R1.53 C=C(C)c1cnccc1NN 271570a_100000694244_100013404636 [0,2,0,0,1,0|1,0,0]=4 13862 B11R1.53 C=C(C)c1cnccc1OC 271570a_100000694244_100011997281 [0,2,0,0,1,0|1,0,0]=4 13863 B11R1.53 C=C(C)c1ncccc1C#N 271570a_100000694244_100000211984 [0,2,0,0,1,0|1,0,0]=4 13864 B11R1.53 C=C(C)c1ncccc1C=O 271570a_100000694244_100009816751 [0,2,0,0,1,0|1,0,0]=4 13865 B11R1.53 C=C(C)c1ncccc1CN 271570a_100000694244_100015189234 [0,2,0,0,1,0|1,0,0]=4 13866 B11R1.53 C=C(C)c1ncccc1CO 271570a_100000694244_100000748726 [0,2,0,0,1,0|1,0,0]=4 13867 B11R1.53 C=C(C)c1ncccc1NC 271570a_100000694244_200011806188 [0,2,0,0,1,0|1,0,0]=4 13868 B11R1.53 C=C(C)c1ncccc1OC 271570a_100000694244_100000690851 [0,2,0,0,1,0|1,0,0]=4 13869 B11R1.53 C=Cc1ccccc1C(=O)C 1458a_100011830265_200000210301 [0,2,0,0,1,0|1,0,0]=4 13870 B11R1.53 C=Cc1ccccc1C(=O)C 271570a_100011290941_100000751169 [0,2,0,0,1,0|1,0,0]=4 13871 B11R1.53 C=Cc1ccccc1C(=O)[13CH3] 1458a_100011830265_200025704644 [0,2,0,0,1,0|1,0,0]=4 13872 B11R1.53 CC(=O)c1ccccc1C#N 1458a_100000742908_200000210301 [0,2,0,0,1,0|1,0,0]=4 13873 B11R1.53 CC(=O)c1ccccc1CO 1458a_100011301526_200000210301 [0,2,0,0,1,0|1,0,0]=4 13874 B11R1.53 CC(=O)c1ccccc1I=O 1458a_100000032414_200000210301 [0,2,0,0,1,0|1,0,0]=4 13875 B11R1.53 CC(=O)c1ccccc1S[13CH3] 62a_100000751169_200025704644 [0,2,0,0,1,0|1,0,0]=4 13876 B11R1.53 CCc1ccccc1C(=O)C 1458a_100000689120_200000210301 [0,2,0,0,1,0|1,0,0]=4 13877 B11R1.53 CCc1ccccc1C(=O)[13CH3] 1458a_100000689120_200025704644 [0,2,0,0,1,0|1,0,0]=4 13878 B11R1.53 COc1ccccc1C(=O)C 1458a_100000185835_200000210301 [0,2,0,0,1,0|1,0,0]=4 13879 B11R1.53 COc1ccccc1C(=O)[13CH3] 1458a_100000185835_200025704644 [0,2,0,0,1,0|1,0,0]=4 13880 B11R1.53 CSc1ccccc1C(=O)C 1458a_100000183967_200000210301 [0,2,0,0,1,0|1,0,0]=4 13881 B11R1.53 CSc1ccccc1C(=O)C 62a_100000751169_200000210301 [0,2,0,0,1,0|1,0,0]=4 13882 B11R1.53 CSc1ccccc1C(=O)[13CH3] 1458a_100000183967_200025704644 [0,2,0,0,1,0|1,0,0]=4 13883 B11R1.53 [13CH3]C(=O)c1ccccc1C#N 1458a_100000742908_200025704644 [0,2,0,0,1,0|1,0,0]=4 13884 B11R1.53 [13CH3]C(=O)c1ccccc1CO 1458a_100011301526_200025704644 [0,2,0,0,1,0|1,0,0]=4 13885 B11R1.53 [13CH3]C(=O)c1ccccc1I=O 1458a_100000032414_200025704644 [0,2,0,0,1,0|1,0,0]=4 13886 B11R1.156 C=C(C)c1c(ccc[n+]1[O-])C 271570a_100000694244_100116209805 [0,2,0,0,1,0|1,0,0]=4 13887 B11R1.156 C=C(C)c1c(cccc1Br)Br 271570a_100000694244_100009994525 [0,2,0,0,1,0|0,0,0]=3 13888 B11R1.156 C=C(C)c1c(cccc1Br)Cl 271570a_100000694244_100010214488 [0,2,0,0,1,0|0,0,0]=3 13889 B11R1.156 C=C(C)c1c(cccc1Br)F 271570a_100000694244_100011219512 [0,2,0,0,1,0|0,0,0]=3 13890 B11R1.156 C=C(C)c1c(cccc1Br)N 271570a_100000694244_100020590159 [0,2,0,0,1,0|0,0,0]=3 13891 B11R1.156 C=C(C)c1c(cccc1Br)O 271570a_100000694244_100010187912 [0,2,0,0,1,0|0,0,0]=3 13892 B11R1.156 C=C(C)c1c(cccc1C)C 271570a_100000694244_100000033847 [0,2,0,0,1,0|0,0,0]=3 13893 B11R1.156 C=C(C)c1c(cccc1Cl)C 271570a_100000694244_100000043165 [0,2,0,0,1,0|0,0,0]=3 13894 B11R1.156 C=C(C)c1c(cccc1Cl)Cl 271570a_100000694244_100000034237 [0,2,0,0,1,0|0,0,0]=3 13895 B11R1.156 C=C(C)c1c(cccc1Cl)F 271570a_100000694244_100000050007 [0,2,0,0,1,0|0,0,0]=3 13896 B11R1.156 C=C(C)c1c(cccc1Cl)N 271570a_100000694244_100000049713 [0,2,0,0,1,0|0,0,0]=3 13897 B11R1.156 C=C(C)c1c(cccc1Cl)O 271570a_100000694244_100000050174 [0,2,0,0,1,0|0,0,0]=3 13898 B11R1.156 C=C(C)c1c(cccc1F)C 271570a_100000694244_100012349962 [0,2,0,0,1,0|0,0,0]=3 13899 B11R1.156 C=C(C)c1c(cccc1F)F 271570a_100000694244_100000693133 [0,2,0,0,1,0|0,0,0]=3 13900 B11R1.156 C=C(C)c1c(cccc1F)N 271570a_100000694244_100011934729 [0,2,0,0,1,0|0,0,0]=3 13901 B11R1.156 C=C(C)c1c(cccc1F)O 271570a_100000694244_100009820682 [0,2,0,0,1,0|0,0,0]=3 13902 B11R1.156 C=C(C)c1c(cccc1N)C 271570a_100000694244_100000684715 [0,2,0,0,1,0|0,0,0]=3 13903 B11R1.156 C=C(C)c1c(cccc1O)C 271570a_100000694244_100000686692 [0,2,0,0,1,0|0,0,0]=3 13904 B11R1.156 C=C(C)c1c(cccc1O)N 271570a_100000694244_100012183704 [0,2,0,0,1,0|0,0,0]=3 13905 B11R1.156 C=C(C)c1c(cccc1O)O 271570a_100000694244_100010205330 [0,2,0,0,1,0|0,0,0]=3 13906 B11R1.156 C=C(C)c1c(ccnc1C)C 271570a_100000694244_100012000501 [0,2,0,0,1,0|1,0,0]=4 13907 B11R1.156 C=C(C)c1c(ccnc1C)N 271570a_100000694244_100010243816 [0,2,0,0,1,0|1,0,0]=4 13908 B11R1.156 C=C(C)c1c(ccnc1F)C 271570a_100000694244_100009818256 [0,2,0,0,1,0|1,0,0]=4 13909 B11R1.156 C=C(C)c1c(ccnc1F)F 271570a_100000694244_100009874084 [0,2,0,0,1,0|1,0,0]=4 13910 B11R1.156 C=C(C)c1c(ccnc1F)N 271570a_100000694244_100010381272 [0,2,0,0,1,0|1,0,0]=4 13911 B11R1.156 C=C(C)c1c(ccnc1N)C 271570a_100000694244_100011998619 [0,2,0,0,1,0|1,0,0]=4 13912 B11R1.156 C=C(C)c1c(ccnc1N)Cl 271570a_100000694244_100010199028 [0,2,0,0,1,0|1,0,0]=4 13913 B11R1.156 C=C(C)c1c(ccnc1O)C 271570a_100000694244_100012000493 [0,2,0,0,1,0|1,0,0]=4 13914 B11R1.156 C=C(C)c1c(ccnc1O)O 271570a_100000694244_200009817435 [0,2,0,0,1,0|1,0,0]=4 13915 B11R1.156 C=C(C)c1c(cncc1Br)Br 271570a_100000694244_100010172828 [0,2,0,0,1,0|1,0,0]=4 13916 B11R1.156 C=C(C)c1c(cncc1C)C 271570a_100000694244_100009817138 [0,2,0,0,1,0|1,0,0]=4 13917 B11R1.156 C=C(C)c1c(cncc1Cl)Cl 271570a_100000694244_100000036193 [0,2,0,0,1,0|1,0,0]=4 13918 B11R1.156 C=C(C)c1c(cncc1F)F 271570a_100000694244_100000760538 [0,2,0,0,1,0|1,0,0]=4 13919 B11R1.156 CC(=O)c1c(cccc1Br)Br 1458a_100000690891_200000210301 [0,2,0,0,1,0|1,0,0]=4 13920 B11R1.156 CC(=O)c1c(cccc1Br)C 1458a_100000701904_200000210301 [0,2,0,0,1,0|1,0,0]=4 13921 B11R1.156 CC(=O)c1c(cccc1Br)Cl 1458a_100011253703_200000210301 [0,2,0,0,1,0|1,0,0]=4 13922 B11R1.156 CC(=O)c1c(cccc1Br)F 1458a_100000752694_200000210301 [0,2,0,0,1,0|1,0,0]=4 13923 B11R1.156 CC(=O)c1c(cccc1Br)O 1458a_100011935254_200000210301 [0,2,0,0,1,0|1,0,0]=4 13924 B11R1.156 CC(=O)c1c(cccc1C)C 1458a_100000758298_200000210301 [0,2,0,0,1,0|1,0,0]=4 13925 B11R1.156 CC(=O)c1c(cccc1Cl)C 1458a_100000692601_200000210301 [0,2,0,0,1,0|1,0,0]=4 13926 B11R1.156 CC(=O)c1c(cccc1Cl)Cl 1458a_100000210656_200000210301 [0,2,0,0,1,0|1,0,0]=4 13927 B11R1.156 CC(=O)c1c(cccc1Cl)F 1458a_100000210369_200000210301 [0,2,0,0,1,0|1,0,0]=4 13928 B11R1.156 CC(=O)c1c(cccc1Cl)O 1458a_100000745519_200000210301 [0,2,0,0,1,0|1,0,0]=4 13929 B11R1.156 CC(=O)c1c(cccc1F)C 1458a_100000762013_200000210301 [0,2,0,0,1,0|1,0,0]=4 13930 B11R1.156 CC(=O)c1c(cccc1F)F 1458a_100000210804_200000210301 [0,2,0,0,1,0|1,0,0]=4 13931 B11R1.156 CC(=O)c1c(cccc1F)O 1458a_100000763259_200000210301 [0,2,0,0,1,0|1,0,0]=4 13932 B11R1.156 CC(=O)c1c(cccc1F)O 271570a_203496583355_100012351873 [0,2,0,0,1,0|1,0,0]=4 13933 B11R1.156 CC(=O)c1c(cccc1I)Br 1458a_100010232521_200000210301 [0,2,0,0,1,0|1,0,0]=4 13934 B11R1.156 CC(=O)c1c(cccc1I)C 1458a_100000688020_200000210301 [0,2,0,0,1,0|1,0,0]=4 13935 B11R1.156 CC(=O)c1c(cccc1I)Cl 1458a_100000702859_200000210301 [0,2,0,0,1,0|1,0,0]=4 13936 B11R1.156 CC(=O)c1c(cccc1I)F 1458a_100000023732_200000210301 [0,2,0,0,1,0|1,0,0]=4 13937 B11R1.156 CC(=O)c1c(cccc1O)C 1458a_100011934116_200000210301 [0,2,0,0,1,0|1,0,0]=4 13938 B11R1.156 CC(=O)c1c(cccc1O)O 1458a_100000755285_200000210301 [0,2,0,0,1,0|1,0,0]=4 13939 B11R1.156 CC(=O)c1c(cccc1O)O 271570a_203496583355_100010174959 [0,2,0,0,1,0|1,0,0]=4 13940 B11R1.156 Cc1cccc(c1C(=O)[13CH3])Br 1458a_100000701904_200025704644 [0,2,0,0,1,0|1,0,0]=4 13941 B11R1.156 Cc1cccc(c1C(=O)[13CH3])C 1458a_100000758298_200025704644 [0,2,0,0,1,0|1,0,0]=4 13942 B11R1.156 Cc1cccc(c1C(=O)[13CH3])Cl 1458a_100000692601_200025704644 [0,2,0,0,1,0|1,0,0]=4 13943 B11R1.156 Cc1cccc(c1C(=O)[13CH3])F 1458a_100000762013_200025704644 [0,2,0,0,1,0|1,0,0]=4 13944 B11R1.156 Cc1cccc(c1C(=O)[13CH3])I 1458a_100000688020_200025704644 [0,2,0,0,1,0|1,0,0]=4 13945 B11R1.156 Cc1cccc(c1C(=O)[13CH3])O 1458a_100011934116_200025704644 [0,2,0,0,1,0|1,0,0]=4 13946 B11R1.156 [13CH3]C(=O)c1c(cccc1Br)Br 1458a_100000690891_200025704644 [0,2,0,0,1,0|1,0,0]=4 13947 B11R1.156 [13CH3]C(=O)c1c(cccc1Br)Cl 1458a_100011253703_200025704644 [0,2,0,0,1,0|1,0,0]=4 13948 B11R1.156 [13CH3]C(=O)c1c(cccc1Br)F 1458a_100000752694_200025704644 [0,2,0,0,1,0|1,0,0]=4 13949 B11R1.156 [13CH3]C(=O)c1c(cccc1Br)O 1458a_100011935254_200025704644 [0,2,0,0,1,0|1,0,0]=4 13950 B11R1.156 [13CH3]C(=O)c1c(cccc1Cl)Cl 1458a_100000210656_200025704644 [0,2,0,0,1,0|1,0,0]=4 13951 B11R1.156 [13CH3]C(=O)c1c(cccc1Cl)F 1458a_100000210369_200025704644 [0,2,0,0,1,0|1,0,0]=4 13952 B11R1.156 [13CH3]C(=O)c1c(cccc1Cl)O 1458a_100000745519_200025704644 [0,2,0,0,1,0|1,0,0]=4 13953 B11R1.156 [13CH3]C(=O)c1c(cccc1F)F 1458a_100000210804_200025704644 [0,2,0,0,1,0|1,0,0]=4 13954 B11R1.156 [13CH3]C(=O)c1c(cccc1F)O 1458a_100000763259_200025704644 [0,2,0,0,1,0|1,0,0]=4 13955 B11R1.156 [13CH3]C(=O)c1c(cccc1I)Br 1458a_100010232521_200025704644 [0,2,0,0,1,0|1,0,0]=4 13956 B11R1.156 [13CH3]C(=O)c1c(cccc1I)Cl 1458a_100000702859_200025704644 [0,2,0,0,1,0|1,0,0]=4 13957 B11R1.156 [13CH3]C(=O)c1c(cccc1I)F 1458a_100000023732_200025704644 [0,2,0,0,1,0|1,0,0]=4 13958 B11R1.156 [13CH3]C(=O)c1c(cccc1O)O 1458a_100000755285_200025704644 [0,2,0,0,1,0|1,0,0]=4 13959 B11R1.159 C=C(C)c1cccc(=O)n1C 271570a_100000694244_100000726605 [0,2,0,0,1,0|1,0,0]=4 13960 B11R1.159 C=C(C)c1cccc(c1Br)O 271570a_100000694244_100010187914 [0,2,0,0,1,0|0,0,0]=3 13961 B11R1.159 C=C(C)c1cccc(c1C)Br 271570a_100000694244_100012353703 [0,2,0,0,1,0|0,0,0]=3 13962 B11R1.159 C=C(C)c1cccc(c1C)C 271570a_100000694244_100011214922 [0,2,0,0,1,0|0,0,0]=3 13963 B11R1.159 C=C(C)c1cccc(c1C)Cl 271570a_100000694244_100000726075 [0,2,0,0,1,0|0,0,0]=3 13964 B11R1.159 C=C(C)c1cccc(c1C)F 271570a_100000694244_100011216893 [0,2,0,0,1,0|0,0,0]=3 13965 B11R1.159 C=C(C)c1cccc(c1C)N 271570a_100000694244_100000761887 [0,2,0,0,1,0|0,0,0]=3 13966 B11R1.159 C=C(C)c1cccc(c1C)O 271570a_100000694244_100012002258 [0,2,0,0,1,0|0,0,0]=3 13967 B11R1.159 C=C(C)c1cccc(c1Cl)Br 271570a_100000694244_100010142854 [0,2,0,0,1,0|0,0,0]=3 13968 B11R1.159 C=C(C)c1cccc(c1Cl)C 271570a_100000694244_200012352035 [0,2,0,0,1,0|0,0,0]=3 13969 B11R1.159 C=C(C)c1cccc(c1Cl)Cl 271570a_100000694244_100011215384 [0,2,0,0,1,0|0,0,0]=3 13970 B11R1.159 C=C(C)c1cccc(c1Cl)F 271570a_100000694244_200010234923 [0,2,0,0,1,0|0,0,0]=3 13971 B11R1.159 C=C(C)c1cccc(c1Cl)O 271570a_100000694244_100000049636 [0,2,0,0,1,0|0,0,0]=3 13972 B11R1.159 C=C(C)c1cccc(c1F)Br 271570a_100000694244_100000702267 [0,2,0,0,1,0|0,0,0]=3 13973 B11R1.159 C=C(C)c1cccc(c1F)C 271570a_100000694244_100000717567 [0,2,0,0,1,0|0,0,0]=3 13974 B11R1.159 C=C(C)c1cccc(c1F)Cl 271570a_100000694244_100011217346 [0,2,0,0,1,0|0,0,0]=3 13975 B11R1.159 C=C(C)c1cccc(c1F)F 271570a_100000694244_100000694657 [0,2,0,0,1,0|0,0,0]=3 13976 B11R1.159 C=C(C)c1cccc(c1F)N 271570a_100000694244_100011935091 [0,2,0,0,1,0|0,0,0]=3 13977 B11R1.159 C=C(C)c1cccc(c1F)O 271570a_100000694244_100009817021 [0,2,0,0,1,0|0,0,0]=3 13978 B11R1.159 C=C(C)c1cccc(c1N)Br 271570a_100000694244_100010146558 [0,2,0,0,1,0|0,0,0]=3 13979 B11R1.159 C=C(C)c1cccc(c1N)C 271570a_100000694244_100011834072 [0,2,0,0,1,0|0,0,0]=3 13980 B11R1.159 C=C(C)c1cccc(c1N)Cl 271570a_100000694244_100010190421 [0,2,0,0,1,0|0,0,0]=3 13981 B11R1.159 C=C(C)c1cccc(c1N)F 271570a_100000694244_100000042321 [0,2,0,0,1,0|0,0,0]=3 13982 B11R1.159 C=C(C)c1cccc(c1N)N 271570a_100000694244_100015191791 [0,2,0,0,1,0|0,0,0]=3 13983 B11R1.159 C=C(C)c1cccc(c1N)O 271570a_100000694244_100011934926 [0,2,0,0,1,0|0,0,0]=3 13984 B11R1.159 C=C(C)c1cccc(c1O)Br 271570a_100000694244_100010084509 [0,2,0,0,1,0|0,0,0]=3 13985 B11R1.159 C=C(C)c1cccc(c1O)C 271570a_100000694244_100009817157 [0,2,0,0,1,0|0,0,0]=3 13986 B11R1.159 C=C(C)c1cccc(c1O)Cl 271570a_100000694244_100010202889 [0,2,0,0,1,0|0,0,0]=3 13987 B11R1.159 C=C(C)c1cccc(c1O)F 271570a_100000694244_100009813666 [0,2,0,0,1,0|0,0,0]=3 13988 B11R1.159 C=C(C)c1cccc(c1O)N 271570a_100000694244_100011934915 [0,2,0,0,1,0|0,0,0]=3 13989 B11R1.159 C=C(C)c1cccc(c1O)O 271570a_100000694244_100009815950 [0,2,0,0,1,0|0,0,0]=3 13990 B11R1.159 C=C(C)c1cccn(c1=O)C 271570a_100000694244_100000687173 [0,2,0,0,1,0|1,0,0]=4 13991 B11R1.159 C=C(C)c1ccnc(c1C)C 271570a_100000694244_100009846815 [0,2,0,0,1,0|1,0,0]=4 13992 B11R1.159 C=C(C)c1ccnc(c1C)Cl 271570a_100000694244_100000047055 [0,2,0,0,1,0|1,0,0]=4 13993 B11R1.159 C=C(C)c1ccnc(c1C)F 271570a_100000694244_100010006593 [0,2,0,0,1,0|1,0,0]=4 13994 B11R1.159 C=C(C)c1ccnc(c1C)N 271570a_100000694244_100009865460 [0,2,0,0,1,0|1,0,0]=4 13995 B11R1.159 C=C(C)c1ccnc(c1C)O 271570a_100000694244_100009858498 [0,2,0,0,1,0|1,0,0]=4 13996 B11R1.159 C=C(C)c1ccnc(c1Cl)C 271570a_100000694244_100000698670 [0,2,0,0,1,0|1,0,0]=4 13997 B11R1.159 C=C(C)c1ccnc(c1Cl)Cl 271570a_100000694244_100010246212 [0,2,0,0,1,0|1,0,0]=4 13998 B11R1.159 C=C(C)c1ccnc(c1Cl)F 271570a_100000694244_100010067886 [0,2,0,0,1,0|1,0,0]=4 13999 B11R1.159 C=C(C)c1ccnc(c1Cl)N 271570a_100000694244_100010735111 [0,2,0,0,1,0|1,0,0]=4 14000 B11R1.159 C=C(C)c1ccnc(c1F)Br 271570a_100000694244_200015269031 [0,2,0,0,1,0|1,0,0]=4 14001 B11R1.159 C=C(C)c1ccnc(c1F)C 271570a_100000694244_100009849794 [0,2,0,0,1,0|1,0,0]=4 14002 B11R1.159 C=C(C)c1ccnc(c1F)Cl 271570a_100000694244_100010150473 [0,2,0,0,1,0|1,0,0]=4 14003 B11R1.159 C=C(C)c1ccnc(c1F)F 271570a_100000694244_100010214882 [0,2,0,0,1,0|1,0,0]=4 14004 B11R1.159 C=C(C)c1ccnc(c1F)N 271570a_100000694244_100010077785 [0,2,0,0,1,0|1,0,0]=4 14005 B11R1.159 C=C(C)c1ccnc(c1N)C 271570a_100000694244_100009885578 [0,2,0,0,1,0|1,0,0]=4 14006 B11R1.159 C=C(C)c1ccnc(c1N)N 271570a_100000694244_100000124095 [0,2,0,0,1,0|1,0,0]=4 14007 B11R1.159 C=C(C)c1cncc(c1C)Br 271570a_100000694244_100010109657 [0,2,0,0,1,0|1,0,0]=4 14008 B11R1.159 C=C(C)c1cncc(c1C)C 271570a_100000694244_100009864703 [0,2,0,0,1,0|1,0,0]=4 14009 B11R1.159 C=C(C)c1cncc(c1C)F 271570a_100000694244_100009881546 [0,2,0,0,1,0|1,0,0]=4 14010 B11R1.159 C=C(C)c1cncc(c1C)N 271570a_100000694244_100011998293 [0,2,0,0,1,0|1,0,0]=4 14011 B11R1.159 C=C(C)c1cncc(c1N)Br 271570a_100000694244_100011290786 [0,2,0,0,1,0|1,0,0]=4 14012 B11R1.159 C=C(C)c1cncc(c1N)C 271570a_100000694244_100009818025 [0,2,0,0,1,0|1,0,0]=4 14013 B11R1.159 C=C(C)c1cncc(c1N)Cl 271570a_100000694244_100000684942 [0,2,0,0,1,0|1,0,0]=4 14014 B11R1.159 C=C(C)c1cncc(c1N)F 271570a_100000694244_100009880649 [0,2,0,0,1,0|1,0,0]=4 14015 B11R1.159 C=C(C)c1cncc(c1N)N 271570a_100000694244_100000694774 [0,2,0,0,1,0|1,0,0]=4 14016 B11R1.159 C=C(C)c1nccc(c1C)C 271570a_100000694244_100009847204 [0,2,0,0,1,0|1,0,0]=4 14017 B11R1.159 C=C(C)c1nccc(c1C)F 271570a_100000694244_100009846374 [0,2,0,0,1,0|1,0,0]=4 14018 B11R1.159 C=C(C)c1nccc(c1C)N 271570a_100000694244_100009980296 [0,2,0,0,1,0|1,0,0]=4 14019 B11R1.159 C=C(C)c1nccc(c1F)C 271570a_100000694244_100009817629 [0,2,0,0,1,0|1,0,0]=4 14020 B11R1.159 C=C(C)c1nccc(c1F)N 271570a_100000694244_100015205195 [0,2,0,0,1,0|1,0,0]=4 14021 B11R1.159 C=C(C)c1nccc(c1F)O 271570a_100000694244_100009876375 [0,2,0,0,1,0|1,0,0]=4 14022 B11R1.159 C=C(C)c1nccc(c1N)C 271570a_100000694244_100000763560 [0,2,0,0,1,0|1,0,0]=4 14023 B11R1.159 C=C(C)c1nccc(c1N)N 271570a_100000694244_100000085203 [0,2,0,0,1,0|1,0,0]=4 14024 B11R1.159 C=C(C)c1nccc(c1N)O 271570a_100000694244_100000128729 [0,2,0,0,1,0|1,0,0]=4 14025 B11R1.159 C=C(C)c1nccc(c1O)C 271570a_100000694244_100000696282 [0,2,0,0,1,0|1,0,0]=4 14026 B11R1.159 C=C(C)c1nccc(c1O)F 271570a_100000694244_100009867227 [0,2,0,0,1,0|1,0,0]=4 14027 B11R1.159 CC(=O)c1cccc(c1Br)Br 1458a_100012360534_200000210301 [0,2,0,0,1,0|1,0,0]=4 14028 B11R1.159 CC(=O)c1cccc(c1Br)C 1458a_100000692419_200000210301 [0,2,0,0,1,0|1,0,0]=4 14029 B11R1.159 CC(=O)c1cccc(c1Br)Cl 1458a_100012339722_200000210301 [0,2,0,0,1,0|1,0,0]=4 14030 B11R1.159 CC(=O)c1cccc(c1Br)F 1458a_100011217547_200000210301 [0,2,0,0,1,0|1,0,0]=4 14031 B11R1.159 CC(=O)c1cccc(c1Br)I 1458a_100010232522_200000210301 [0,2,0,0,1,0|1,0,0]=4 14032 B11R1.159 CC(=O)c1cccc(c1Br)O 1458a_100010230362_200000210301 [0,2,0,0,1,0|1,0,0]=4 14033 B11R1.159 CC(=O)c1cccc(c1C)Br 1458a_100000760464_200000210301 [0,2,0,0,1,0|1,0,0]=4 14034 B11R1.159 CC(=O)c1cccc(c1C)C 1458a_100000183679_200000210301 [0,2,0,0,1,0|1,0,0]=4 14035 B11R1.159 CC(=O)c1cccc(c1C)Cl 1458a_100000690184_200000210301 [0,2,0,0,1,0|1,0,0]=4 14036 B11R1.159 CC(=O)c1cccc(c1C)F 1458a_100011218272_200000210301 [0,2,0,0,1,0|1,0,0]=4 14037 B11R1.159 CC(=O)c1cccc(c1C)I 1458a_100000751865_200000210301 [0,2,0,0,1,0|1,0,0]=4 14038 B11R1.159 CC(=O)c1cccc(c1C)O 1458a_100000766327_200000210301 [0,2,0,0,1,0|1,0,0]=4 14039 B11R1.159 CC(=O)c1cccc(c1C)O 271570a_203496583355_100012706834 [0,2,0,0,1,0|1,0,0]=4 14040 B11R1.159 CC(=O)c1cccc(c1Cl)Br 1458a_100000760540_200000210301 [0,2,0,0,1,0|1,0,0]=4 14041 B11R1.159 CC(=O)c1cccc(c1Cl)C 1458a_100000693142_200000210301 [0,2,0,0,1,0|1,0,0]=4 14042 B11R1.159 CC(=O)c1cccc(c1Cl)Cl 1458a_100000183631_200000210301 [0,2,0,0,1,0|1,0,0]=4 14043 B11R1.159 CC(=O)c1cccc(c1Cl)F 1458a_100000759904_200000210301 [0,2,0,0,1,0|1,0,0]=4 14044 B11R1.159 CC(=O)c1cccc(c1Cl)I 1458a_100010176783_200000210301 [0,2,0,0,1,0|1,0,0]=4 14045 B11R1.159 CC(=O)c1cccc(c1Cl)O 1458a_100000092362_200000210301 [0,2,0,0,1,0|1,0,0]=4 14046 B11R1.159 CC(=O)c1cccc(c1F)Br 1458a_100000756403_200000210301 [0,2,0,0,1,0|1,0,0]=4 14047 B11R1.159 CC(=O)c1cccc(c1F)C 1458a_100000766181_200000210301 [0,2,0,0,1,0|1,0,0]=4 14048 B11R1.159 CC(=O)c1cccc(c1F)Cl 1458a_100000688816_200000210301 [0,2,0,0,1,0|1,0,0]=4 14049 B11R1.159 CC(=O)c1cccc(c1F)F 1458a_100000748134_200000210301 [0,2,0,0,1,0|1,0,0]=4 14050 B11R1.159 CC(=O)c1cccc(c1F)I 1458a_100010185205_200000210301 [0,2,0,0,1,0|1,0,0]=4 14051 B11R1.159 CC(=O)c1cccc(c1F)O 1458a_100000037433_200000210301 [0,2,0,0,1,0|1,0,0]=4 14052 B11R1.159 CC(=O)c1cccc(c1F)O 271570a_203496583355_100012355707 [0,2,0,0,1,0|1,0,0]=4 14053 B11R1.159 CC(=O)c1cccc(c1I)Br 1458a_100000688019_200000210301 [0,2,0,0,1,0|1,0,0]=4 14054 B11R1.159 CC(=O)c1cccc(c1I)C 1458a_100000739377_200000210301 [0,2,0,0,1,0|1,0,0]=4 14055 B11R1.159 CC(=O)c1cccc(c1I)Cl 1458a_100010176784_200000210301 [0,2,0,0,1,0|1,0,0]=4 14056 B11R1.159 CC(=O)c1cccc(c1I)F 1458a_100000690930_200000210301 [0,2,0,0,1,0|1,0,0]=4 14057 B11R1.159 CC(=O)c1cccc(c1I)O 1458a_100010084636_200000210301 [0,2,0,0,1,0|1,0,0]=4 14058 B11R1.159 CC(=O)c1cccc(c1O)Br 1458a_100000752940_200000210301 [0,2,0,0,1,0|1,0,0]=4 14059 B11R1.159 CC(=O)c1cccc(c1O)C 1458a_100000183896_200000210301 [0,2,0,0,1,0|1,0,0]=4 14060 B11R1.159 CC(=O)c1cccc(c1O)Cl 1458a_100000742801_200000210301 [0,2,0,0,1,0|1,0,0]=4 14061 B11R1.159 CC(=O)c1cccc(c1O)F 1458a_100011217230_200000210301 [0,2,0,0,1,0|1,0,0]=4 14062 B11R1.159 CC(=O)c1cccc(c1O)F 271570a_203496583355_100012362612 [0,2,0,0,1,0|1,0,0]=4 14063 B11R1.159 CC(=O)c1cccc(c1O)O 1458a_100000690420_200000210301 [0,2,0,0,1,0|1,0,0]=4 14064 B11R1.159 CC(=O)c1cccc(c1O)O 271570a_203496583355_100009815558 [0,2,0,0,1,0|1,0,0]=4 14065 B11R1.159 Cc1c(cccc1C(=O)[13CH3])Br 1458a_100000760464_200025704644 [0,2,0,0,1,0|1,0,0]=4 14066 B11R1.159 Cc1c(cccc1C(=O)[13CH3])Cl 1458a_100000690184_200025704644 [0,2,0,0,1,0|1,0,0]=4 14067 B11R1.159 Cc1c(cccc1C(=O)[13CH3])F 1458a_100011218272_200025704644 [0,2,0,0,1,0|1,0,0]=4 14068 B11R1.159 Cc1c(cccc1C(=O)[13CH3])I 1458a_100000751865_200025704644 [0,2,0,0,1,0|1,0,0]=4 14069 B11R1.159 Cc1c(cccc1C(=O)[13CH3])O 1458a_100000766327_200025704644 [0,2,0,0,1,0|1,0,0]=4 14070 B11R1.159 Cc1cccc(c1Br)C(=O)[13CH3] 1458a_100000692419_200025704644 [0,2,0,0,1,0|1,0,0]=4 14071 B11R1.159 Cc1cccc(c1C)C(=O)[13CH3] 1458a_100000183679_200025704644 [0,2,0,0,1,0|1,0,0]=4 14072 B11R1.159 Cc1cccc(c1Cl)C(=O)[13CH3] 1458a_100000693142_200025704644 [0,2,0,0,1,0|1,0,0]=4 14073 B11R1.159 Cc1cccc(c1F)C(=O)[13CH3] 1458a_100000766181_200025704644 [0,2,0,0,1,0|1,0,0]=4 14074 B11R1.159 Cc1cccc(c1I)C(=O)[13CH3] 1458a_100000739377_200025704644 [0,2,0,0,1,0|1,0,0]=4 14075 B11R1.159 Cc1cccc(c1O)C(=O)[13CH3] 1458a_100000183896_200025704644 [0,2,0,0,1,0|1,0,0]=4 14076 B11R1.159 [13CH3]C(=O)c1cccc(c1Br)Br 1458a_100012360534_200025704644 [0,2,0,0,1,0|1,0,0]=4 14077 B11R1.159 [13CH3]C(=O)c1cccc(c1Br)Cl 1458a_100012339722_200025704644 [0,2,0,0,1,0|1,0,0]=4 14078 B11R1.159 [13CH3]C(=O)c1cccc(c1Br)F 1458a_100011217547_200025704644 [0,2,0,0,1,0|1,0,0]=4 14079 B11R1.159 [13CH3]C(=O)c1cccc(c1Br)I 1458a_100010232522_200025704644 [0,2,0,0,1,0|1,0,0]=4 14080 B11R1.159 [13CH3]C(=O)c1cccc(c1Br)O 1458a_100010230362_200025704644 [0,2,0,0,1,0|1,0,0]=4 14081 B11R1.159 [13CH3]C(=O)c1cccc(c1Cl)Br 1458a_100000760540_200025704644 [0,2,0,0,1,0|1,0,0]=4 14082 B11R1.159 [13CH3]C(=O)c1cccc(c1Cl)Cl 1458a_100000183631_200025704644 [0,2,0,0,1,0|1,0,0]=4 14083 B11R1.159 [13CH3]C(=O)c1cccc(c1Cl)F 1458a_100000759904_200025704644 [0,2,0,0,1,0|1,0,0]=4 14084 B11R1.159 [13CH3]C(=O)c1cccc(c1Cl)I 1458a_100010176783_200025704644 [0,2,0,0,1,0|1,0,0]=4 14085 B11R1.159 [13CH3]C(=O)c1cccc(c1Cl)O 1458a_100000092362_200025704644 [0,2,0,0,1,0|1,0,0]=4 14086 B11R1.159 [13CH3]C(=O)c1cccc(c1F)Br 1458a_100000756403_200025704644 [0,2,0,0,1,0|1,0,0]=4 14087 B11R1.159 [13CH3]C(=O)c1cccc(c1F)Cl 1458a_100000688816_200025704644 [0,2,0,0,1,0|1,0,0]=4 14088 B11R1.159 [13CH3]C(=O)c1cccc(c1F)F 1458a_100000748134_200025704644 [0,2,0,0,1,0|1,0,0]=4 14089 B11R1.159 [13CH3]C(=O)c1cccc(c1F)I 1458a_100010185205_200025704644 [0,2,0,0,1,0|1,0,0]=4 14090 B11R1.159 [13CH3]C(=O)c1cccc(c1F)O 1458a_100000037433_200025704644 [0,2,0,0,1,0|1,0,0]=4 14091 B11R1.159 [13CH3]C(=O)c1cccc(c1I)Br 1458a_100000688019_200025704644 [0,2,0,0,1,0|1,0,0]=4 14092 B11R1.159 [13CH3]C(=O)c1cccc(c1I)Cl 1458a_100010176784_200025704644 [0,2,0,0,1,0|1,0,0]=4 14093 B11R1.159 [13CH3]C(=O)c1cccc(c1I)F 1458a_100000690930_200025704644 [0,2,0,0,1,0|1,0,0]=4 14094 B11R1.159 [13CH3]C(=O)c1cccc(c1I)O 1458a_100010084636_200025704644 [0,2,0,0,1,0|1,0,0]=4 14095 B11R1.159 [13CH3]C(=O)c1cccc(c1O)Br 1458a_100000752940_200025704644 [0,2,0,0,1,0|1,0,0]=4 14096 B11R1.159 [13CH3]C(=O)c1cccc(c1O)Cl 1458a_100000742801_200025704644 [0,2,0,0,1,0|1,0,0]=4 14097 B11R1.159 [13CH3]C(=O)c1cccc(c1O)F 1458a_100011217230_200025704644 [0,2,0,0,1,0|1,0,0]=4 14098 B11R1.159 [13CH3]C(=O)c1cccc(c1O)O 1458a_100000690420_200025704644 [0,2,0,0,1,0|1,0,0]=4 14099 B11R1.167 C=C(C)c1cc(=O)[nH]cc1F 271570a_100000694244_100009817642 [0,2,0,0,1,0|1,0,0]=4 14100 B11R1.167 C=C(C)c1cc(c[nH]c1=O)F 271570a_100000694244_100009817720 [0,2,0,0,1,0|1,0,0]=4 14101 B11R1.167 C=C(C)c1cc(ccc1Br)Br 271570a_100000694244_100011483371 [0,2,0,0,1,0|0,0,0]=3 14102 B11R1.167 C=C(C)c1cc(ccc1Br)C 271570a_100000694244_100012353751 [0,2,0,0,1,0|0,0,0]=3 14103 B11R1.167 C=C(C)c1cc(ccc1Br)Cl 271570a_100000694244_100012339723 [0,2,0,0,1,0|0,0,0]=3 14104 B11R1.167 C=C(C)c1cc(ccc1Br)F 271570a_100000694244_100011217576 [0,2,0,0,1,0|0,0,0]=3 14105 B11R1.167 C=C(C)c1cc(ccc1Br)N 271570a_100000694244_100000750459 [0,2,0,0,1,0|0,0,0]=3 14106 B11R1.167 C=C(C)c1cc(ccc1Br)O 271570a_100000694244_100012339312 [0,2,0,0,1,0|0,0,0]=3 14107 B11R1.167 C=C(C)c1cc(ccc1C)Br 271570a_100000694244_100011344865 [0,2,0,0,1,0|0,0,0]=3 14108 B11R1.167 C=C(C)c1cc(ccc1C)C 271570a_100000694244_100000210833 [0,2,0,0,1,0|0,0,0]=3 14109 B11R1.167 C=C(C)c1cc(ccc1C)Cl 271570a_100000694244_100011263213 [0,2,0,0,1,0|0,0,0]=3 14110 B11R1.167 C=C(C)c1cc(ccc1C)F 271570a_100000694244_100011218078 [0,2,0,0,1,0|0,0,0]=3 14111 B11R1.167 C=C(C)c1cc(ccc1C)N 271570a_100000694244_100000736455 [0,2,0,0,1,0|0,0,0]=3 14112 B11R1.167 C=C(C)c1cc(ccc1C)O 271570a_100000694244_100011380479 [0,2,0,0,1,0|0,0,0]=3 14113 B11R1.167 C=C(C)c1cc(ccc1Cl)Br 271570a_100000694244_100011772130 [0,2,0,0,1,0|0,0,0]=3 14114 B11R1.167 C=C(C)c1cc(ccc1Cl)C 271570a_100000694244_100012356289 [0,2,0,0,1,0|0,0,0]=3 14115 B11R1.167 C=C(C)c1cc(ccc1Cl)Cl 271570a_100000694244_100000707729 [0,2,0,0,1,0|0,0,0]=3 14116 B11R1.167 C=C(C)c1cc(ccc1Cl)F 271570a_100000694244_100011217299 [0,2,0,0,1,0|0,0,0]=3 14117 B11R1.167 C=C(C)c1cc(ccc1Cl)N 271570a_100000694244_100012360549 [0,2,0,0,1,0|0,0,0]=3 14118 B11R1.167 C=C(C)c1cc(ccc1Cl)O 271570a_100000694244_100000049588 [0,2,0,0,1,0|0,0,0]=3 14119 B11R1.167 C=C(C)c1cc(ccc1F)Br 271570a_100000694244_100011217312 [0,2,0,0,1,0|0,0,0]=3 14120 B11R1.167 C=C(C)c1cc(ccc1F)C 271570a_100000694244_100000736223 [0,2,0,0,1,0|0,0,0]=3 14121 B11R1.167 C=C(C)c1cc(ccc1F)Cl 271570a_100000694244_100011218116 [0,2,0,0,1,0|0,0,0]=3 14122 B11R1.167 C=C(C)c1cc(ccc1F)F 271570a_100000694244_100000750033 [0,2,0,0,1,0|0,0,0]=3 14123 B11R1.167 C=C(C)c1cc(ccc1F)N 271570a_100000694244_100000760356 [0,2,0,0,1,0|0,0,0]=3 14124 B11R1.167 C=C(C)c1cc(ccc1F)O 271570a_100000694244_100000693481 [0,2,0,0,1,0|0,0,0]=3 14125 B11R1.167 C=C(C)c1cc(ccc1N)Br 271570a_100000694244_100000187925 [0,2,0,0,1,0|0,0,0]=3 14126 B11R1.167 C=C(C)c1cc(ccc1N)C 271570a_100000694244_100000210942 [0,2,0,0,1,0|0,0,0]=3 14127 B11R1.167 C=C(C)c1cc(ccc1N)Cl 271570a_100000694244_100000761889 [0,2,0,0,1,0|0,0,0]=3 14128 B11R1.167 C=C(C)c1cc(ccc1N)F 271570a_100000694244_100000760547 [0,2,0,0,1,0|0,0,0]=3 14129 B11R1.167 C=C(C)c1cc(ccc1N)N 271570a_100000694244_100011534242 [0,2,0,0,1,0|0,0,0]=3 14130 B11R1.167 C=C(C)c1cc(ccc1N)O 271570a_100000694244_100012001276 [0,2,0,0,1,0|0,0,0]=3 14131 B11R1.167 C=C(C)c1cc(ccc1O)Br 271570a_100000694244_100012355227 [0,2,0,0,1,0|0,0,0]=3 14132 B11R1.167 C=C(C)c1cc(ccc1O)C 271570a_100000694244_100000765521 [0,2,0,0,1,0|0,0,0]=3 14133 B11R1.167 C=C(C)c1cc(ccc1O)Cl 271570a_100000694244_100011356953 [0,2,0,0,1,0|0,0,0]=3 14134 B11R1.167 C=C(C)c1cc(ccc1O)F 271570a_100000694244_100000211999 [0,2,0,0,1,0|0,0,0]=3 14135 B11R1.167 C=C(C)c1cc(ccc1O)N 271570a_100000694244_100011534360 [0,2,0,0,1,0|0,0,0]=3 14136 B11R1.167 C=C(C)c1cc(ccc1O)O 271570a_100000694244_100009813629 [0,2,0,0,1,0|0,0,0]=3 14137 B11R1.167 C=C(C)c1cc(cnc1Br)N 271570a_100000694244_100010201102 [0,2,0,0,1,0|1,0,0]=4 14138 B11R1.167 C=C(C)c1cc(cnc1C)Br 271570a_100000694244_200010090566 [0,2,0,0,1,0|1,0,0]=4 14139 B11R1.167 C=C(C)c1cc(cnc1C)C 271570a_100000694244_100009817436 [0,2,0,0,1,0|1,0,0]=4 14140 B11R1.167 C=C(C)c1cc(cnc1C)F 271570a_100000694244_100009860710 [0,2,0,0,1,0|1,0,0]=4 14141 B11R1.167 C=C(C)c1cc(cnc1C)N 271570a_100000694244_100011998591 [0,2,0,0,1,0|1,0,0]=4 14142 B11R1.167 C=C(C)c1cc(cnc1C)O 271570a_100000694244_100009819603 [0,2,0,0,1,0|1,0,0]=4 14143 B11R1.167 C=C(C)c1cc(cnc1Cl)Br 271570a_100000694244_100009814771 [0,2,0,0,1,0|1,0,0]=4 14144 B11R1.167 C=C(C)c1cc(cnc1Cl)C 271570a_100000694244_100010210167 [0,2,0,0,1,0|1,0,0]=4 14145 B11R1.167 C=C(C)c1cc(cnc1Cl)Cl 271570a_100000694244_200000062399 [0,2,0,0,1,0|1,0,0]=4 14146 B11R1.167 C=C(C)c1cc(cnc1Cl)N 271570a_100000694244_100010253917 [0,2,0,0,1,0|1,0,0]=4 14147 B11R1.167 C=C(C)c1cc(cnc1F)Br 271570a_100000694244_100010172738 [0,2,0,0,1,0|1,0,0]=4 14148 B11R1.167 C=C(C)c1cc(cnc1F)C 271570a_100000694244_100000049784 [0,2,0,0,1,0|1,0,0]=4 14149 B11R1.167 C=C(C)c1cc(cnc1F)Cl 271570a_100000694244_100010188783 [0,2,0,0,1,0|1,0,0]=4 14150 B11R1.167 C=C(C)c1cc(cnc1F)F 271570a_100000694244_100009820768 [0,2,0,0,1,0|1,0,0]=4 14151 B11R1.167 C=C(C)c1cc(cnc1F)N 271570a_100000694244_100009840397 [0,2,0,0,1,0|1,0,0]=4 14152 B11R1.167 C=C(C)c1cc(cnc1F)O 271570a_100000694244_100009817267 [0,2,0,0,1,0|1,0,0]=4 14153 B11R1.167 C=C(C)c1cc(cnc1N)Br 271570a_100000694244_100000760472 [0,2,0,0,1,0|1,0,0]=4 14154 B11R1.167 C=C(C)c1cc(cnc1N)C 271570a_100000694244_100000049664 [0,2,0,0,1,0|1,0,0]=4 14155 B11R1.167 C=C(C)c1cc(cnc1N)Cl 271570a_100000694244_100000050159 [0,2,0,0,1,0|1,0,0]=4 14156 B11R1.167 C=C(C)c1cc(cnc1N)F 271570a_100000694244_100009814671 [0,2,0,0,1,0|1,0,0]=4 14157 B11R1.167 C=C(C)c1cc(cnc1N)N 271570a_100000694244_200011934315 [0,2,0,0,1,0|1,0,0]=4 14158 B11R1.167 C=C(C)c1cc(cnc1O)Br 271570a_100000694244_100010197142 [0,2,0,0,1,0|1,0,0]=4 14159 B11R1.167 C=C(C)c1cc(cnc1O)C 271570a_100000694244_100000049931 [0,2,0,0,1,0|1,0,0]=4 14160 B11R1.167 C=C(C)c1cc(cnc1O)Cl 271570a_100000694244_100010188700 [0,2,0,0,1,0|1,0,0]=4 14161 B11R1.167 C=C(C)c1cc(ncc1Br)Br 271570a_100000694244_100010171693 [0,2,0,0,1,0|1,0,0]=4 14162 B11R1.167 C=C(C)c1cc(ncc1Br)Cl 271570a_100000694244_100009815598 [0,2,0,0,1,0|1,0,0]=4 14163 B11R1.167 C=C(C)c1cc(ncc1C)Br 271570a_100000694244_100010067628 [0,2,0,0,1,0|1,0,0]=4 14164 B11R1.167 C=C(C)c1cc(ncc1C)C 271570a_100000694244_100009862788 [0,2,0,0,1,0|1,0,0]=4 14165 B11R1.167 C=C(C)c1cc(ncc1C)Cl 271570a_100000694244_100010068021 [0,2,0,0,1,0|1,0,0]=4 14166 B11R1.167 C=C(C)c1cc(ncc1C)F 271570a_100000694244_100000049870 [0,2,0,0,1,0|1,0,0]=4 14167 B11R1.167 C=C(C)c1cc(ncc1C)N 271570a_100000694244_100009819938 [0,2,0,0,1,0|1,0,0]=4 14168 B11R1.167 C=C(C)c1cc(ncc1C)O 271570a_100000694244_100009831917 [0,2,0,0,1,0|1,0,0]=4 14169 B11R1.167 C=C(C)c1cc(ncc1Cl)Br 271570a_100000694244_100010223331 [0,2,0,0,1,0|1,0,0]=4 14170 B11R1.167 C=C(C)c1cc(ncc1Cl)Cl 271570a_100000694244_100010172835 [0,2,0,0,1,0|1,0,0]=4 14171 B11R1.167 C=C(C)c1cc(ncc1Cl)F 271570a_100000694244_100009892587 [0,2,0,0,1,0|1,0,0]=4 14172 B11R1.167 C=C(C)c1cc(ncc1Cl)N 271570a_100000694244_100010134119 [0,2,0,0,1,0|1,0,0]=4 14173 B11R1.167 C=C(C)c1cc(ncc1F)Br 271570a_100000694244_100010193852 [0,2,0,0,1,0|1,0,0]=4 14174 B11R1.167 C=C(C)c1cc(ncc1F)C 271570a_100000694244_100009867690 [0,2,0,0,1,0|1,0,0]=4 14175 B11R1.167 C=C(C)c1cc(ncc1F)Cl 271570a_100000694244_100000708277 [0,2,0,0,1,0|1,0,0]=4 14176 B11R1.167 C=C(C)c1cc(ncc1F)F 271570a_100000694244_100010233071 [0,2,0,0,1,0|1,0,0]=4 14177 B11R1.167 C=C(C)c1cc(ncc1F)N 271570a_100000694244_100015713587 [0,2,0,0,1,0|1,0,0]=4 14178 B11R1.167 C=C(C)c1cc(ncc1N)Cl 271570a_100000694244_100000050123 [0,2,0,0,1,0|1,0,0]=4 14179 B11R1.167 C=C(C)c1cc(ncc1O)C 271570a_100000694244_100009843476 [0,2,0,0,1,0|1,0,0]=4 14180 B11R1.167 C=C(C)c1cc(ncc1O)Cl 271570a_100000694244_100000698892 [0,2,0,0,1,0|1,0,0]=4 14181 B11R1.167 C=C(C)c1cn(ccc1=O)C 271570a_100000694244_100010750718 [0,2,0,0,1,0|1,0,0]=4 14182 B11R1.167 C=C(C)c1nc(ccc1Br)N 271570a_100000694244_100010192275 [0,2,0,0,1,0|1,0,0]=4 14183 B11R1.167 C=C(C)c1nc(ccc1C)C 271570a_100000694244_100009854376 [0,2,0,0,1,0|1,0,0]=4 14184 B11R1.167 C=C(C)c1nc(ccc1C)N 271570a_100000694244_100000126722 [0,2,0,0,1,0|1,0,0]=4 14185 B11R1.167 C=C(C)c1nc(ccc1F)C 271570a_100000694244_100009817602 [0,2,0,0,1,0|1,0,0]=4 14186 B11R1.167 C=C(C)c1nc(ccc1F)Cl 271570a_100000694244_100010136221 [0,2,0,0,1,0|1,0,0]=4 14187 B11R1.167 C=C(C)c1nc(ccc1F)F 271570a_100000694244_100010997973 [0,2,0,0,1,0|1,0,0]=4 14188 B11R1.167 C=C(C)c1nc(ccc1F)N 271570a_100000694244_100010892222 [0,2,0,0,1,0|1,0,0]=4 14189 B11R1.167 C=C(C)c1nc(ccc1N)Br 271570a_100000694244_100010168765 [0,2,0,0,1,0|1,0,0]=4 14190 B11R1.167 C=C(C)c1nc(ccc1N)C 271570a_100000694244_100000685570 [0,2,0,0,1,0|1,0,0]=4 14191 B11R1.167 C=C(C)c1nc(ccc1N)Cl 271570a_100000694244_100010233647 [0,2,0,0,1,0|1,0,0]=4 14192 B11R1.167 C=C(C)c1nc(ccc1N)F 271570a_100000694244_100009879877 [0,2,0,0,1,0|1,0,0]=4 14193 B11R1.167 C=C(C)c1nc(ccc1N)N 271570a_100000694244_200009884323 [0,2,0,0,1,0|1,0,0]=4 14194 B11R1.167 C=C(C)c1nc(ccc1O)Br 271570a_100000694244_100010253912 [0,2,0,0,1,0|1,0,0]=4 14195 B11R1.167 C=C(C)c1nc(ccc1O)C 271570a_100000694244_100000702858 [0,2,0,0,1,0|1,0,0]=4 14196 B11R1.167 C=C(C)c1nc(ccc1O)Cl 271570a_100000694244_100000696390 [0,2,0,0,1,0|1,0,0]=4 14197 B11R1.167 C=C(C)c1nc(ccc1O)F 271570a_100000694244_100010382442 [0,2,0,0,1,0|1,0,0]=4 14198 B11R1.167 CC(=O)c1cc(ccc1Br)Br 1458a_100000690610_200000210301 [0,2,0,0,1,0|1,0,0]=4 14199 B11R1.167 CC(=O)c1cc(ccc1Br)C 1458a_100000689033_200000210301 [0,2,0,0,1,0|1,0,0]=4 14200 B11R1.167 CC(=O)c1cc(ccc1Br)Cl 1458a_100000736951_200000210301 [0,2,0,0,1,0|1,0,0]=4 14201 B11R1.167 CC(=O)c1cc(ccc1Br)F 1458a_100000212315_200000210301 [0,2,0,0,1,0|1,0,0]=4 14202 B11R1.167 CC(=O)c1cc(ccc1Br)I 1458a_100000698340_200000210301 [0,2,0,0,1,0|1,0,0]=4 14203 B11R1.167 CC(=O)c1cc(ccc1Br)O 1458a_100012352043_200000210301 [0,2,0,0,1,0|1,0,0]=4 14204 B11R1.167 CC(=O)c1cc(ccc1C)Br 1458a_100000759961_200000210301 [0,2,0,0,1,0|1,0,0]=4 14205 B11R1.167 CC(=O)c1cc(ccc1C)C 1458a_100000195421_200000210301 [0,2,0,0,1,0|1,0,0]=4 14206 B11R1.167 CC(=O)c1cc(ccc1C)Cl 1458a_100000692595_200000210301 [0,2,0,0,1,0|1,0,0]=4 14207 B11R1.167 CC(=O)c1cc(ccc1C)F 1458a_100000240043_200000210301 [0,2,0,0,1,0|1,0,0]=4 14208 B11R1.167 CC(=O)c1cc(ccc1C)I 1458a_100000688012_200000210301 [0,2,0,0,1,0|1,0,0]=4 14209 B11R1.167 CC(=O)c1cc(ccc1C)O 1458a_100000687834_200000210301 [0,2,0,0,1,0|1,0,0]=4 14210 B11R1.167 CC(=O)c1cc(ccc1C)O 271570a_203496583355_100012706819 [0,2,0,0,1,0|1,0,0]=4 14211 B11R1.167 CC(=O)c1cc(ccc1Cl)Br 1458a_100000211212_200000210301 [0,2,0,0,1,0|1,0,0]=4 14212 B11R1.167 CC(=O)c1cc(ccc1Cl)C 1458a_100011290873_200000210301 [0,2,0,0,1,0|1,0,0]=4 14213 B11R1.167 CC(=O)c1cc(ccc1Cl)Cl 1458a_100000210642_200000210301 [0,2,0,0,1,0|1,0,0]=4 14214 B11R1.167 CC(=O)c1cc(ccc1Cl)F 1458a_100011219680_200000210301 [0,2,0,0,1,0|1,0,0]=4 14215 B11R1.167 CC(=O)c1cc(ccc1Cl)I 1458a_100000688013_200000210301 [0,2,0,0,1,0|1,0,0]=4 14216 B11R1.167 CC(=O)c1cc(ccc1Cl)O 1458a_100000719527_200000210301 [0,2,0,0,1,0|1,0,0]=4 14217 B11R1.167 CC(=O)c1cc(ccc1Cl)O 271570a_203496583355_100010712560 [0,2,0,0,1,0|1,0,0]=4 14218 B11R1.167 CC(=O)c1cc(ccc1F)Br 1458a_100000212322_200000210301 [0,2,0,0,1,0|1,0,0]=4 14219 B11R1.167 CC(=O)c1cc(ccc1F)C 1458a_100000749327_200000210301 [0,2,0,0,1,0|1,0,0]=4 14220 B11R1.167 CC(=O)c1cc(ccc1F)Cl 1458a_100000214954_200000210301 [0,2,0,0,1,0|1,0,0]=4 14221 B11R1.167 CC(=O)c1cc(ccc1F)F 1458a_100000198512_200000210301 [0,2,0,0,1,0|1,0,0]=4 14222 B11R1.167 CC(=O)c1cc(ccc1F)I 1458a_100000688014_200000210301 [0,2,0,0,1,0|1,0,0]=4 14223 B11R1.167 CC(=O)c1cc(ccc1F)O 1458a_100000037260_200000210301 [0,2,0,0,1,0|1,0,0]=4 14224 B11R1.167 CC(=O)c1cc(ccc1F)O 271570a_203496583355_100000689017 [0,2,0,0,1,0|1,0,0]=4 14225 B11R1.167 CC(=O)c1cc(ccc1I)Br 1458a_100000183945_200000210301 [0,2,0,0,1,0|1,0,0]=4 14226 B11R1.167 CC(=O)c1cc(ccc1I)C 1458a_100000057929_200000210301 [0,2,0,0,1,0|1,0,0]=4 14227 B11R1.167 CC(=O)c1cc(ccc1I)Cl 1458a_100000739379_200000210301 [0,2,0,0,1,0|1,0,0]=4 14228 B11R1.167 CC(=O)c1cc(ccc1I)F 1458a_100000748905_200000210301 [0,2,0,0,1,0|1,0,0]=4 14229 B11R1.167 CC(=O)c1cc(ccc1I)I 1458a_100000750460_200000210301 [0,2,0,0,1,0|1,0,0]=4 14230 B11R1.167 CC(=O)c1cc(ccc1I)O 1458a_200009995701_200000210301 [0,2,0,0,1,0|1,0,0]=4 14231 B11R1.167 CC(=O)c1cc(ccc1N)O 271570a_203496583355_100000695420 [0,2,0,0,1,0|1,0,0]=4 14232 B11R1.167 CC(=O)c1cc(ccc1O)Br 1458a_100000212140_200000210301 [0,2,0,0,1,0|1,0,0]=4 14233 B11R1.167 CC(=O)c1cc(ccc1O)Br 271570a_203496583355_100012349576 [0,2,0,0,1,0|1,0,0]=4 14234 B11R1.167 CC(=O)c1cc(ccc1O)C 1458a_100000229998_200000210301 [0,2,0,0,1,0|1,0,0]=4 14235 B11R1.167 CC(=O)c1cc(ccc1O)C 271570a_203496583355_100012361225 [0,2,0,0,1,0|1,0,0]=4 14236 B11R1.167 CC(=O)c1cc(ccc1O)Cl 1458a_100000212143_200000210301 [0,2,0,0,1,0|1,0,0]=4 14237 B11R1.167 CC(=O)c1cc(ccc1O)F 1458a_100000742286_200000210301 [0,2,0,0,1,0|1,0,0]=4 14238 B11R1.167 CC(=O)c1cc(ccc1O)F 271570a_203496583355_100012353695 [0,2,0,0,1,0|1,0,0]=4 14239 B11R1.167 CC(=O)c1cc(ccc1O)I 1458a_100000212111_200000210301 [0,2,0,0,1,0|1,0,0]=4 14240 B11R1.167 CC(=O)c1cc(ccc1O)N 271570a_203496583355_100012349454 [0,2,0,0,1,0|1,0,0]=4 14241 B11R1.167 CC(=O)c1cc(ccc1O)O 1458a_100000758025_200000210301 [0,2,0,0,1,0|1,0,0]=4 14242 B11R1.167 CC(=O)c1cc(ccc1O)O 271570a_203496583355_100000212127 [0,2,0,0,1,0|1,0,0]=4 14243 B11R1.167 Cc1ccc(c(c1)C(=O)[13CH3])Br 1458a_100000689033_200025704644 [0,2,0,0,1,0|1,0,0]=4 14244 B11R1.167 Cc1ccc(c(c1)C(=O)[13CH3])C 1458a_100000195421_200025704644 [0,2,0,0,1,0|1,0,0]=4 14245 B11R1.167 Cc1ccc(c(c1)C(=O)[13CH3])Cl 1458a_100011290873_200025704644 [0,2,0,0,1,0|1,0,0]=4 14246 B11R1.167 Cc1ccc(c(c1)C(=O)[13CH3])F 1458a_100000749327_200025704644 [0,2,0,0,1,0|1,0,0]=4 14247 B11R1.167 Cc1ccc(c(c1)C(=O)[13CH3])I 1458a_100000057929_200025704644 [0,2,0,0,1,0|1,0,0]=4 14248 B11R1.167 Cc1ccc(c(c1)C(=O)[13CH3])O 1458a_100000229998_200025704644 [0,2,0,0,1,0|1,0,0]=4 14249 B11R1.167 Cc1ccc(cc1C(=O)[13CH3])Br 1458a_100000759961_200025704644 [0,2,0,0,1,0|1,0,0]=4 14250 B11R1.167 Cc1ccc(cc1C(=O)[13CH3])Cl 1458a_100000692595_200025704644 [0,2,0,0,1,0|1,0,0]=4 14251 B11R1.167 Cc1ccc(cc1C(=O)[13CH3])F 1458a_100000240043_200025704644 [0,2,0,0,1,0|1,0,0]=4 14252 B11R1.167 Cc1ccc(cc1C(=O)[13CH3])I 1458a_100000688012_200025704644 [0,2,0,0,1,0|1,0,0]=4 14253 B11R1.167 Cc1ccc(cc1C(=O)[13CH3])O 1458a_100000687834_200025704644 [0,2,0,0,1,0|1,0,0]=4 14254 B11R1.167 [13CH3]C(=O)c1cc(ccc1Br)Br 1458a_100000690610_200025704644 [0,2,0,0,1,0|1,0,0]=4 14255 B11R1.167 [13CH3]C(=O)c1cc(ccc1Br)Cl 1458a_100000736951_200025704644 [0,2,0,0,1,0|1,0,0]=4 14256 B11R1.167 [13CH3]C(=O)c1cc(ccc1Br)F 1458a_100000212315_200025704644 [0,2,0,0,1,0|1,0,0]=4 14257 B11R1.167 [13CH3]C(=O)c1cc(ccc1Br)I 1458a_100000698340_200025704644 [0,2,0,0,1,0|1,0,0]=4 14258 B11R1.167 [13CH3]C(=O)c1cc(ccc1Br)O 1458a_100012352043_200025704644 [0,2,0,0,1,0|1,0,0]=4 14259 B11R1.167 [13CH3]C(=O)c1cc(ccc1Cl)Br 1458a_100000211212_200025704644 [0,2,0,0,1,0|1,0,0]=4 14260 B11R1.167 [13CH3]C(=O)c1cc(ccc1Cl)Cl 1458a_100000210642_200025704644 [0,2,0,0,1,0|1,0,0]=4 14261 B11R1.167 [13CH3]C(=O)c1cc(ccc1Cl)F 1458a_100011219680_200025704644 [0,2,0,0,1,0|1,0,0]=4 14262 B11R1.167 [13CH3]C(=O)c1cc(ccc1Cl)I 1458a_100000688013_200025704644 [0,2,0,0,1,0|1,0,0]=4 14263 B11R1.167 [13CH3]C(=O)c1cc(ccc1Cl)O 1458a_100000719527_200025704644 [0,2,0,0,1,0|1,0,0]=4 14264 B11R1.167 [13CH3]C(=O)c1cc(ccc1F)Br 1458a_100000212322_200025704644 [0,2,0,0,1,0|1,0,0]=4 14265 B11R1.167 [13CH3]C(=O)c1cc(ccc1F)Cl 1458a_100000214954_200025704644 [0,2,0,0,1,0|1,0,0]=4 14266 B11R1.167 [13CH3]C(=O)c1cc(ccc1F)F 1458a_100000198512_200025704644 [0,2,0,0,1,0|1,0,0]=4 14267 B11R1.167 [13CH3]C(=O)c1cc(ccc1F)I 1458a_100000688014_200025704644 [0,2,0,0,1,0|1,0,0]=4 14268 B11R1.167 [13CH3]C(=O)c1cc(ccc1F)O 1458a_100000037260_200025704644 [0,2,0,0,1,0|1,0,0]=4 14269 B11R1.167 [13CH3]C(=O)c1cc(ccc1I)Br 1458a_100000183945_200025704644 [0,2,0,0,1,0|1,0,0]=4 14270 B11R1.167 [13CH3]C(=O)c1cc(ccc1I)Cl 1458a_100000739379_200025704644 [0,2,0,0,1,0|1,0,0]=4 14271 B11R1.167 [13CH3]C(=O)c1cc(ccc1I)F 1458a_100000748905_200025704644 [0,2,0,0,1,0|1,0,0]=4 14272 B11R1.167 [13CH3]C(=O)c1cc(ccc1I)I 1458a_100000750460_200025704644 [0,2,0,0,1,0|1,0,0]=4 14273 B11R1.167 [13CH3]C(=O)c1cc(ccc1I)O 1458a_200009995701_200025704644 [0,2,0,0,1,0|1,0,0]=4 14274 B11R1.167 [13CH3]C(=O)c1cc(ccc1O)Br 1458a_100000212140_200025704644 [0,2,0,0,1,0|1,0,0]=4 14275 B11R1.167 [13CH3]C(=O)c1cc(ccc1O)Cl 1458a_100000212143_200025704644 [0,2,0,0,1,0|1,0,0]=4 14276 B11R1.167 [13CH3]C(=O)c1cc(ccc1O)F 1458a_100000742286_200025704644 [0,2,0,0,1,0|1,0,0]=4 14277 B11R1.167 [13CH3]C(=O)c1cc(ccc1O)I 1458a_100000212111_200025704644 [0,2,0,0,1,0|1,0,0]=4 14278 B11R1.167 [13CH3]C(=O)c1cc(ccc1O)O 1458a_100000758025_200025704644 [0,2,0,0,1,0|1,0,0]=4 14279 B11R1.74 C=C(C)c1cc([nH]c(=O)c1)C 271570a_100000694244_100009861981 [0,2,0,0,1,0|1,0,0]=4 14280 B11R1.74 C=C(C)c1cc(cc(c1)Br)Br 271570a_100000694244_100009814770 [0,2,0,0,1,0|0,0,0]=3 14281 B11R1.74 C=C(C)c1cc(cc(c1)Br)Cl 271570a_100000694244_100009814755 [0,2,0,0,1,0|0,0,0]=3 14282 B11R1.74 C=C(C)c1cc(cc(c1)Br)F 271570a_100000694244_100009814764 [0,2,0,0,1,0|0,0,0]=3 14283 B11R1.74 C=C(C)c1cc(cc(c1)Br)N 271570a_100000694244_100009814763 [0,2,0,0,1,0|0,0,0]=3 14284 B11R1.74 C=C(C)c1cc(cc(c1)Br)O 271570a_100000694244_100010068917 [0,2,0,0,1,0|0,0,0]=3 14285 B11R1.74 C=C(C)c1cc(cc(c1)C)C 271570a_100000694244_100011215608 [0,2,0,0,1,0|0,0,0]=3 14286 B11R1.74 C=C(C)c1cc(cc(c1)Cl)C 271570a_100000694244_100010172791 [0,2,0,0,1,0|0,0,0]=3 14287 B11R1.74 C=C(C)c1cc(cc(c1)Cl)Cl 271570a_100000694244_100000747138 [0,2,0,0,1,0|0,0,0]=3 14288 B11R1.74 C=C(C)c1cc(cc(c1)Cl)F 271570a_100000694244_100013859453 [0,2,0,0,1,0|0,0,0]=3 14289 B11R1.74 C=C(C)c1cc(cc(c1)Cl)N 271570a_100000694244_100010147676 [0,2,0,0,1,0|0,0,0]=3 14290 B11R1.74 C=C(C)c1cc(cc(c1)Cl)O 271570a_100000694244_100010068924 [0,2,0,0,1,0|0,0,0]=3 14291 B11R1.74 C=C(C)c1cc(cc(c1)F)C 271570a_100000694244_100011356977 [0,2,0,0,1,0|0,0,0]=3 14292 B11R1.74 C=C(C)c1cc(cc(c1)F)F 271570a_100000694244_100011218498 [0,2,0,0,1,0|0,0,0]=3 14293 B11R1.74 C=C(C)c1cc(cc(c1)F)N 271570a_100000694244_100011356972 [0,2,0,0,1,0|0,0,0]=3 14294 B11R1.74 C=C(C)c1cc(cc(c1)F)O 271570a_100000694244_100000717995 [0,2,0,0,1,0|0,0,0]=3 14295 B11R1.74 C=C(C)c1cc(cc(c1)N)C 271570a_100000694244_100000695972 [0,2,0,0,1,0|0,0,0]=3 14296 B11R1.74 C=C(C)c1cc(cc(c1)N)N 271570a_100000694244_100011999608 [0,2,0,0,1,0|0,0,0]=3 14297 B11R1.74 C=C(C)c1cc(cc(c1)O)C 271570a_100000694244_100011999630 [0,2,0,0,1,0|0,0,0]=3 14298 B11R1.74 C=C(C)c1cc(cc(c1)O)O 271570a_100000694244_100009868816 [0,2,0,0,1,0|0,0,0]=3 14299 B11R1.74 C=C(C)c1cc(cc(n1)C)C 271570a_100000694244_100000069240 [0,2,0,0,1,0|1,0,0]=4 14300 B11R1.74 C=C(C)c1cc(cc(n1)F)C 271570a_100000694244_100009819601 [0,2,0,0,1,0|1,0,0]=4 14301 B11R1.74 C=C(C)c1cc(cc(n1)N)C 271570a_100000694244_100009819863 [0,2,0,0,1,0|1,0,0]=4 14302 B11R1.74 C=C(C)c1cc(nc(c1)C)C 271570a_100000694244_100009816552 [0,2,0,0,1,0|1,0,0]=4 14303 B11R1.74 C=C(C)c1cc(nc(c1)F)C 271570a_100000694244_100010006595 [0,2,0,0,1,0|1,0,0]=4 14304 B11R1.74 C=C(C)c1cc(nc(c1)F)F 271570a_100000694244_100000049587 [0,2,0,0,1,0|1,0,0]=4 14305 B11R1.74 C=C(C)c1cc(nc(c1)N)C 271570a_100000694244_100000076705 [0,2,0,0,1,0|1,0,0]=4 14306 B11R1.74 C=C(C)c1cc(nc(c1)N)N 271570a_100000694244_100009816676 [0,2,0,0,1,0|1,0,0]=4 14307 B11R1.74 CC(=O)c1cc(cc(c1)Br)Br 1458a_100000687083_200000210301 [0,2,0,0,1,0|1,0,0]=4 14308 B11R1.74 CC(=O)c1cc(cc(c1)Br)C 1458a_100000760426_200000210301 [0,2,0,0,1,0|1,0,0]=4 14309 B11R1.74 CC(=O)c1cc(cc(c1)Br)Cl 1458a_100000687899_200000210301 [0,2,0,0,1,0|1,0,0]=4 14310 B11R1.74 CC(=O)c1cc(cc(c1)Br)F 1458a_100000739618_200000210301 [0,2,0,0,1,0|1,0,0]=4 14311 B11R1.74 CC(=O)c1cc(cc(c1)Br)O 1458a_100011934545_200000210301 [0,2,0,0,1,0|1,0,0]=4 14312 B11R1.74 CC(=O)c1cc(cc(c1)Br)O 271570a_203496583355_100010005435 [0,2,0,0,1,0|1,0,0]=4 14313 B11R1.74 CC(=O)c1cc(cc(c1)C)C 1458a_100000210874_200000210301 [0,2,0,0,1,0|1,0,0]=4 14314 B11R1.74 CC(=O)c1cc(cc(c1)Cl)C 1458a_100000684526_200000210301 [0,2,0,0,1,0|1,0,0]=4 14315 B11R1.74 CC(=O)c1cc(cc(c1)Cl)Cl 1458a_100000210701_200000210301 [0,2,0,0,1,0|1,0,0]=4 14316 B11R1.74 CC(=O)c1cc(cc(c1)Cl)F 1458a_100000685768_200000210301 [0,2,0,0,1,0|1,0,0]=4 14317 B11R1.74 CC(=O)c1cc(cc(c1)Cl)O 1458a_100011997059_200000210301 [0,2,0,0,1,0|1,0,0]=4 14318 B11R1.74 CC(=O)c1cc(cc(c1)F)C 1458a_100000763163_200000210301 [0,2,0,0,1,0|1,0,0]=4 14319 B11R1.74 CC(=O)c1cc(cc(c1)F)F 1458a_100000211655_200000210301 [0,2,0,0,1,0|1,0,0]=4 14320 B11R1.74 CC(=O)c1cc(cc(c1)F)O 1458a_100012017291_200000210301 [0,2,0,0,1,0|1,0,0]=4 14321 B11R1.74 CC(=O)c1cc(cc(c1)F)O 271570a_203496583355_100012361402 [0,2,0,0,1,0|1,0,0]=4 14322 B11R1.74 CC(=O)c1cc(cc(c1)I)Br 1458a_100000689235_200000210301 [0,2,0,0,1,0|1,0,0]=4 14323 B11R1.74 CC(=O)c1cc(cc(c1)I)C 1458a_100000729426_200000210301 [0,2,0,0,1,0|1,0,0]=4 14324 B11R1.74 CC(=O)c1cc(cc(c1)I)Cl 1458a_100012047205_200000210301 [0,2,0,0,1,0|1,0,0]=4 14325 B11R1.74 CC(=O)c1cc(cc(c1)I)F 1458a_100012047268_200000210301 [0,2,0,0,1,0|1,0,0]=4 14326 B11R1.74 CC(=O)c1cc(cc(c1)I)I 1458a_100011204819_200000210301 [0,2,0,0,1,0|1,0,0]=4 14327 B11R1.74 CC(=O)c1cc(cc(c1)O)C 1458a_100000094094_200000210301 [0,2,0,0,1,0|1,0,0]=4 14328 B11R1.74 CC(=O)c1cc(cc(c1)O)C 271570a_203496583355_100000694479 [0,2,0,0,1,0|1,0,0]=4 14329 B11R1.74 Cc1cc(cc(c1)C(=O)[13CH3])Br 1458a_100000760426_200025704644 [0,2,0,0,1,0|1,0,0]=4 14330 B11R1.74 Cc1cc(cc(c1)C(=O)[13CH3])C 1458a_100000210874_200025704644 [0,2,0,0,1,0|1,0,0]=4 14331 B11R1.74 Cc1cc(cc(c1)C(=O)[13CH3])Cl 1458a_100000684526_200025704644 [0,2,0,0,1,0|1,0,0]=4 14332 B11R1.74 Cc1cc(cc(c1)C(=O)[13CH3])F 1458a_100000763163_200025704644 [0,2,0,0,1,0|1,0,0]=4 14333 B11R1.74 Cc1cc(cc(c1)C(=O)[13CH3])I 1458a_100000729426_200025704644 [0,2,0,0,1,0|1,0,0]=4 14334 B11R1.74 Cc1cc(cc(c1)C(=O)[13CH3])O 1458a_100000094094_200025704644 [0,2,0,0,1,0|1,0,0]=4 14335 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)Br)Br 1458a_100000687083_200025704644 [0,2,0,0,1,0|1,0,0]=4 14336 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)Br)Cl 1458a_100000687899_200025704644 [0,2,0,0,1,0|1,0,0]=4 14337 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)Br)F 1458a_100000739618_200025704644 [0,2,0,0,1,0|1,0,0]=4 14338 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)Br)O 1458a_100011934545_200025704644 [0,2,0,0,1,0|1,0,0]=4 14339 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)Cl)Cl 1458a_100000210701_200025704644 [0,2,0,0,1,0|1,0,0]=4 14340 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)Cl)F 1458a_100000685768_200025704644 [0,2,0,0,1,0|1,0,0]=4 14341 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)Cl)O 1458a_100011997059_200025704644 [0,2,0,0,1,0|1,0,0]=4 14342 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)F)F 1458a_100000211655_200025704644 [0,2,0,0,1,0|1,0,0]=4 14343 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)F)O 1458a_100012017291_200025704644 [0,2,0,0,1,0|1,0,0]=4 14344 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)I)Br 1458a_100000689235_200025704644 [0,2,0,0,1,0|1,0,0]=4 14345 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)I)Cl 1458a_100012047205_200025704644 [0,2,0,0,1,0|1,0,0]=4 14346 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)I)F 1458a_100012047268_200025704644 [0,2,0,0,1,0|1,0,0]=4 14347 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)I)I 1458a_100011204819_200025704644 [0,2,0,0,1,0|1,0,0]=4 14348 B11R1.266 C#Cc1cccc(c1)C(=O)C 1458a_100011997762_200000210301 [0,2,0,0,1,0|1,0,0]=4 14349 B11R1.266 C#Cc1cccc(c1)C(=O)[13CH3] 1458a_100011997762_200025704644 [0,2,0,0,1,0|1,0,0]=4 14350 B11R1.266 C=C(C)c1cc(ccn1)C#N 271570a_100000694244_100011291639 [0,2,0,0,1,0|1,0,0]=4 14351 B11R1.266 C=C(C)c1cc(ccn1)C=O 271570a_100000694244_100011290808 [0,2,0,0,1,0|1,0,0]=4 14352 B11R1.266 C=C(C)c1cc(ccn1)CC 271570a_100000694244_100009817561 [0,2,0,0,1,0|1,0,0]=4 14353 B11R1.266 C=C(C)c1cc(ccn1)CO 271570a_100000694244_100009814636 [0,2,0,0,1,0|1,0,0]=4 14354 B11R1.266 C=C(C)c1cc(ccn1)NC 271570a_100000694244_100009869472 [0,2,0,0,1,0|1,0,0]=4 14355 B11R1.266 C=C(C)c1cc(ccn1)OC 271570a_100000694244_100011216251 [0,2,0,0,1,0|1,0,0]=4 14356 B11R1.266 C=C(C)c1cc(ccn1)SC 271570a_100000694244_100010883326 [0,2,0,0,1,0|1,0,0]=4 14357 B11R1.266 C=C(C)c1cccc(c1)C#N 271570a_100000694244_100000189340 [0,2,0,0,1,0|0,0,0]=3 14358 B11R1.266 C=C(C)c1cccc(c1)C=O 271570a_100000694244_100000014684 [0,2,0,0,1,0|0,0,0]=3 14359 B11R1.266 C=C(C)c1cccc(c1)CC 271570a_100000694244_100000684523 [0,2,0,0,1,0|0,0,0]=3 14360 B11R1.266 C=C(C)c1cccc(c1)CF 271570a_100000694244_100010878472 [0,2,0,0,1,0|0,0,0]=3 14361 B11R1.266 C=C(C)c1cccc(c1)CN 271570a_100000694244_100000106179 [0,2,0,0,1,0|0,0,0]=3 14362 B11R1.266 C=C(C)c1cccc(c1)CO 271570a_100000694244_100000687537 [0,2,0,0,1,0|0,0,0]=3 14363 B11R1.266 C=C(C)c1cccc(c1)NC 271570a_100000694244_100000219648 [0,2,0,0,1,0|0,0,0]=3 14364 B11R1.266 C=C(C)c1cccc(c1)NN 271570a_100000694244_100000217339 [0,2,0,0,1,0|0,0,0]=3 14365 B11R1.266 C=C(C)c1cccc(c1)OC 271570a_100000694244_100000170001 [0,2,0,0,1,0|0,0,0]=3 14366 B11R1.266 C=C(C)c1cccc(c1)SC 271570a_100000694244_100011215954 [0,2,0,0,1,0|0,0,0]=3 14367 B11R1.266 C=C(C)c1cccc(c1)SC 62a_100012123953_200000210301 [0,2,0,0,1,0|0,0,0]=3 14368 B11R1.266 C=C(C)c1cccc(c1)SC 62a_200000210301_100012123953 [0,2,0,0,1,0|0,0,0]=3 14369 B11R1.266 C=C(C)c1cccc(c1)S[13CH3] 62a_100012123953_200025704644 [0,2,0,0,1,0|0,0,0]=3 14370 B11R1.266 C=C(C)c1cccc(c1)S[13CH3] 62a_200025704644_100012123953 [0,2,0,0,1,0|0,0,0]=3 14371 B11R1.266 C=C(C)c1cccc(n1)C#N 271570a_100000694244_100011934037 [0,2,0,0,1,0|1,0,0]=4 14372 B11R1.266 C=C(C)c1cccc(n1)C=O 271570a_100000694244_100000688028 [0,2,0,0,1,0|1,0,0]=4 14373 B11R1.266 C=C(C)c1cccc(n1)CC 271570a_100000694244_100009856026 [0,2,0,0,1,0|1,0,0]=4 14374 B11R1.266 C=C(C)c1cccc(n1)CN 271570a_100000694244_100016990191 [0,2,0,0,1,0|1,0,0]=4 14375 B11R1.266 C=C(C)c1cccc(n1)CO 271570a_100000694244_100000694195 [0,2,0,0,1,0|1,0,0]=4 14376 B11R1.266 C=C(C)c1cccc(n1)NC 271570a_100000694244_100000703281 [0,2,0,0,1,0|1,0,0]=4 14377 B11R1.266 C=C(C)c1cccc(n1)NN 271570a_100000694244_100009817029 [0,2,0,0,1,0|1,0,0]=4 14378 B11R1.266 C=C(C)c1cccc(n1)OC 271570a_100000694244_100000760917 [0,2,0,0,1,0|1,0,0]=4 14379 B11R1.266 C=C(C)c1cccc(n1)SC 271570a_100000694244_100011960944 [0,2,0,0,1,0|1,0,0]=4 14380 B11R1.266 C=C(C)c1ccnc(c1)C#N 271570a_100000694244_100000685610 [0,2,0,0,1,0|1,0,0]=4 14381 B11R1.266 C=C(C)c1ccnc(c1)C=O 271570a_100000694244_100011998288 [0,2,0,0,1,0|1,0,0]=4 14382 B11R1.266 C=C(C)c1ccnc(c1)CC 271570a_100000694244_100009820011 [0,2,0,0,1,0|1,0,0]=4 14383 B11R1.266 C=C(C)c1ccnc(c1)CN 271570a_100000694244_100000085674 [0,2,0,0,1,0|1,0,0]=4 14384 B11R1.266 C=C(C)c1ccnc(c1)CO 271570a_100000694244_100009819072 [0,2,0,0,1,0|1,0,0]=4 14385 B11R1.266 C=C(C)c1ccnc(c1)NC 271570a_100000694244_100009819592 [0,2,0,0,1,0|1,0,0]=4 14386 B11R1.266 C=C(C)c1ccnc(c1)NN 271570a_100000694244_100000764631 [0,2,0,0,1,0|1,0,0]=4 14387 B11R1.266 C=C(C)c1ccnc(c1)OC 271570a_100000694244_100000117307 [0,2,0,0,1,0|1,0,0]=4 14388 B11R1.266 C=C(C)c1cncc(c1)C#N 271570a_100000694244_100000686085 [0,2,0,0,1,0|1,0,0]=4 14389 B11R1.266 C=C(C)c1cncc(c1)C=O 271570a_100000694244_100000687066 [0,2,0,0,1,0|1,0,0]=4 14390 B11R1.266 C=C(C)c1cncc(c1)CC 271570a_100000694244_200009819073 [0,2,0,0,1,0|1,0,0]=4 14391 B11R1.266 C=C(C)c1cncc(c1)CN 271570a_100000694244_100011249555 [0,2,0,0,1,0|1,0,0]=4 14392 B11R1.266 C=C(C)c1cncc(c1)CO 271570a_100000694244_100011259137 [0,2,0,0,1,0|1,0,0]=4 14393 B11R1.266 C=C(C)c1cncc(c1)NC 271570a_100000694244_100012184536 [0,2,0,0,1,0|1,0,0]=4 14394 B11R1.266 C=C(C)c1cncc(c1)NN 271570a_100000694244_100000727789 [0,2,0,0,1,0|1,0,0]=4 14395 B11R1.266 C=C(C)c1cncc(c1)OC 271570a_100000694244_100000684773 [0,2,0,0,1,0|1,0,0]=4 14396 B11R1.266 C=C(C)c1cncc(c1)SC 271570a_100000694244_100009816972 [0,2,0,0,1,0|1,0,0]=4 14397 B11R1.266 C=C(C)c1cncc(c1)SC 62a_200000210301_200009889500 [0,2,0,0,1,0|1,0,0]=4 14398 B11R1.266 C=C(C)c1cncc(c1)SC 62a_200009889500_200000210301 [0,2,0,0,1,0|1,0,0]=4 14399 B11R1.266 C=C(C)c1cncc(c1)S[13CH3] 62a_200009889500_200025704644 [0,2,0,0,1,0|1,0,0]=4 14400 B11R1.266 C=C(C)c1cncc(c1)S[13CH3] 62a_200025704644_200009889500 [0,2,0,0,1,0|1,0,0]=4 14401 B11R1.266 C=Cc1cccc(c1)C(=C)C 271570a_100011290941_100012123953 [0,2,0,0,1,0|0,0,0]=3 14402 B11R1.266 C=Cc1cccc(c1)C(=O)C 1458a_100011215009_200000210301 [0,2,0,0,1,0|1,0,0]=4 14403 B11R1.266 C=Cc1cccc(c1)C(=O)C 271570a_100011290941_100000210093 [0,2,0,0,1,0|1,0,0]=4 14404 B11R1.266 C=Cc1cccc(c1)C(=O)[13CH3] 1458a_100011215009_200025704644 [0,2,0,0,1,0|1,0,0]=4 14405 B11R1.266 C=Cc1cncc(c1)C(=C)C 271570a_100011290941_200009889500 [0,2,0,0,1,0|1,0,0]=4 14406 B11R1.266 CC(=O)c1cccc(c1)C#N 1458a_100000183950_200000210301 [0,2,0,0,1,0|1,0,0]=4 14407 B11R1.266 CC(=O)c1cccc(c1)CO 1458a_100000746274_200000210301 [0,2,0,0,1,0|1,0,0]=4 14408 B11R1.266 CC(=O)c1cccc(c1)O[13CH3] 34a_100000211620_200025704644 [0,2,0,0,1,0|1,0,0]=4 14409 B11R1.266 CC(=O)c1cccc(c1)O[13CH3] 7a_100000211620_200025704644 [0,2,0,0,1,0|1,0,0]=4 14410 B11R1.266 CC(=O)c1cccc(c1)S[13CH3] 62a_100000210093_200025704644 [0,2,0,0,1,0|1,0,0]=4 14411 B11R1.266 CC(=O)c1cccc(c1)S[13CH3] 62a_200025704644_100000210093 [0,2,0,0,1,0|1,0,0]=4 14412 B11R1.266 CCc1cccc(c1)C(=O)C 1458a_100011933908_200000210301 [0,2,0,0,1,0|1,0,0]=4 14413 B11R1.266 CCc1cccc(c1)C(=O)[13CH3] 1458a_100011933908_200025704644 [0,2,0,0,1,0|1,0,0]=4 14414 B11R1.266 COc1cccc(c1)C(=O)C 1458a_100000188888_200000210301 [0,2,0,0,1,0|1,0,0]=4 14415 B11R1.266 COc1cccc(c1)C(=O)C 34a_100000211620_200000210301 [0,2,0,0,1,0|1,0,0]=4 14416 B11R1.266 COc1cccc(c1)C(=O)C 7a_100000211620_200000210301 [0,2,0,0,1,0|1,0,0]=4 14417 B11R1.266 COc1cccc(c1)C(=O)[13CH3] 1458a_100000188888_200025704644 [0,2,0,0,1,0|1,0,0]=4 14418 B11R1.266 CSc1cccc(c1)C(=O)C 1458a_100011217804_200000210301 [0,2,0,0,1,0|1,0,0]=4 14419 B11R1.266 CSc1cccc(c1)C(=O)C 62a_100000210093_200000210301 [0,2,0,0,1,0|1,0,0]=4 14420 B11R1.266 CSc1cccc(c1)C(=O)C 62a_200000210301_100000210093 [0,2,0,0,1,0|1,0,0]=4 14421 B11R1.266 CSc1cccc(c1)C(=O)[13CH3] 1458a_100011217804_200025704644 [0,2,0,0,1,0|1,0,0]=4 14422 B11R1.266 [13CH3]C(=O)c1cccc(c1)C#N 1458a_100000183950_200025704644 [0,2,0,0,1,0|1,0,0]=4 14423 B11R1.266 [13CH3]C(=O)c1cccc(c1)CO 1458a_100000746274_200025704644 [0,2,0,0,1,0|1,0,0]=4 14424 B13R1.45 C=C(C)CCC(=O)c1ccccc1 1458a_100000185807_100000730704 [0,1,0,0,0,2|0,0,0]=3 14425 B13R1.45 C=C(C)CCN(C)c1ccccc1 2230a_100000210012_100000730704 [0,1,0,0,0,2|0,0,0]=3 14426 B13R1.45 C=C(C)CCN(C)c1ccccc1 269982a_100000210012_100000730704 [0,1,0,0,0,2|0,0,0]=3 14427 B13R1.45 C=C(C)CCN(C)c1ccccc1 34a_100000210012_100000730704 [0,1,0,0,0,2|0,0,0]=3 14428 B13R1.45 C=C(C)CNC(=O)c1ccccc1 11a_100000765925_100000185807 [0,1,0,0,0,2|0,0,0]=3 14429 B13R1.45 C=C(C)CNC(=O)c1ccccc1 1626a_100000765925_100000185807 [0,1,0,0,0,2|0,0,0]=3 14430 B13R1.45 C=C(C)CNC(=O)c1ccccc1 240690a_100000765925_100000185807 [0,1,0,0,0,2|0,0,0]=3 14431 B13R1.45 C=C(C)CNC(=O)c1ccccc1 527a_100000765925_100000185807 [0,1,0,0,0,2|0,0,0]=3 14432 B13R1.45 C=C(C)CNC(C)c1ccccn1 2230a_100000181244_100000748629 [0,1,0,0,0,2|1,0,0]=4 14433 B13R1.45 C=C(C)CNC(C)c1cccnc1 2230a_100000195435_100000748629 [0,1,0,0,0,2|1,0,0]=4 14434 B13R1.45 C=C(C)CNC(C)c1ccncc1 2230a_100000181269_100000748629 [0,1,0,0,0,2|1,0,0]=4 14435 B13R1.45 C=C(C)CN[C@H](C)c1ccccc1 2230a_100000751104_100000748629 [0,1,0,0,0,2|0,0,0]=3 14436 B13R1.45 C=C(C)COC(C)c1ccccc1 34a_100000210245_100000211855 [0,1,0,0,0,2|0,0,0]=3 14437 B13R1.45 C=C(C)CO[C@H](C)c1ccccc1 34a_100000761318_100000748629 [0,1,0,0,0,2|0,0,0]=3 14438 B13R1.45 C=C(C)CO[C@H](C)c1ccccc1 7a_100000761318_100000748629 [0,1,0,0,0,2|0,0,0]=3 14439 B13R1.45 C=C(C)CSC(C)c1ccccc1 62a_100000230085_100000211660 [0,1,0,0,0,2|0,0,0]=3 14440 B13R1.45 C=C(C)CSC(C)c1ccccc1 62a_100000748629_100000230085 [0,1,0,0,0,2|0,0,0]=3 14441 B13R1.45 C=C(F)CN[C@H](C)c1ccccc1 2230a_100000751104_100009893438 [0,1,0,0,0,2|1,0,0]=4 14442 B13R1.45 C=C(F)COC(C)c1ccccc1 34a_200010262243_100000211855 [0,1,0,0,0,2|1,0,0]=4 14443 B13R1.45 C=C(F)CO[C@H](C)c1ccccc1 34a_100000761318_100009893438 [0,1,0,0,0,2|1,0,0]=4 14444 B13R1.45 C=C(F)CO[C@H](C)c1ccccc1 7a_100000761318_100000042424 [0,1,0,0,0,2|1,0,0]=4 14445 B13R1.45 C=C(F)CSC(C)c1ccccc1 62a_100000042424_100000230085 [0,1,0,0,0,2|1,0,0]=4 14446 B13R1.45 C=C(F)CSC(C)c1ccccc1 62a_100000230085_100000042424 [0,1,0,0,0,2|1,0,0]=4 14447 B13R1.45 CC(=CCC(=O)c1ccccc1)C 1458a_100000185807_100000761012 [0,1,0,0,0,2|0,0,1]=4 14448 B13R1.45 CC(=CCN(C)c1ccccc1)C 2230a_100000210012_100000761012 [0,1,0,0,0,2|0,0,1]=4 14449 B13R1.45 CC(=CCN(C)c1ccccc1)C 269982a_100000210012_100000761012 [0,1,0,0,0,2|0,0,1]=4 14450 B13R1.45 CC(=CCN(C)c1ccccc1)C 34a_100000210012_100000761012 [0,1,0,0,0,2|0,0,1]=4 14451 B13R1.45 CC(=O)CCC(=O)c1ccccc1 1458a_100000070787_100000750707 [0,1,0,0,0,2|1,0,0]=4 14452 B13R1.45 CC(=O)CCN(C)c1ccccc1 269982a_100000210012_100000053229 [0,1,0,0,0,2|1,0,0]=4 14453 B13R1.45 CC(=O)CC[C@@H](O)c1ccccc1 1458a_100000070787_100000729684 [0,1,0,0,0,2|1,0,0]=4 14454 B13R1.45 CC(=O)CNC(=O)c1ccccc1 1458a_100000182045_200000210301 [0,1,0,0,0,2|1,0,0]=4 14455 B13R1.45 CC(=O)COC(=O)c1ccccc1 1458a_100000070787_100000073877 [0,1,0,0,0,2|1,0,0]=4 14456 B13R1.45 CC(=O)COC(C)c1ccccc1 34a_100000211253_100000211855 [0,1,0,0,0,2|1,0,0]=4 14457 B13R1.45 CC(=O)CSC(=S)c1ccccc1 1458a_100000043459_200000210301 [0,1,0,0,0,2|1,0,0]=4 14458 B13R1.45 CC(=O)NCC(C)c1ccccc1 11a_100000701038_100015343762 [0,1,0,0,0,2|1,0,0]=4 14459 B13R1.45 CC(=O)NCC(C)c1ccccc1 1626a_100000701038_100015343762 [0,1,0,0,0,2|1,0,0]=4 14460 B13R1.45 CC(=O)NCC(C)c1ccccc1 240690a_100000701038_100015343762 [0,1,0,0,0,2|1,0,0]=4 14461 B13R1.45 CC(=O)NCC(C)c1ccccc1 527a_100000701038_100103153847 [0,1,0,0,0,2|1,0,0]=4 14462 B13R1.45 CC(=O)NCC(O)c1ccccc1 240690a_100000210709_100015343762 [0,1,0,0,0,2|1,0,0]=4 14463 B13R1.45 CC(=O)NCC(O)c1ccccc1 527a_100000210709_100103153847 [0,1,0,0,0,2|1,0,0]=4 14464 B13R1.45 CC(=O)OCN(C)c1ccccc1 269982a_100000210012_100000076356 [0,1,0,0,0,2|1,0,0]=4 14465 B13R1.45 CC(=O)OCN(C)c1ccccc1 34a_100000210012_100009813279 [0,1,0,0,0,2|1,0,0]=4 14466 B13R1.45 [13CH3]C(=O)CNC(=O)c1ccccc1 1458a_100000182045_200025704644 [0,1,0,0,0,2|1,0,0]=4 14467 B13R1.45 [13CH3]C(=O)CSC(=S)c1ccccc1 1458a_100000043459_200025704644 [0,1,0,0,0,2|1,0,0]=4 14468 B13R1.149 C=C(C)C=NNc1cccc(c1)Br 4a_100000217339_100000210575 [0,1,0,0,0,2|0,0,1]=4 14469 B13R1.149 C=C(C)C=NNc1cccc(c1)C 4a_100000681630_100000210575 [0,1,0,0,0,2|0,0,1]=4 14470 B13R1.149 C=C(C)C=NNc1cccc(c1)Cl 4a_100000184277_100000210575 [0,1,0,0,0,2|0,0,1]=4 14471 B13R1.149 C=C(C)C=NNc1cccc(c1)F 4a_100000745080_100000210575 [0,1,0,0,0,2|0,0,1]=4 14472 B13R1.149 C=C(C)C=NNc1cccc(c1)I 4a_100020605690_100000210575 [0,1,0,0,0,2|0,0,1]=4 14473 B13R1.149 C=C(C)CCNc1cccc(c1)Br 34a_100000210019_100000730704 [0,1,0,0,0,2|0,0,0]=3 14474 B13R1.149 C=C(C)CCNc1cccc(c1)C 2230a_100000188690_100000730704 [0,1,0,0,0,2|0,0,0]=3 14475 B13R1.149 C=C(C)CCNc1cccc(c1)C 34a_100000188690_100000730704 [0,1,0,0,0,2|0,0,0]=3 14476 B13R1.149 C=C(C)CCNc1cccc(c1)Cl 34a_100000185859_100000730704 [0,1,0,0,0,2|0,0,0]=3 14477 B13R1.149 C=C(C)CCNc1cccc(c1)F 34a_100000210047_100000730704 [0,1,0,0,0,2|0,0,0]=3 14478 B13R1.149 C=C(C)CCNc1cccc(c1)I 34a_100000211102_100000730704 [0,1,0,0,0,2|0,0,0]=3 14479 B13R1.149 C=C(C)CCNc1cccc(c1)O 34a_100000210217_100000730704 [0,1,0,0,0,2|0,0,0]=3 14480 B13R1.149 C=C(C)CCOc1cc[nH]c(=O)c1 34a_100000032262_100000730704 [0,1,0,0,0,2|1,0,0]=4 14481 B13R1.149 C=C(C)CCOc1ccc[n+](c1)[O-] 34a_100000039713_100000730704 [0,1,0,0,0,2|1,0,0]=4 14482 B13R1.149 C=C(C)CCOc1ccc[n+](c1)[O-] 7a_100000039713_100000730704 [0,1,0,0,0,2|1,0,0]=4 14483 B13R1.149 C=C(C)CCOc1cccc(=O)[nH]1 34a_100000033347_100000730704 [0,1,0,0,0,2|1,0,0]=4 14484 B13R1.149 C=C(C)CCOc1cccc(c1)Br 34a_100000210342_100000730704 [0,1,0,0,0,2|0,0,0]=3 14485 B13R1.149 C=C(C)CCOc1cccc(c1)Br 7a_100000210342_100000730704 [0,1,0,0,0,2|0,0,0]=3 14486 B13R1.149 C=C(C)CCOc1cccc(c1)C 34a_100000210337_100000730704 [0,1,0,0,0,2|0,0,0]=3 14487 B13R1.149 C=C(C)CCOc1cccc(c1)C 7a_100000210337_100000730704 [0,1,0,0,0,2|0,0,0]=3 14488 B13R1.149 C=C(C)CCOc1cccc(c1)Cl 34a_100000210295_100000730704 [0,1,0,0,0,2|0,0,0]=3 14489 B13R1.149 C=C(C)CCOc1cccc(c1)Cl 7a_100000210295_100000730704 [0,1,0,0,0,2|0,0,0]=3 14490 B13R1.149 C=C(C)CCOc1cccc(c1)F 34a_100000210426_100000730704 [0,1,0,0,0,2|0,0,0]=3 14491 B13R1.149 C=C(C)CCOc1cccc(c1)F 7a_100000210426_100000730704 [0,1,0,0,0,2|0,0,0]=3 14492 B13R1.149 C=C(C)CCOc1cccc(c1)I 34a_100000211634_100000730704 [0,1,0,0,0,2|0,0,0]=3 14493 B13R1.149 C=C(C)CCOc1cccc(c1)I 7a_100000211634_100000730704 [0,1,0,0,0,2|0,0,0]=3 14494 B13R1.149 C=C(C)CCOc1cccc(c1)N 34a_100000210217_100000730704 [0,1,0,0,0,2|0,0,0]=3 14495 B13R1.149 C=C(C)CCOc1cccc(n1)F 34a_100011432558_100000730704 [0,1,0,0,0,2|1,0,0]=4 14496 B13R1.149 C=C(C)CCOc1ccnc(c1)C 34a_100000688365_100000730704 [0,1,0,0,0,2|1,0,0]=4 14497 B13R1.149 C=C(C)CCOc1ccnc(c1)Cl 34a_100000762945_100000730704 [0,1,0,0,0,2|1,0,0]=4 14498 B13R1.149 C=C(C)CCOc1ccnc(c1)F 34a_100000732698_100000730704 [0,1,0,0,0,2|1,0,0]=4 14499 B13R1.149 C=C(C)CCOc1ccnc(c1)N 34a_100011834064_100000730704 [0,1,0,0,0,2|1,0,0]=4 14500 B13R1.149 C=C(C)CCOc1cncc(c1)Br 34a_100000754920_100000730704 [0,1,0,0,0,2|1,0,0]=4 14501 B13R1.149 C=C(C)CCOc1cncc(c1)Br 7a_100000754920_100000730704 [0,1,0,0,0,2|1,0,0]=4 14502 B13R1.149 C=C(C)CCOc1cncc(c1)C 34a_100011830280_100000730704 [0,1,0,0,0,2|1,0,0]=4 14503 B13R1.149 C=C(C)CCOc1cncc(c1)C 7a_100011830280_100000730704 [0,1,0,0,0,2|1,0,0]=4 14504 B13R1.149 C=C(C)CCOc1cncc(c1)Cl 7a_100000032511_100000730704 [0,1,0,0,0,2|1,0,0]=4 14505 B13R1.149 C=C(C)CCOc1cncc(c1)F 34a_100011830296_100000730704 [0,1,0,0,0,2|1,0,0]=4 14506 B13R1.149 C=C(C)CCOc1cncc(c1)F 7a_100011830296_100000730704 [0,1,0,0,0,2|1,0,0]=4 14507 B13R1.149 C=C(C)CCOc1cncc(c1)N 34a_100011997051_100000730704 [0,1,0,0,0,2|1,0,0]=4 14508 B13R1.149 C=C(C)CCSc1cc(=O)cc[nH]1 62a_100009817434_100000730704 [0,1,0,0,0,2|1,0,0]=4 14509 B13R1.149 C=C(C)CCSc1cc(ccn1)C 62a_100000730704_100000750283 [0,1,0,0,0,2|1,0,0]=4 14510 B13R1.149 C=C(C)CCSc1cc(ccn1)C 62a_100000750283_100000730704 [0,1,0,0,0,2|1,0,0]=4 14511 B13R1.149 C=C(C)CCSc1cc(ccn1)Cl 62a_100000730704_100010167805 [0,1,0,0,0,2|1,0,0]=4 14512 B13R1.149 C=C(C)CCSc1cc(ccn1)Cl 62a_100010167805_100000730704 [0,1,0,0,0,2|1,0,0]=4 14513 B13R1.149 C=C(C)CCSc1cc(ccn1)F 62a_100000730704_100000764206 [0,1,0,0,0,2|1,0,0]=4 14514 B13R1.149 C=C(C)CCSc1cc(ccn1)F 62a_100000764206_100000730704 [0,1,0,0,0,2|1,0,0]=4 14515 B13R1.149 C=C(C)CCSc1cc(ccn1)N 62a_100000730704_100009814236 [0,1,0,0,0,2|1,0,0]=4 14516 B13R1.149 C=C(C)CCSc1cc(ccn1)N 62a_100009814236_100000730704 [0,1,0,0,0,2|1,0,0]=4 14517 B13R1.149 C=C(C)CCSc1cc(ccn1)O 62a_100000730704_100000762945 [0,1,0,0,0,2|1,0,0]=4 14518 B13R1.149 C=C(C)CCSc1cc[nH]c(=O)c1 62a_100000730704_100009816521 [0,1,0,0,0,2|1,0,0]=4 14519 B13R1.149 C=C(C)CCSc1cc[nH]c(=O)c1 62a_100009816521_100000730704 [0,1,0,0,0,2|1,0,0]=4 14520 B13R1.149 C=C(C)CCSc1ccc[n+](c1)C 62a_100000730704_100009996589 [0,1,0,0,0,2|1,0,0]=4 14521 B13R1.149 C=C(C)CCSc1ccc[n+](c1)C 62a_100009996589_100000730704 [0,1,0,0,0,2|1,0,0]=4 14522 B13R1.149 C=C(C)CCSc1ccc[n+](c1)[O-] 62a_100000730704_100009815978 [0,1,0,0,0,2|1,0,0]=4 14523 B13R1.149 C=C(C)CCSc1cccc(=O)[nH]1 62a_100000730704_100000752884 [0,1,0,0,0,2|1,0,0]=4 14524 B13R1.149 C=C(C)CCSc1cccc(c1)Br 62a_100000691529_100000730704 [0,1,0,0,0,2|0,0,0]=3 14525 B13R1.149 C=C(C)CCSc1cccc(c1)Br 62a_100000730704_100000691529 [0,1,0,0,0,2|0,0,0]=3 14526 B13R1.149 C=C(C)CCSc1cccc(c1)C 62a_100000730704_100011215228 [0,1,0,0,0,2|0,0,0]=3 14527 B13R1.149 C=C(C)CCSc1cccc(c1)C 62a_100011215228_100000730704 [0,1,0,0,0,2|0,0,0]=3 14528 B13R1.149 C=C(C)CCSc1cccc(c1)Cl 62a_100000699651_100000730704 [0,1,0,0,0,2|0,0,0]=3 14529 B13R1.149 C=C(C)CCSc1cccc(c1)Cl 62a_100000730704_100000699651 [0,1,0,0,0,2|0,0,0]=3 14530 B13R1.149 C=C(C)CCSc1cccc(c1)F 62a_100000685547_100000730704 [0,1,0,0,0,2|0,0,0]=3 14531 B13R1.149 C=C(C)CCSc1cccc(c1)F 62a_100000730704_100000685547 [0,1,0,0,0,2|0,0,0]=3 14532 B13R1.149 C=C(C)CCSc1cccc(c1)N 62a_100000210019_100000730704 [0,1,0,0,0,2|0,0,0]=3 14533 B13R1.149 C=C(C)CCSc1cccc(c1)N 62a_100000730704_100000210019 [0,1,0,0,0,2|0,0,0]=3 14534 B13R1.149 C=C(C)CCSc1cccc(c1)O 62a_100000730704_100000211634 [0,1,0,0,0,2|0,0,0]=3 14535 B13R1.149 C=C(C)CCSc1cccc(c1)[S] 62a_100000730704_114929384022 [0,1,0,0,0,2|0,0,0]=3 14536 B13R1.149 C=C(C)CCSc1cccc(c1)[S] 62a_114929384022_100000730704 [0,1,0,0,0,2|0,0,0]=3 14537 B13R1.149 C=C(C)CCSc1cccc(n1)Br 62a_100000684672_100000730704 [0,1,0,0,0,2|1,0,0]=4 14538 B13R1.149 C=C(C)CCSc1cccc(n1)Br 62a_100000730704_100000684672 [0,1,0,0,0,2|1,0,0]=4 14539 B13R1.149 C=C(C)CCSc1cccc(n1)C 62a_100000730704_100000742759 [0,1,0,0,0,2|1,0,0]=4 14540 B13R1.149 C=C(C)CCSc1cccc(n1)C 62a_100000742759_100000730704 [0,1,0,0,0,2|1,0,0]=4 14541 B13R1.149 C=C(C)CCSc1cccc(n1)Cl 62a_100000051397_100000730704 [0,1,0,0,0,2|1,0,0]=4 14542 B13R1.149 C=C(C)CCSc1cccc(n1)Cl 62a_100000730704_100000051397 [0,1,0,0,0,2|1,0,0]=4 14543 B13R1.149 C=C(C)CCSc1cccc(n1)F 62a_100000730704_100009815982 [0,1,0,0,0,2|1,0,0]=4 14544 B13R1.149 C=C(C)CCSc1cccc(n1)F 62a_100009815982_100000730704 [0,1,0,0,0,2|1,0,0]=4 14545 B13R1.149 C=C(C)CCSc1cccc(n1)N 62a_100000730704_100000740741 [0,1,0,0,0,2|1,0,0]=4 14546 B13R1.149 C=C(C)CCSc1cccc(n1)N 62a_100000740741_100000730704 [0,1,0,0,0,2|1,0,0]=4 14547 B13R1.149 C=C(C)CCSc1ccnc(c1)Br 62a_100000730704_100009814637 [0,1,0,0,0,2|1,0,0]=4 14548 B13R1.149 C=C(C)CCSc1ccnc(c1)Br 62a_100009814637_100000730704 [0,1,0,0,0,2|1,0,0]=4 14549 B13R1.149 C=C(C)CCSc1ccnc(c1)C 62a_100000730704_100000758586 [0,1,0,0,0,2|1,0,0]=4 14550 B13R1.149 C=C(C)CCSc1ccnc(c1)C 62a_100000758586_100000730704 [0,1,0,0,0,2|1,0,0]=4 14551 B13R1.149 C=C(C)CCSc1ccnc(c1)Cl 62a_100000035001_100000730704 [0,1,0,0,0,2|1,0,0]=4 14552 B13R1.149 C=C(C)CCSc1ccnc(c1)Cl 62a_100000730704_100000035001 [0,1,0,0,0,2|1,0,0]=4 14553 B13R1.149 C=C(C)CCSc1ccnc(c1)F 62a_100000730704_100009816116 [0,1,0,0,0,2|1,0,0]=4 14554 B13R1.149 C=C(C)CCSc1ccnc(c1)F 62a_100009816116_100000730704 [0,1,0,0,0,2|1,0,0]=4 14555 B13R1.149 C=C(C)CCSc1ccnc(c1)N 62a_100000049665_100000730704 [0,1,0,0,0,2|1,0,0]=4 14556 B13R1.149 C=C(C)CCSc1ccnc(c1)N 62a_100000730704_100000049665 [0,1,0,0,0,2|1,0,0]=4 14557 B13R1.149 C=C(C)CCSc1cncc(c1)Br 62a_100000728054_100000730704 [0,1,0,0,0,2|1,0,0]=4 14558 B13R1.149 C=C(C)CCSc1cncc(c1)Br 62a_100000730704_100000728054 [0,1,0,0,0,2|1,0,0]=4 14559 B13R1.149 C=C(C)CCSc1cncc(c1)C 62a_100000730704_100000760492 [0,1,0,0,0,2|1,0,0]=4 14560 B13R1.149 C=C(C)CCSc1cncc(c1)C 62a_100000760492_100000730704 [0,1,0,0,0,2|1,0,0]=4 14561 B13R1.149 C=C(C)CCSc1cncc(c1)Cl 62a_100000049639_100000730704 [0,1,0,0,0,2|1,0,0]=4 14562 B13R1.149 C=C(C)CCSc1cncc(c1)Cl 62a_100000730704_100000049639 [0,1,0,0,0,2|1,0,0]=4 14563 B13R1.149 C=C(C)CCSc1cncc(c1)F 62a_100000730704_100000744099 [0,1,0,0,0,2|1,0,0]=4 14564 B13R1.149 C=C(C)CCSc1cncc(c1)F 62a_100000744099_100000730704 [0,1,0,0,0,2|1,0,0]=4 14565 B13R1.149 C=C(C)CCSc1cncc(c1)N 62a_100000687067_100000730704 [0,1,0,0,0,2|1,0,0]=4 14566 B13R1.149 C=C(C)CCSc1cncc(c1)N 62a_100000730704_100000687067 [0,1,0,0,0,2|1,0,0]=4 14567 B13R1.149 C=C(C)CCSc1cncc(c1)O 62a_100000730704_100000754920 [0,1,0,0,0,2|1,0,0]=4 14568 B13R1.149 C=C(C)CCSc1cncc(c1)O 62a_100000754920_100000730704 [0,1,0,0,0,2|1,0,0]=4 14569 B13R1.149 C=C(C)CNCc1cccc(=O)[nH]1 2230a_100000696482_100000748629 [0,1,0,0,0,2|1,0,0]=4 14570 B13R1.149 C=C(C)CNCc1cccc(c1)Br 2230a_100000174977_100000748629 [0,1,0,0,0,2|0,0,0]=3 14571 B13R1.149 C=C(C)CNCc1cccc(c1)Br 34a_100000174977_100000748629 [0,1,0,0,0,2|0,0,0]=3 14572 B13R1.149 C=C(C)CNCc1cccc(c1)C 2230a_100000185548_100000748629 [0,1,0,0,0,2|0,0,0]=3 14573 B13R1.149 C=C(C)CNCc1cccc(c1)C 34a_100000185548_100000748629 [0,1,0,0,0,2|0,0,0]=3 14574 B13R1.149 C=C(C)CNCc1cccc(c1)Cl 2230a_100000174878_100000748629 [0,1,0,0,0,2|0,0,0]=3 14575 B13R1.149 C=C(C)CNCc1cccc(c1)Cl 34a_100000174878_100000748629 [0,1,0,0,0,2|0,0,0]=3 14576 B13R1.149 C=C(C)CNCc1cccc(c1)F 2230a_100000174948_100000748629 [0,1,0,0,0,2|0,0,0]=3 14577 B13R1.149 C=C(C)CNCc1cccc(c1)F 34a_100000174948_100000748629 [0,1,0,0,0,2|0,0,0]=3 14578 B13R1.149 C=C(C)CNCc1cccc(c1)I 2230a_100000106179_100000748629 [0,1,0,0,0,2|0,0,0]=3 14579 B13R1.149 C=C(C)CNCc1cccc(c1)I 34a_100000106179_100000748629 [0,1,0,0,0,2|0,0,0]=3 14580 B13R1.149 C=C(C)CNCc1cccc(c1)O 2230a_100000743036_100000748629 [0,1,0,0,0,2|0,0,0]=3 14581 B13R1.149 C=C(C)CNCc1cccc(c1)O 34a_100000743036_100000748629 [0,1,0,0,0,2|0,0,0]=3 14582 B13R1.149 C=C(C)CNCc1cccc(n1)Br 2230a_100016987751_100000748629 [0,1,0,0,0,2|1,0,0]=4 14583 B13R1.149 C=C(C)CNCc1cccc(n1)C 34a_100000701342_100000748629 [0,1,0,0,0,2|1,0,0]=4 14584 B13R1.149 C=C(C)CNCc1cccc(n1)Cl 2230a_100016990191_100000748629 [0,1,0,0,0,2|1,0,0]=4 14585 B13R1.149 C=C(C)CNCc1cccc(n1)F 2230a_100015188798_100000748629 [0,1,0,0,0,2|1,0,0]=4 14586 B13R1.149 C=C(C)CNCc1cccc(n1)F 34a_100015188798_100000748629 [0,1,0,0,0,2|1,0,0]=4 14587 B13R1.149 C=C(C)CNCc1ccnc(c1)Br 2230a_100025757509_100000748629 [0,1,0,0,0,2|1,0,0]=4 14588 B13R1.149 C=C(C)CNCc1ccnc(c1)Br 34a_100025757509_100000748629 [0,1,0,0,0,2|1,0,0]=4 14589 B13R1.149 C=C(C)CNCc1ccnc(c1)C 34a_100011934566_100000748629 [0,1,0,0,0,2|1,0,0]=4 14590 B13R1.149 C=C(C)CNCc1ccnc(c1)Cl 2230a_100015205668_100000748629 [0,1,0,0,0,2|1,0,0]=4 14591 B13R1.149 C=C(C)CNCc1ccnc(c1)Cl 34a_100015205668_100000748629 [0,1,0,0,0,2|1,0,0]=4 14592 B13R1.149 C=C(C)CNCc1ccnc(c1)F 2230a_100015188774_100000748629 [0,1,0,0,0,2|1,0,0]=4 14593 B13R1.149 C=C(C)CNCc1ccnc(c1)F 34a_100015188774_100000748629 [0,1,0,0,0,2|1,0,0]=4 14594 B13R1.149 C=C(C)CNCc1cncc(c1)C 2230a_100000692839_100000748629 [0,1,0,0,0,2|1,0,0]=4 14595 B13R1.149 C=C(C)CNCc1cncc(c1)C 34a_100000692839_100000748629 [0,1,0,0,0,2|1,0,0]=4 14596 B13R1.149 C=C(C)CNCc1cncc(c1)Cl 2230a_200020614424_100000748629 [0,1,0,0,0,2|1,0,0]=4 14597 B13R1.149 C=C(C)CNCc1cncc(c1)F 2230a_100011962886_100000748629 [0,1,0,0,0,2|1,0,0]=4 14598 B13R1.149 C=C(C)CNCc1cncc(c1)F 34a_100011962886_100000748629 [0,1,0,0,0,2|1,0,0]=4 14599 B13R1.149 C=C(C)COCc1cc(ccn1)Br 34a_100000210245_100010173614 [0,1,0,0,0,2|1,0,0]=4 14600 B13R1.149 C=C(C)COCc1cc(ccn1)C 34a_100000210245_100000718516 [0,1,0,0,0,2|1,0,0]=4 14601 B13R1.149 C=C(C)COCc1cc(ccn1)C 34a_100011998357_100000748629 [0,1,0,0,0,2|1,0,0]=4 14602 B13R1.149 C=C(C)COCc1cc(ccn1)Cl 34a_100000210245_100016988179 [0,1,0,0,0,2|1,0,0]=4 14603 B13R1.149 C=C(C)COCc1cc(ccn1)Cl 34a_100000748867_100000748629 [0,1,0,0,0,2|1,0,0]=4 14604 B13R1.149 C=C(C)COCc1cc(ccn1)N 34a_100000692640_100000748629 [0,1,0,0,0,2|1,0,0]=4 14605 B13R1.149 C=C(C)COCc1ccc[n+](c1)[O-] 34a_100000037817_100000748629 [0,1,0,0,0,2|1,0,0]=4 14606 B13R1.149 C=C(C)COCc1ccc[n+](c1)[O-] 7a_100000037817_100000748629 [0,1,0,0,0,2|1,0,0]=4 14607 B13R1.149 C=C(C)COCc1cccc(c1)Br 34a_100000210245_100000698116 [0,1,0,0,0,2|0,0,0]=3 14608 B13R1.149 C=C(C)COCc1cccc(c1)Br 34a_100000687537_100000748629 [0,1,0,0,0,2|0,0,0]=3 14609 B13R1.149 C=C(C)COCc1cccc(c1)Br 7a_100000687537_100000748629 [0,1,0,0,0,2|0,0,0]=3 14610 B13R1.149 C=C(C)COCc1cccc(c1)C 34a_100000210245_100000211840 [0,1,0,0,0,2|0,0,0]=3 14611 B13R1.149 C=C(C)COCc1cccc(c1)C 34a_100011217746_100000748629 [0,1,0,0,0,2|0,0,0]=3 14612 B13R1.149 C=C(C)COCc1cccc(c1)C 7a_100011217746_100000748629 [0,1,0,0,0,2|0,0,0]=3 14613 B13R1.149 C=C(C)COCc1cccc(c1)Cl 34a_100000210245_100000187163 [0,1,0,0,0,2|0,0,0]=3 14614 B13R1.149 C=C(C)COCc1cccc(c1)Cl 34a_100000241301_100000748629 [0,1,0,0,0,2|0,0,0]=3 14615 B13R1.149 C=C(C)COCc1cccc(c1)Cl 7a_100000241301_100000748629 [0,1,0,0,0,2|0,0,0]=3 14616 B13R1.149 C=C(C)COCc1cccc(c1)F 34a_100000210245_100000187166 [0,1,0,0,0,2|0,0,0]=3 14617 B13R1.149 C=C(C)COCc1cccc(c1)F 34a_100000210976_100000748629 [0,1,0,0,0,2|0,0,0]=3 14618 B13R1.149 C=C(C)COCc1cccc(c1)F 7a_100000210976_100000748629 [0,1,0,0,0,2|0,0,0]=3 14619 B13R1.149 C=C(C)COCc1cccc(c1)I 34a_100000210245_100011218688 [0,1,0,0,0,2|0,0,0]=3 14620 B13R1.149 C=C(C)COCc1cccc(c1)I 34a_100011215336_100000748629 [0,1,0,0,0,2|0,0,0]=3 14621 B13R1.149 C=C(C)COCc1cccc(c1)I 7a_100011215336_100000748629 [0,1,0,0,0,2|0,0,0]=3 14622 B13R1.149 C=C(C)COCc1cccc(c1)N 34a_100000211919_100000748629 [0,1,0,0,0,2|0,0,0]=3 14623 B13R1.149 C=C(C)COCc1cccc(c1)O 34a_100000210245_100011660834 [0,1,0,0,0,2|0,0,0]=3 14624 B13R1.149 C=C(C)COCc1cccc(n1)Br 34a_100000210245_100009889011 [0,1,0,0,0,2|1,0,0]=4 14625 B13R1.149 C=C(C)COCc1cccc(n1)Br 34a_100000694195_100000748629 [0,1,0,0,0,2|1,0,0]=4 14626 B13R1.149 C=C(C)COCc1cccc(n1)C 34a_100000210245_100000757606 [0,1,0,0,0,2|1,0,0]=4 14627 B13R1.149 C=C(C)COCc1cccc(n1)C 34a_100000690600_100000748629 [0,1,0,0,0,2|1,0,0]=4 14628 B13R1.149 C=C(C)COCc1cccc(n1)Cl 34a_100000210245_100000086093 [0,1,0,0,0,2|1,0,0]=4 14629 B13R1.149 C=C(C)COCc1cccc(n1)Cl 34a_100011998359_100000748629 [0,1,0,0,0,2|1,0,0]=4 14630 B13R1.149 C=C(C)COCc1cccc(n1)F 34a_100000086748_100000748629 [0,1,0,0,0,2|1,0,0]=4 14631 B13R1.149 C=C(C)COCc1cccc(n1)F 34a_100000210245_100009819644 [0,1,0,0,0,2|1,0,0]=4 14632 B13R1.149 C=C(C)COCc1ccnc(c1)Br 34a_100000210245_100010243470 [0,1,0,0,0,2|1,0,0]=4 14633 B13R1.149 C=C(C)COCc1ccnc(c1)Br 34a_100009814636_100000748629 [0,1,0,0,0,2|1,0,0]=4 14634 B13R1.149 C=C(C)COCc1ccnc(c1)Br 7a_100009814636_100000748629 [0,1,0,0,0,2|1,0,0]=4 14635 B13R1.149 C=C(C)COCc1ccnc(c1)C 34a_100000210245_200020672517 [0,1,0,0,0,2|1,0,0]=4 14636 B13R1.149 C=C(C)COCc1ccnc(c1)C 34a_100011998630_100000748629 [0,1,0,0,0,2|1,0,0]=4 14637 B13R1.149 C=C(C)COCc1ccnc(c1)Cl 34a_100000210245_100000764220 [0,1,0,0,0,2|1,0,0]=4 14638 B13R1.149 C=C(C)COCc1ccnc(c1)Cl 34a_100000748751_100000748629 [0,1,0,0,0,2|1,0,0]=4 14639 B13R1.149 C=C(C)COCc1ccnc(c1)F 34a_100000082451_100000748629 [0,1,0,0,0,2|1,0,0]=4 14640 B13R1.149 C=C(C)COCc1cncc(c1)Br 34a_100000210245_100000738771 [0,1,0,0,0,2|1,0,0]=4 14641 B13R1.149 C=C(C)COCc1cncc(c1)Br 34a_100011259137_100000748629 [0,1,0,0,0,2|1,0,0]=4 14642 B13R1.149 C=C(C)COCc1cncc(c1)Br 7a_100011259137_100000748629 [0,1,0,0,0,2|1,0,0]=4 14643 B13R1.149 C=C(C)COCc1cncc(c1)C 34a_100000210245_100000716715 [0,1,0,0,0,2|1,0,0]=4 14644 B13R1.149 C=C(C)COCc1cncc(c1)C 34a_100011998709_100000748629 [0,1,0,0,0,2|1,0,0]=4 14645 B13R1.149 C=C(C)COCc1cncc(c1)C 7a_100011998709_100000748629 [0,1,0,0,0,2|1,0,0]=4 14646 B13R1.149 C=C(C)COCc1cncc(c1)Cl 34a_100000092867_100000748629 [0,1,0,0,0,2|1,0,0]=4 14647 B13R1.149 C=C(C)COCc1cncc(c1)Cl 34a_100000210245_100016992070 [0,1,0,0,0,2|1,0,0]=4 14648 B13R1.149 C=C(C)COCc1cncc(c1)Cl 7a_100000092867_100000748629 [0,1,0,0,0,2|1,0,0]=4 14649 B13R1.149 C=C(C)COCc1cncc(c1)F 34a_100000210245_100000725299 [0,1,0,0,0,2|1,0,0]=4 14650 B13R1.149 C=C(C)COCc1cncc(c1)F 34a_100011962875_100000748629 [0,1,0,0,0,2|1,0,0]=4 14651 B13R1.149 C=C(C)COCc1cncc(c1)F 7a_100011962875_100000748629 [0,1,0,0,0,2|1,0,0]=4 14652 B13R1.149 C=C(C)COCc1cncc(c1)N 34a_100000085308_100000748629 [0,1,0,0,0,2|1,0,0]=4 14653 B13R1.149 C=C(C)CSCc1cc(ccn1)Br 62a_100000748629_100010173614 [0,1,0,0,0,2|1,0,0]=4 14654 B13R1.149 C=C(C)CSCc1cc(ccn1)Br 62a_100010173614_100000211660 [0,1,0,0,0,2|1,0,0]=4 14655 B13R1.149 C=C(C)CSCc1cc(ccn1)C 62a_100000718516_100000211660 [0,1,0,0,0,2|1,0,0]=4 14656 B13R1.149 C=C(C)CSCc1cc(ccn1)C 62a_100000748629_100000718516 [0,1,0,0,0,2|1,0,0]=4 14657 B13R1.149 C=C(C)CSCc1cc(ccn1)Cl 62a_100000748629_100016988179 [0,1,0,0,0,2|1,0,0]=4 14658 B13R1.149 C=C(C)CSCc1cc(ccn1)Cl 62a_100016988179_100000211660 [0,1,0,0,0,2|1,0,0]=4 14659 B13R1.149 C=C(C)CSCc1cccc(c1)Br 62a_100000211773_100000211660 [0,1,0,0,0,2|0,0,0]=3 14660 B13R1.149 C=C(C)CSCc1cccc(c1)Br 62a_100000748629_100000211773 [0,1,0,0,0,2|0,0,0]=3 14661 B13R1.149 C=C(C)CSCc1cccc(c1)C 62a_100000211840_100000211660 [0,1,0,0,0,2|0,0,0]=3 14662 B13R1.149 C=C(C)CSCc1cccc(c1)C 62a_100000748629_100000211840 [0,1,0,0,0,2|0,0,0]=3 14663 B13R1.149 C=C(C)CSCc1cccc(c1)Cl 62a_100000187163_100000211660 [0,1,0,0,0,2|0,0,0]=3 14664 B13R1.149 C=C(C)CSCc1cccc(c1)Cl 62a_100000748629_100000187163 [0,1,0,0,0,2|0,0,0]=3 14665 B13R1.149 C=C(C)CSCc1cccc(c1)F 62a_100000230114_100000211660 [0,1,0,0,0,2|0,0,0]=3 14666 B13R1.149 C=C(C)CSCc1cccc(c1)F 62a_100000748629_100000230114 [0,1,0,0,0,2|0,0,0]=3 14667 B13R1.149 C=C(C)CSCc1cccc(c1)I 62a_100000748629_100011218688 [0,1,0,0,0,2|0,0,0]=3 14668 B13R1.149 C=C(C)CSCc1cccc(c1)I 62a_100011218688_100000211660 [0,1,0,0,0,2|0,0,0]=3 14669 B13R1.149 C=C(C)CSCc1cccc(c1)O 62a_100000748629_100011660834 [0,1,0,0,0,2|0,0,0]=3 14670 B13R1.149 C=C(C)CSCc1cccc(c1)O 62a_100011660834_100000211660 [0,1,0,0,0,2|0,0,0]=3 14671 B13R1.149 C=C(C)CSCc1cccc(n1)Br 62a_100000748629_100009889011 [0,1,0,0,0,2|1,0,0]=4 14672 B13R1.149 C=C(C)CSCc1cccc(n1)Br 62a_100009889011_100000211660 [0,1,0,0,0,2|1,0,0]=4 14673 B13R1.149 C=C(C)CSCc1cccc(n1)C 62a_100000748629_100000757606 [0,1,0,0,0,2|1,0,0]=4 14674 B13R1.149 C=C(C)CSCc1cccc(n1)C 62a_100000757606_100000211660 [0,1,0,0,0,2|1,0,0]=4 14675 B13R1.149 C=C(C)CSCc1cccc(n1)Cl 62a_100000086093_100000211660 [0,1,0,0,0,2|1,0,0]=4 14676 B13R1.149 C=C(C)CSCc1cccc(n1)Cl 62a_100000748629_100000086093 [0,1,0,0,0,2|1,0,0]=4 14677 B13R1.149 C=C(C)CSCc1cccc(n1)F 62a_100000748629_100009819644 [0,1,0,0,0,2|1,0,0]=4 14678 B13R1.149 C=C(C)CSCc1cccc(n1)F 62a_100009819644_100000211660 [0,1,0,0,0,2|1,0,0]=4 14679 B13R1.149 C=C(C)CSCc1ccnc(c1)Br 62a_100000748629_100010243470 [0,1,0,0,0,2|1,0,0]=4 14680 B13R1.149 C=C(C)CSCc1ccnc(c1)Br 62a_100010254460_100000211660 [0,1,0,0,0,2|1,0,0]=4 14681 B13R1.149 C=C(C)CSCc1ccnc(c1)C 62a_100000748629_200020672517 [0,1,0,0,0,2|1,0,0]=4 14682 B13R1.149 C=C(C)CSCc1ccnc(c1)C 62a_200020672517_100000211660 [0,1,0,0,0,2|1,0,0]=4 14683 B13R1.149 C=C(C)CSCc1ccnc(c1)Cl 62a_100000748629_100000764220 [0,1,0,0,0,2|1,0,0]=4 14684 B13R1.149 C=C(C)CSCc1ccnc(c1)Cl 62a_100000764220_100000211660 [0,1,0,0,0,2|1,0,0]=4 14685 B13R1.149 C=C(C)CSCc1cncc(c1)Br 62a_100000738771_100000211660 [0,1,0,0,0,2|1,0,0]=4 14686 B13R1.149 C=C(C)CSCc1cncc(c1)Br 62a_100000748629_100000738771 [0,1,0,0,0,2|1,0,0]=4 14687 B13R1.149 C=C(C)CSCc1cncc(c1)C 62a_100000716715_100000211660 [0,1,0,0,0,2|1,0,0]=4 14688 B13R1.149 C=C(C)CSCc1cncc(c1)C 62a_100000748629_100000716715 [0,1,0,0,0,2|1,0,0]=4 14689 B13R1.149 C=C(C)CSCc1cncc(c1)Cl 62a_100000748629_100016992070 [0,1,0,0,0,2|1,0,0]=4 14690 B13R1.149 C=C(C)CSCc1cncc(c1)Cl 62a_100016992070_100000211660 [0,1,0,0,0,2|1,0,0]=4 14691 B13R1.149 C=C(C)CSCc1cncc(c1)F 62a_100000725299_100000211660 [0,1,0,0,0,2|1,0,0]=4 14692 B13R1.149 C=C(C)CSCc1cncc(c1)F 62a_100000748629_100000725299 [0,1,0,0,0,2|1,0,0]=4 14693 B13R1.149 C=C(F)CNCc1cccc(c1)Br 2230a_100000174977_100009893438 [0,1,0,0,0,2|1,0,0]=4 14694 B13R1.149 C=C(F)CNCc1cccc(c1)Br 34a_100000174977_100009893438 [0,1,0,0,0,2|1,0,0]=4 14695 B13R1.149 C=C(F)CNCc1cccc(c1)C 2230a_100000185548_100009893438 [0,1,0,0,0,2|1,0,0]=4 14696 B13R1.149 C=C(F)CNCc1cccc(c1)C 34a_100000185548_100009893438 [0,1,0,0,0,2|1,0,0]=4 14697 B13R1.149 C=C(F)CNCc1cccc(c1)Cl 2230a_100000174878_100009893438 [0,1,0,0,0,2|1,0,0]=4 14698 B13R1.149 C=C(F)CNCc1cccc(c1)Cl 34a_100000174878_100009893438 [0,1,0,0,0,2|1,0,0]=4 14699 B13R1.149 C=C(F)CNCc1cccc(c1)F 2230a_100000174948_100009893438 [0,1,0,0,0,2|1,0,0]=4 14700 B13R1.149 C=C(F)CNCc1cccc(c1)F 34a_100000174948_100009893438 [0,1,0,0,0,2|1,0,0]=4 14701 B13R1.149 C=C(F)CNCc1cccc(c1)I 2230a_100000106179_100009893438 [0,1,0,0,0,2|1,0,0]=4 14702 B13R1.149 C=C(F)CNCc1cccc(c1)I 34a_100000106179_100009893438 [0,1,0,0,0,2|1,0,0]=4 14703 B13R1.149 C=C(F)CNCc1cccc(c1)O 2230a_100000743036_100009893438 [0,1,0,0,0,2|1,0,0]=4 14704 B13R1.149 C=C(F)CNCc1cccc(c1)O 34a_100000743036_100009893438 [0,1,0,0,0,2|1,0,0]=4 14705 B13R1.149 C=C(F)COCc1cccc(c1)Br 34a_100000687537_100009893438 [0,1,0,0,0,2|1,0,0]=4 14706 B13R1.149 C=C(F)COCc1cccc(c1)Br 34a_200010262243_100000698116 [0,1,0,0,0,2|1,0,0]=4 14707 B13R1.149 C=C(F)COCc1cccc(c1)Br 7a_100000687537_100000042424 [0,1,0,0,0,2|1,0,0]=4 14708 B13R1.149 C=C(F)COCc1cccc(c1)C 34a_100011217746_100009893438 [0,1,0,0,0,2|1,0,0]=4 14709 B13R1.149 C=C(F)COCc1cccc(c1)C 34a_200010262243_100000211840 [0,1,0,0,0,2|1,0,0]=4 14710 B13R1.149 C=C(F)COCc1cccc(c1)C 7a_100011217746_100000042424 [0,1,0,0,0,2|1,0,0]=4 14711 B13R1.149 C=C(F)COCc1cccc(c1)Cl 34a_100000241301_100009893438 [0,1,0,0,0,2|1,0,0]=4 14712 B13R1.149 C=C(F)COCc1cccc(c1)Cl 34a_200010262243_100000187163 [0,1,0,0,0,2|1,0,0]=4 14713 B13R1.149 C=C(F)COCc1cccc(c1)Cl 7a_100000241301_100000042424 [0,1,0,0,0,2|1,0,0]=4 14714 B13R1.149 C=C(F)COCc1cccc(c1)F 34a_100000210976_100009893438 [0,1,0,0,0,2|1,0,0]=4 14715 B13R1.149 C=C(F)COCc1cccc(c1)F 34a_200010262243_100000187166 [0,1,0,0,0,2|1,0,0]=4 14716 B13R1.149 C=C(F)COCc1cccc(c1)F 7a_100000210976_100000042424 [0,1,0,0,0,2|1,0,0]=4 14717 B13R1.149 C=C(F)COCc1cccc(c1)I 34a_100011215336_100009893438 [0,1,0,0,0,2|1,0,0]=4 14718 B13R1.149 C=C(F)COCc1cccc(c1)I 34a_200010262243_100011218688 [0,1,0,0,0,2|1,0,0]=4 14719 B13R1.149 C=C(F)COCc1cccc(c1)I 7a_100011215336_100000042424 [0,1,0,0,0,2|1,0,0]=4 14720 B13R1.149 C=C(F)COCc1cccc(c1)N 34a_100000211919_100009893438 [0,1,0,0,0,2|1,0,0]=4 14721 B13R1.149 C=C(F)COCc1cccc(c1)O 34a_200010262243_100011660834 [0,1,0,0,0,2|1,0,0]=4 14722 B13R1.149 C=C(F)CSCc1cccc(c1)Br 62a_100000042424_100000211773 [0,1,0,0,0,2|1,0,0]=4 14723 B13R1.149 C=C(F)CSCc1cccc(c1)Br 62a_100000211773_100000042424 [0,1,0,0,0,2|1,0,0]=4 14724 B13R1.149 C=C(F)CSCc1cccc(c1)C 62a_100000042424_100000211840 [0,1,0,0,0,2|1,0,0]=4 14725 B13R1.149 C=C(F)CSCc1cccc(c1)C 62a_100000211840_100000042424 [0,1,0,0,0,2|1,0,0]=4 14726 B13R1.149 C=C(F)CSCc1cccc(c1)Cl 62a_100000042424_100000187163 [0,1,0,0,0,2|1,0,0]=4 14727 B13R1.149 C=C(F)CSCc1cccc(c1)Cl 62a_100000187163_100000042424 [0,1,0,0,0,2|1,0,0]=4 14728 B13R1.149 C=C(F)CSCc1cccc(c1)F 62a_100000042424_100000230114 [0,1,0,0,0,2|1,0,0]=4 14729 B13R1.149 C=C(F)CSCc1cccc(c1)F 62a_100000230114_100000042424 [0,1,0,0,0,2|1,0,0]=4 14730 B13R1.149 C=C(F)CSCc1cccc(c1)I 62a_100000042424_100011218688 [0,1,0,0,0,2|1,0,0]=4 14731 B13R1.149 C=C(F)CSCc1cccc(c1)I 62a_100011218688_100000042424 [0,1,0,0,0,2|1,0,0]=4 14732 B13R1.149 C=C(F)CSCc1cccc(c1)O 62a_100000042424_100011660834 [0,1,0,0,0,2|1,0,0]=4 14733 B13R1.149 C=C(F)CSCc1cccc(c1)O 62a_100011660834_100000042424 [0,1,0,0,0,2|1,0,0]=4 14734 B13R1.149 CC(=CCNc1cccc(c1)Br)C 34a_100000210019_100000761012 [0,1,0,0,0,2|0,0,1]=4 14735 B13R1.149 CC(=CCNc1cccc(c1)C)C 2230a_100000188690_100000761012 [0,1,0,0,0,2|0,0,1]=4 14736 B13R1.149 CC(=CCNc1cccc(c1)C)C 34a_100000188690_100000761012 [0,1,0,0,0,2|0,0,1]=4 14737 B13R1.149 CC(=CCNc1cccc(c1)Cl)C 34a_100000185859_100000761012 [0,1,0,0,0,2|0,0,1]=4 14738 B13R1.149 CC(=CCNc1cccc(c1)F)C 34a_100000210047_100000761012 [0,1,0,0,0,2|0,0,1]=4 14739 B13R1.149 CC(=CCNc1cccc(c1)I)C 34a_100000211102_100000761012 [0,1,0,0,0,2|0,0,1]=4 14740 B13R1.149 CC(=CCNc1cccc(c1)O)C 34a_100000210217_100000761012 [0,1,0,0,0,2|0,0,1]=4 14741 B13R1.149 CC(=CCOc1cccc(c1)Br)C 34a_100000210342_100000761012 [0,1,0,0,0,2|0,0,1]=4 14742 B13R1.149 CC(=CCOc1cccc(c1)Br)C 7a_100000210342_100000761012 [0,1,0,0,0,2|0,0,1]=4 14743 B13R1.149 CC(=CCOc1cccc(c1)C)C 34a_100000210337_100000761012 [0,1,0,0,0,2|0,0,1]=4 14744 B13R1.149 CC(=CCOc1cccc(c1)C)C 7a_100000210337_100000761012 [0,1,0,0,0,2|0,0,1]=4 14745 B13R1.149 CC(=CCOc1cccc(c1)Cl)C 34a_100000210295_100000761012 [0,1,0,0,0,2|0,0,1]=4 14746 B13R1.149 CC(=CCOc1cccc(c1)Cl)C 7a_100000210295_100000761012 [0,1,0,0,0,2|0,0,1]=4 14747 B13R1.149 CC(=CCOc1cccc(c1)F)C 34a_100000210426_100000761012 [0,1,0,0,0,2|0,0,1]=4 14748 B13R1.149 CC(=CCOc1cccc(c1)F)C 7a_100000210426_100000761012 [0,1,0,0,0,2|0,0,1]=4 14749 B13R1.149 CC(=CCOc1cccc(c1)I)C 34a_100000211634_100000761012 [0,1,0,0,0,2|0,0,1]=4 14750 B13R1.149 CC(=CCOc1cccc(c1)I)C 7a_100000211634_100000761012 [0,1,0,0,0,2|0,0,1]=4 14751 B13R1.149 CC(=CCOc1cccc(c1)N)C 34a_100000210217_100000761012 [0,1,0,0,0,2|0,0,1]=4 14752 B13R1.149 CC(=CCSc1cccc(c1)Br)C 62a_100000691529_100000761012 [0,1,0,0,0,2|0,0,1]=4 14753 B13R1.149 CC(=CCSc1cccc(c1)Br)C 62a_100000761012_100000691529 [0,1,0,0,0,2|0,0,1]=4 14754 B13R1.149 CC(=CCSc1cccc(c1)C)C 62a_100000761012_100011215228 [0,1,0,0,0,2|0,0,1]=4 14755 B13R1.149 CC(=CCSc1cccc(c1)C)C 62a_100011215228_100000761012 [0,1,0,0,0,2|0,0,1]=4 14756 B13R1.149 CC(=CCSc1cccc(c1)Cl)C 62a_100000699651_100000761012 [0,1,0,0,0,2|0,0,1]=4 14757 B13R1.149 CC(=CCSc1cccc(c1)Cl)C 62a_100000761012_100000699651 [0,1,0,0,0,2|0,0,1]=4 14758 B13R1.149 CC(=CCSc1cccc(c1)F)C 62a_100000685547_100000761012 [0,1,0,0,0,2|0,0,1]=4 14759 B13R1.149 CC(=CCSc1cccc(c1)F)C 62a_100000761012_100000685547 [0,1,0,0,0,2|0,0,1]=4 14760 B13R1.149 CC(=CCSc1cccc(c1)N)C 62a_100000210019_100000761012 [0,1,0,0,0,2|0,0,1]=4 14761 B13R1.149 CC(=CCSc1cccc(c1)N)C 62a_100000761012_100000210019 [0,1,0,0,0,2|0,0,1]=4 14762 B13R1.149 CC(=CCSc1cccc(c1)O)C 62a_100000761012_100000211634 [0,1,0,0,0,2|0,0,1]=4 14763 B13R1.149 CC(=CCSc1cccc(c1)[S])C 62a_100000761012_114929384022 [0,1,0,0,0,2|0,0,1]=4 14764 B13R1.149 CC(=CCSc1cccc(c1)[S])C 62a_114929384022_100000761012 [0,1,0,0,0,2|0,0,1]=4 14765 B13R1.149 CC(=O)CC#Cc1cccc(c1)Br 1458a_100000070787_100010706776 [0,1,0,0,0,2|1,0,0]=4 14766 B13R1.149 CC(=O)CC#Cc1cccc(c1)F 1458a_100000070787_100010402994 [0,1,0,0,0,2|1,0,0]=4 14767 B13R1.149 CC(=O)CCCc1cccc(c1)Br 1458a_100000070787_100011713683 [0,1,0,0,0,2|1,0,0]=4 14768 B13R1.149 CC(=O)CCCc1cccc(c1)Br 1458a_100000685939_200000210301 [0,1,0,0,0,2|1,0,0]=4 14769 B13R1.149 CC(=O)CCCc1cccc(c1)F 1458a_100000070787_200000698031 [0,1,0,0,0,2|1,0,0]=4 14770 B13R1.149 CC(=O)CCOc1cccc(c1)Br 1458a_100000070787_100000183150 [0,1,0,0,0,2|1,0,0]=4 14771 B13R1.149 CC(=O)CCOc1cccc(c1)Br 1458a_100000183437_200000210301 [0,1,0,0,0,2|1,0,0]=4 14772 B13R1.149 CC(=O)CCOc1cccc(c1)Br 7a_100000210342_100000053229 [0,1,0,0,0,2|1,0,0]=4 14773 B13R1.149 CC(=O)CCOc1cccc(c1)C 1458a_100000182325_200000210301 [0,1,0,0,0,2|1,0,0]=4 14774 B13R1.149 CC(=O)CCOc1cccc(c1)C 7a_100000210337_100000053229 [0,1,0,0,0,2|1,0,0]=4 14775 B13R1.149 CC(=O)CCOc1cccc(c1)Cl 1458a_100000070787_100000181161 [0,1,0,0,0,2|1,0,0]=4 14776 B13R1.149 CC(=O)CCOc1cccc(c1)Cl 1458a_100000738917_200000210301 [0,1,0,0,0,2|1,0,0]=4 14777 B13R1.149 CC(=O)CCOc1cccc(c1)Cl 7a_100000210295_100000053229 [0,1,0,0,0,2|1,0,0]=4 14778 B13R1.149 CC(=O)CCOc1cccc(c1)F 1458a_100000070787_100000739188 [0,1,0,0,0,2|1,0,0]=4 14779 B13R1.149 CC(=O)CCOc1cccc(c1)F 1458a_100000737089_200000210301 [0,1,0,0,0,2|1,0,0]=4 14780 B13R1.149 CC(=O)CCOc1cccc(c1)F 7a_100000210426_100000053229 [0,1,0,0,0,2|1,0,0]=4 14781 B13R1.149 CC(=O)CCOc1cccc(c1)I 7a_100000211634_100000053229 [0,1,0,0,0,2|1,0,0]=4 14782 B13R1.149 CC(=O)CCSc1cccc(c1)Br 62a_100000053229_100000691529 [0,1,0,0,0,2|1,0,0]=4 14783 B13R1.149 CC(=O)CCSc1cccc(c1)Br 62a_100000691529_100000053229 [0,1,0,0,0,2|1,0,0]=4 14784 B13R1.149 CC(=O)CCSc1cccc(c1)C 62a_100000053229_100011215228 [0,1,0,0,0,2|1,0,0]=4 14785 B13R1.149 CC(=O)CCSc1cccc(c1)C 62a_100011215228_100000053229 [0,1,0,0,0,2|1,0,0]=4 14786 B13R1.149 CC(=O)CCSc1cccc(c1)Cl 62a_100000053229_100000699651 [0,1,0,0,0,2|1,0,0]=4 14787 B13R1.149 CC(=O)CCSc1cccc(c1)Cl 62a_100000699651_100000053229 [0,1,0,0,0,2|1,0,0]=4 14788 B13R1.149 CC(=O)CCSc1cccc(c1)F 62a_100000053229_100000685547 [0,1,0,0,0,2|1,0,0]=4 14789 B13R1.149 CC(=O)CCSc1cccc(c1)F 62a_100000685547_100000053229 [0,1,0,0,0,2|1,0,0]=4 14790 B13R1.149 CC(=O)CCSc1cccc(c1)N 62a_100000053229_100000210019 [0,1,0,0,0,2|1,0,0]=4 14791 B13R1.149 CC(=O)CCSc1cccc(c1)N 62a_100000210019_100000053229 [0,1,0,0,0,2|1,0,0]=4 14792 B13R1.149 CC(=O)CCSc1cccc(c1)O 62a_100000053229_100000211634 [0,1,0,0,0,2|1,0,0]=4 14793 B13R1.149 CC(=O)CCSc1cccc(c1)[S] 62a_100000053229_114929384022 [0,1,0,0,0,2|1,0,0]=4 14794 B13R1.149 CC(=O)CCSc1cccc(c1)[S] 62a_114929384022_100000053229 [0,1,0,0,0,2|1,0,0]=4 14795 B13R1.149 CC(=O)COCc1cccc(c1)Br 34a_100000211253_100000698116 [0,1,0,0,0,2|1,0,0]=4 14796 B13R1.149 CC(=O)COCc1cccc(c1)C 34a_100000211253_100000211840 [0,1,0,0,0,2|1,0,0]=4 14797 B13R1.149 CC(=O)COCc1cccc(c1)Cl 34a_100000211253_100000187163 [0,1,0,0,0,2|1,0,0]=4 14798 B13R1.149 CC(=O)COCc1cccc(c1)F 34a_100000211253_100000187166 [0,1,0,0,0,2|1,0,0]=4 14799 B13R1.149 CC(=O)COCc1cccc(c1)I 34a_100000211253_100011218688 [0,1,0,0,0,2|1,0,0]=4 14800 B13R1.149 CC(=O)COCc1cccc(c1)O 34a_100000211253_100011660834 [0,1,0,0,0,2|1,0,0]=4 14801 B13R1.149 CC(=O)CSCc1cccc(c1)Cl 1458a_100000150269_200000210301 [0,1,0,0,0,2|1,0,0]=4 14802 B13R1.149 CC(=O)NCCc1cccc(c1)Br 11a_100011207229_100015343762 [0,1,0,0,0,2|1,0,0]=4 14803 B13R1.149 CC(=O)NCCc1cccc(c1)Br 1626a_100011207229_100015343762 [0,1,0,0,0,2|1,0,0]=4 14804 B13R1.149 CC(=O)NCCc1cccc(c1)Br 240690a_100011207229_100015343762 [0,1,0,0,0,2|1,0,0]=4 14805 B13R1.149 CC(=O)NCCc1cccc(c1)Br 527a_100011207229_100103153847 [0,1,0,0,0,2|1,0,0]=4 14806 B13R1.149 CC(=O)NCCc1cccc(c1)C 11a_100000749837_100015343762 [0,1,0,0,0,2|1,0,0]=4 14807 B13R1.149 CC(=O)NCCc1cccc(c1)C 1626a_100000749837_100015343762 [0,1,0,0,0,2|1,0,0]=4 14808 B13R1.149 CC(=O)NCCc1cccc(c1)C 240690a_100000749837_100015343762 [0,1,0,0,0,2|1,0,0]=4 14809 B13R1.149 CC(=O)NCCc1cccc(c1)C 527a_100000749837_100103153847 [0,1,0,0,0,2|1,0,0]=4 14810 B13R1.149 CC(=O)NCCc1cccc(c1)Cl 11a_100000185263_100015343762 [0,1,0,0,0,2|1,0,0]=4 14811 B13R1.149 CC(=O)NCCc1cccc(c1)Cl 1626a_100000185263_100015343762 [0,1,0,0,0,2|1,0,0]=4 14812 B13R1.149 CC(=O)NCCc1cccc(c1)Cl 240690a_100000185263_100015343762 [0,1,0,0,0,2|1,0,0]=4 14813 B13R1.149 CC(=O)NCCc1cccc(c1)Cl 527a_100000185263_100103153847 [0,1,0,0,0,2|1,0,0]=4 14814 B13R1.149 CC(=O)NCCc1cccc(c1)F 11a_100000205154_100015343762 [0,1,0,0,0,2|1,0,0]=4 14815 B13R1.149 CC(=O)NCCc1cccc(c1)F 1626a_100000205154_100015343762 [0,1,0,0,0,2|1,0,0]=4 14816 B13R1.149 CC(=O)NCCc1cccc(c1)F 240690a_100000205154_100015343762 [0,1,0,0,0,2|1,0,0]=4 14817 B13R1.149 CC(=O)NCCc1cccc(c1)F 527a_100000205154_100103153847 [0,1,0,0,0,2|1,0,0]=4 14818 B13R1.149 CC(=O)NCCc1cccc(c1)O 240690a_100000747277_100015343762 [0,1,0,0,0,2|1,0,0]=4 14819 B13R1.149 CC(=O)NCCc1cccc(c1)O 527a_100000747277_100103153847 [0,1,0,0,0,2|1,0,0]=4 14820 B13R1.149 CC(=O)NNCc1cccc(c1)Br 22a_100000686200_100000070787 [0,1,0,0,0,2|1,0,0]=4 14821 B13R1.149 CC(=O)NNCc1cccc(c1)C 22a_100000689898_100000070787 [0,1,0,0,0,2|1,0,0]=4 14822 B13R1.149 CC(=O)NNCc1cccc(c1)Cl 22a_100000685877_100000070787 [0,1,0,0,0,2|1,0,0]=4 14823 B13R1.149 CC(=O)NNCc1cccc(c1)F 22a_100016993953_100000070787 [0,1,0,0,0,2|1,0,0]=4 14824 B13R1.149 CC(=O)NNCc1cccc(c1)O 22a_100000008902_100000070787 [0,1,0,0,0,2|1,0,0]=4 14825 B13R1.149 CC(=O)OCNc1cccc(c1)Br 34a_100000210019_100009813279 [0,1,0,0,0,2|1,0,0]=4 14826 B13R1.149 CC(=O)OCNc1cccc(c1)C 34a_100000188690_100009813279 [0,1,0,0,0,2|1,0,0]=4 14827 B13R1.149 CC(=O)OCNc1cccc(c1)Cl 34a_100000185859_100009813279 [0,1,0,0,0,2|1,0,0]=4 14828 B13R1.149 CC(=O)OCNc1cccc(c1)F 34a_100000210047_100009813279 [0,1,0,0,0,2|1,0,0]=4 14829 B13R1.149 CC(=O)OCNc1cccc(c1)I 34a_100000211102_100009813279 [0,1,0,0,0,2|1,0,0]=4 14830 B13R1.149 CC(=O)OCNc1cccc(c1)O 34a_100000210217_100009813279 [0,1,0,0,0,2|1,0,0]=4 14831 B13R1.149 CC(=O)OCOc1cccc(c1)Br 34a_100000210342_100009813279 [0,1,0,0,0,2|1,0,0]=4 14832 B13R1.149 CC(=O)OCOc1cccc(c1)C 34a_100000210337_100009813279 [0,1,0,0,0,2|1,0,0]=4 14833 B13R1.149 CC(=O)OCOc1cccc(c1)Cl 34a_100000210295_100009813279 [0,1,0,0,0,2|1,0,0]=4 14834 B13R1.149 CC(=O)OCOc1cccc(c1)F 34a_100000210426_100009813279 [0,1,0,0,0,2|1,0,0]=4 14835 B13R1.149 CC(=O)OCOc1cccc(c1)I 34a_100000211634_100009813279 [0,1,0,0,0,2|1,0,0]=4 14836 B13R1.149 CC(=O)OCOc1cccc(c1)N 34a_100000210217_100009813279 [0,1,0,0,0,2|1,0,0]=4 14837 B13R1.149 CC(=O)OCSc1cccc(c1)Br 62a_100000076356_100000691529 [0,1,0,0,0,2|1,0,0]=4 14838 B13R1.149 CC(=O)OCSc1cccc(c1)Br 62a_100000691529_100000076356 [0,1,0,0,0,2|1,0,0]=4 14839 B13R1.149 CC(=O)OCSc1cccc(c1)C 62a_100000076356_100011215228 [0,1,0,0,0,2|1,0,0]=4 14840 B13R1.149 CC(=O)OCSc1cccc(c1)C 62a_100011215228_100000076356 [0,1,0,0,0,2|1,0,0]=4 14841 B13R1.149 CC(=O)OCSc1cccc(c1)Cl 62a_100000076356_100000699651 [0,1,0,0,0,2|1,0,0]=4 14842 B13R1.149 CC(=O)OCSc1cccc(c1)Cl 62a_100000699651_100000076356 [0,1,0,0,0,2|1,0,0]=4 14843 B13R1.149 CC(=O)OCSc1cccc(c1)F 62a_100000076356_100000685547 [0,1,0,0,0,2|1,0,0]=4 14844 B13R1.149 CC(=O)OCSc1cccc(c1)F 62a_100000685547_100000076356 [0,1,0,0,0,2|1,0,0]=4 14845 B13R1.149 CC(=O)OCSc1cccc(c1)N 62a_100000076356_100000210019 [0,1,0,0,0,2|1,0,0]=4 14846 B13R1.149 CC(=O)OCSc1cccc(c1)N 62a_100000210019_100000076356 [0,1,0,0,0,2|1,0,0]=4 14847 B13R1.149 CC(=O)OCSc1cccc(c1)O 62a_100000076356_100000211634 [0,1,0,0,0,2|1,0,0]=4 14848 B13R1.149 CC(=O)OCSc1cccc(c1)[S] 62a_100000076356_114929384022 [0,1,0,0,0,2|1,0,0]=4 14849 B13R1.149 CC(=O)OCSc1cccc(c1)[S] 62a_114929384022_100000076356 [0,1,0,0,0,2|1,0,0]=4 14850 B13R1.149 Cc1cccc(c1)OCCC(=O)[13CH3] 1458a_100000182325_200025704644 [0,1,0,0,0,2|1,0,0]=4 14851 B13R1.149 [13CH3]C(=O)CCCc1cccc(c1)Br 1458a_100000685939_200025704644 [0,1,0,0,0,2|1,0,0]=4 14852 B13R1.149 [13CH3]C(=O)CCOc1cccc(c1)Br 1458a_100000183437_200025704644 [0,1,0,0,0,2|1,0,0]=4 14853 B13R1.149 [13CH3]C(=O)CCOc1cccc(c1)Cl 1458a_100000738917_200025704644 [0,1,0,0,0,2|1,0,0]=4 14854 B13R1.149 [13CH3]C(=O)CCOc1cccc(c1)F 1458a_100000737089_200025704644 [0,1,0,0,0,2|1,0,0]=4 14855 B13R1.149 [13CH3]C(=O)CSCc1cccc(c1)Cl 1458a_100000150269_200025704644 [0,1,0,0,0,2|1,0,0]=4 14856 B13R1.158 C=C(C)C=NNc1ccccc1Br 4a_100000241748_100000210575 [0,1,0,0,0,2|0,0,1]=4 14857 B13R1.158 C=C(C)C=NNc1ccccc1C 4a_100000184220_100000210575 [0,1,0,0,0,2|0,0,1]=4 14858 B13R1.158 C=C(C)C=NNc1ccccc1Cl 4a_100000683529_100000210575 [0,1,0,0,0,2|0,0,1]=4 14859 B13R1.158 C=C(C)C=NNc1ccccc1F 4a_100000239246_100000210575 [0,1,0,0,0,2|0,0,1]=4 14860 B13R1.158 C=C(C)C=NNc1ccccc1I 4a_100011218156_100000210575 [0,1,0,0,0,2|0,0,1]=4 14861 B13R1.158 C=C(C)CCNc1ccccc1Br 34a_100000210017_100000730704 [0,1,0,0,0,2|0,0,0]=3 14862 B13R1.158 C=C(C)CCNc1ccccc1C 34a_100015192222_100000730704 [0,1,0,0,0,2|0,0,0]=3 14863 B13R1.158 C=C(C)CCNc1ccccc1Cl 34a_100000185783_100000730704 [0,1,0,0,0,2|0,0,0]=3 14864 B13R1.158 C=C(C)CCNc1ccccc1F 34a_100000210422_100000730704 [0,1,0,0,0,2|0,0,0]=3 14865 B13R1.158 C=C(C)CCNc1ccccc1I 34a_100000210053_100000730704 [0,1,0,0,0,2|0,0,0]=3 14866 B13R1.158 C=C(C)CCNc1ccccc1O 34a_100000185747_100000730704 [0,1,0,0,0,2|0,0,0]=3 14867 B13R1.158 C=C(C)CCOc1cccc[n+]1[O-] 7a_100000211761_100000730704 [0,1,0,0,0,2|1,0,0]=4 14868 B13R1.158 C=C(C)CCOc1ccccc1Br 34a_100000181306_100000730704 [0,1,0,0,0,2|0,0,0]=3 14869 B13R1.158 C=C(C)CCOc1ccccc1Br 7a_100000181306_100000730704 [0,1,0,0,0,2|0,0,0]=3 14870 B13R1.158 C=C(C)CCOc1ccccc1C 34a_100000210338_100000730704 [0,1,0,0,0,2|0,0,0]=3 14871 B13R1.158 C=C(C)CCOc1ccccc1C 7a_100000210338_100000730704 [0,1,0,0,0,2|0,0,0]=3 14872 B13R1.158 C=C(C)CCOc1ccccc1Cl 34a_100000210172_100000730704 [0,1,0,0,0,2|0,0,0]=3 14873 B13R1.158 C=C(C)CCOc1ccccc1Cl 7a_100000210172_100000730704 [0,1,0,0,0,2|0,0,0]=3 14874 B13R1.158 C=C(C)CCOc1ccccc1F 34a_100000210171_100000730704 [0,1,0,0,0,2|0,0,0]=3 14875 B13R1.158 C=C(C)CCOc1ccccc1F 7a_100000210171_100000730704 [0,1,0,0,0,2|0,0,0]=3 14876 B13R1.158 C=C(C)CCOc1ccccc1I 34a_100000739446_100000730704 [0,1,0,0,0,2|0,0,0]=3 14877 B13R1.158 C=C(C)CCOc1ccccc1I 7a_100000739446_100000730704 [0,1,0,0,0,2|0,0,0]=3 14878 B13R1.158 C=C(C)CCOc1ccccc1N 34a_100000185747_100000730704 [0,1,0,0,0,2|0,0,0]=3 14879 B13R1.158 C=C(C)CCOc1ccccc1N 7a_100000185747_100000730704 [0,1,0,0,0,2|0,0,0]=3 14880 B13R1.158 C=C(C)CCOc1cccnc1Br 34a_100000744436_100000730704 [0,1,0,0,0,2|1,0,0]=4 14881 B13R1.158 C=C(C)CCOc1cccnc1Br 7a_100000744436_100000730704 [0,1,0,0,0,2|1,0,0]=4 14882 B13R1.158 C=C(C)CCOc1cccnc1C 34a_100000745507_100000730704 [0,1,0,0,0,2|1,0,0]=4 14883 B13R1.158 C=C(C)CCOc1cccnc1C 7a_100000745507_100000730704 [0,1,0,0,0,2|1,0,0]=4 14884 B13R1.158 C=C(C)CCOc1cccnc1Cl 34a_100000757616_100000730704 [0,1,0,0,0,2|1,0,0]=4 14885 B13R1.158 C=C(C)CCOc1cccnc1Cl 7a_100000757616_100000730704 [0,1,0,0,0,2|1,0,0]=4 14886 B13R1.158 C=C(C)CCOc1cccnc1F 34a_100000061740_100000730704 [0,1,0,0,0,2|1,0,0]=4 14887 B13R1.158 C=C(C)CCOc1cccnc1F 7a_100000061740_100000730704 [0,1,0,0,0,2|1,0,0]=4 14888 B13R1.158 C=C(C)CCOc1cccnc1I 34a_100000034122_100000730704 [0,1,0,0,0,2|1,0,0]=4 14889 B13R1.158 C=C(C)CCOc1cccnc1I 7a_100000034122_100000730704 [0,1,0,0,0,2|1,0,0]=4 14890 B13R1.158 C=C(C)CCOc1cccnc1N 34a_100000211975_100000730704 [0,1,0,0,0,2|1,0,0]=4 14891 B13R1.158 C=C(C)CCOc1cccnc1N 7a_100000211975_100000730704 [0,1,0,0,0,2|1,0,0]=4 14892 B13R1.158 C=C(C)CCOc1cccoc1=O 34a_100000077404_100000730704 [0,1,0,0,0,2|1,0,0]=4 14893 B13R1.158 C=C(C)CCOc1cccoc1=O 7a_100000077404_100000730704 [0,1,0,0,0,2|1,0,0]=4 14894 B13R1.158 C=C(C)CCOc1ccncc1Br 34a_100011996408_100000730704 [0,1,0,0,0,2|1,0,0]=4 14895 B13R1.158 C=C(C)CCOc1ccncc1C 34a_100000694293_100000730704 [0,1,0,0,0,2|1,0,0]=4 14896 B13R1.158 C=C(C)CCOc1ccncc1Cl 34a_100011997054_100000730704 [0,1,0,0,0,2|1,0,0]=4 14897 B13R1.158 C=C(C)CCOc1ccncc1F 34a_200000081243_100000730704 [0,1,0,0,0,2|1,0,0]=4 14898 B13R1.158 C=C(C)CCOc1cnccc1C 34a_100011997053_100000730704 [0,1,0,0,0,2|1,0,0]=4 14899 B13R1.158 C=C(C)CCOc1cnccc1C 7a_100011997053_100000730704 [0,1,0,0,0,2|1,0,0]=4 14900 B13R1.158 C=C(C)CCOc1cnccc1Cl 34a_100011996695_100000730704 [0,1,0,0,0,2|1,0,0]=4 14901 B13R1.158 C=C(C)CCOc1cnccc1I 34a_100000050107_100000730704 [0,1,0,0,0,2|1,0,0]=4 14902 B13R1.158 C=C(C)CCOc1cnccc1N 34a_100000753702_100000730704 [0,1,0,0,0,2|1,0,0]=4 14903 B13R1.158 C=C(C)CCOc1coccc1=O 34a_100000060831_100000730704 [0,1,0,0,0,2|1,0,0]=4 14904 B13R1.158 C=C(C)CCOc1ncccc1Cl 34a_100011290957_100000730704 [0,1,0,0,0,2|1,0,0]=4 14905 B13R1.158 C=C(C)CCOc1ncccc1F 34a_100011219419_100000730704 [0,1,0,0,0,2|1,0,0]=4 14906 B13R1.158 C=C(C)CCOc1ncccc1N 34a_100000746358_100000730704 [0,1,0,0,0,2|1,0,0]=4 14907 B13R1.158 C=C(C)CCSc1c[nH]ccc1=O 62a_100000730704_100009998708 [0,1,0,0,0,2|1,0,0]=4 14908 B13R1.158 C=C(C)CCSc1c[nH]ccc1=O 62a_100009998708_100000730704 [0,1,0,0,0,2|1,0,0]=4 14909 B13R1.158 C=C(C)CCSc1c[nH]ccc1=S 62a_100000730704_200012280681 [0,1,0,0,0,2|1,0,0]=4 14910 B13R1.158 C=C(C)CCSc1c[nH]ccc1=S 62a_200012280681_100000730704 [0,1,0,0,0,2|1,0,0]=4 14911 B13R1.158 C=C(C)CCSc1cccc[n+]1C 62a_100000730704_100000212160 [0,1,0,0,0,2|1,0,0]=4 14912 B13R1.158 C=C(C)CCSc1cccc[n+]1[O-] 62a_100000730704_200000042595 [0,1,0,0,0,2|1,0,0]=4 14913 B13R1.158 C=C(C)CCSc1ccccc1Br 62a_100000695589_100000730704 [0,1,0,0,0,2|0,0,0]=3 14914 B13R1.158 C=C(C)CCSc1ccccc1Br 62a_100000730704_100000695589 [0,1,0,0,0,2|0,0,0]=3 14915 B13R1.158 C=C(C)CCSc1ccccc1C 62a_100000210755_100000730704 [0,1,0,0,0,2|0,0,0]=3 14916 B13R1.158 C=C(C)CCSc1ccccc1C 62a_100000730704_100000210755 [0,1,0,0,0,2|0,0,0]=3 14917 B13R1.158 C=C(C)CCSc1ccccc1Cl 62a_100000730704_100000764095 [0,1,0,0,0,2|0,0,0]=3 14918 B13R1.158 C=C(C)CCSc1ccccc1Cl 62a_100000764095_100000730704 [0,1,0,0,0,2|0,0,0]=3 14919 B13R1.158 C=C(C)CCSc1ccccc1F 62a_100000730704_100011215700 [0,1,0,0,0,2|0,0,0]=3 14920 B13R1.158 C=C(C)CCSc1ccccc1F 62a_100011215700_100000730704 [0,1,0,0,0,2|0,0,0]=3 14921 B13R1.158 C=C(C)CCSc1ccccc1N 62a_100000210017_100000730704 [0,1,0,0,0,2|0,0,0]=3 14922 B13R1.158 C=C(C)CCSc1ccccc1N 62a_100000730704_100000210017 [0,1,0,0,0,2|0,0,0]=3 14923 B13R1.158 C=C(C)CCSc1ccccc1O 62a_100000730704_100000739446 [0,1,0,0,0,2|0,0,0]=3 14924 B13R1.158 C=C(C)CCSc1ccccc1O 62a_100000739446_100000730704 [0,1,0,0,0,2|0,0,0]=3 14925 B13R1.158 C=C(C)CCSc1cccnc1Br 62a_100000730704_100010202626 [0,1,0,0,0,2|1,0,0]=4 14926 B13R1.158 C=C(C)CCSc1cccnc1Br 62a_100010202626_100000730704 [0,1,0,0,0,2|1,0,0]=4 14927 B13R1.158 C=C(C)CCSc1cccnc1C 62a_100000730704_100000751574 [0,1,0,0,0,2|1,0,0]=4 14928 B13R1.158 C=C(C)CCSc1cccnc1C 62a_100000751574_100000730704 [0,1,0,0,0,2|1,0,0]=4 14929 B13R1.158 C=C(C)CCSc1cccnc1Cl 62a_100000036424_100000730704 [0,1,0,0,0,2|1,0,0]=4 14930 B13R1.158 C=C(C)CCSc1cccnc1Cl 62a_100000730704_100000036424 [0,1,0,0,0,2|1,0,0]=4 14931 B13R1.158 C=C(C)CCSc1cccnc1F 62a_100000730704_100009816115 [0,1,0,0,0,2|1,0,0]=4 14932 B13R1.158 C=C(C)CCSc1cccnc1F 62a_100009816115_100000730704 [0,1,0,0,0,2|1,0,0]=4 14933 B13R1.158 C=C(C)CCSc1cccnc1N 62a_100000045569_100000730704 [0,1,0,0,0,2|1,0,0]=4 14934 B13R1.158 C=C(C)CCSc1cccnc1N 62a_100000730704_100000045569 [0,1,0,0,0,2|1,0,0]=4 14935 B13R1.158 C=C(C)CCSc1cccnc1O 62a_100000730704_100000760158 [0,1,0,0,0,2|1,0,0]=4 14936 B13R1.158 C=C(C)CCSc1cccnc1O 62a_100000760158_100000730704 [0,1,0,0,0,2|1,0,0]=4 14937 B13R1.158 C=C(C)CCSc1ccncc1Br 62a_100000726257_100000730704 [0,1,0,0,0,2|1,0,0]=4 14938 B13R1.158 C=C(C)CCSc1ccncc1Br 62a_100000730704_100000726257 [0,1,0,0,0,2|1,0,0]=4 14939 B13R1.158 C=C(C)CCSc1ccncc1C 62a_100000730704_100000765111 [0,1,0,0,0,2|1,0,0]=4 14940 B13R1.158 C=C(C)CCSc1ccncc1C 62a_100000765111_100000730704 [0,1,0,0,0,2|1,0,0]=4 14941 B13R1.158 C=C(C)CCSc1ccncc1Cl 62a_100000708259_100000730704 [0,1,0,0,0,2|1,0,0]=4 14942 B13R1.158 C=C(C)CCSc1ccncc1Cl 62a_100000730704_100000708259 [0,1,0,0,0,2|1,0,0]=4 14943 B13R1.158 C=C(C)CCSc1ccncc1F 62a_100000047030_100000730704 [0,1,0,0,0,2|1,0,0]=4 14944 B13R1.158 C=C(C)CCSc1ccncc1F 62a_100000730704_100000047030 [0,1,0,0,0,2|1,0,0]=4 14945 B13R1.158 C=C(C)CCSc1ccncc1N 62a_100000730704_100000756074 [0,1,0,0,0,2|1,0,0]=4 14946 B13R1.158 C=C(C)CCSc1ccncc1N 62a_100000756074_100000730704 [0,1,0,0,0,2|1,0,0]=4 14947 B13R1.158 C=C(C)CCSc1ccncc1O 62a_100000730704_100009817591 [0,1,0,0,0,2|1,0,0]=4 14948 B13R1.158 C=C(C)CCSc1ccncc1O 62a_100009817591_100000730704 [0,1,0,0,0,2|1,0,0]=4 14949 B13R1.158 C=C(C)CCSc1cnccc1Br 62a_100000730704_100010138639 [0,1,0,0,0,2|1,0,0]=4 14950 B13R1.158 C=C(C)CCSc1cnccc1Br 62a_100010138639_100000730704 [0,1,0,0,0,2|1,0,0]=4 14951 B13R1.158 C=C(C)CCSc1cnccc1C 62a_100000730704_100000761580 [0,1,0,0,0,2|1,0,0]=4 14952 B13R1.158 C=C(C)CCSc1cnccc1C 62a_100000761580_100000730704 [0,1,0,0,0,2|1,0,0]=4 14953 B13R1.158 C=C(C)CCSc1cnccc1Cl 62a_100000730704_100009995489 [0,1,0,0,0,2|1,0,0]=4 14954 B13R1.158 C=C(C)CCSc1cnccc1Cl 62a_100009995489_100000730704 [0,1,0,0,0,2|1,0,0]=4 14955 B13R1.158 C=C(C)CCSc1cnccc1F 62a_100000730704_100009820683 [0,1,0,0,0,2|1,0,0]=4 14956 B13R1.158 C=C(C)CCSc1cnccc1F 62a_100009820683_100000730704 [0,1,0,0,0,2|1,0,0]=4 14957 B13R1.158 C=C(C)CCSc1cnccc1N 62a_100000047001_100000730704 [0,1,0,0,0,2|1,0,0]=4 14958 B13R1.158 C=C(C)CCSc1cnccc1N 62a_100000730704_100000047001 [0,1,0,0,0,2|1,0,0]=4 14959 B13R1.158 C=C(C)CCSc1ncccc1Br 62a_100000696092_100000730704 [0,1,0,0,0,2|1,0,0]=4 14960 B13R1.158 C=C(C)CCSc1ncccc1Br 62a_100000730704_100000696092 [0,1,0,0,0,2|1,0,0]=4 14961 B13R1.158 C=C(C)CCSc1ncccc1C 62a_100000730704_100000751373 [0,1,0,0,0,2|1,0,0]=4 14962 B13R1.158 C=C(C)CCSc1ncccc1C 62a_100000751373_100000730704 [0,1,0,0,0,2|1,0,0]=4 14963 B13R1.158 C=C(C)CCSc1ncccc1Cl 62a_100000730704_100011356963 [0,1,0,0,0,2|1,0,0]=4 14964 B13R1.158 C=C(C)CCSc1ncccc1Cl 62a_100011356963_100000730704 [0,1,0,0,0,2|1,0,0]=4 14965 B13R1.158 C=C(C)CCSc1ncccc1F 62a_100000685392_100000730704 [0,1,0,0,0,2|1,0,0]=4 14966 B13R1.158 C=C(C)CCSc1ncccc1F 62a_100000730704_100000685392 [0,1,0,0,0,2|1,0,0]=4 14967 B13R1.158 C=C(C)CCSc1ncccc1N 62a_100000688686_100000730704 [0,1,0,0,0,2|1,0,0]=4 14968 B13R1.158 C=C(C)CCSc1ncccc1N 62a_100000730704_100000688686 [0,1,0,0,0,2|1,0,0]=4 14969 B13R1.158 C=C(C)CCSc1ncccc1O 62a_100000034122_100000730704 [0,1,0,0,0,2|1,0,0]=4 14970 B13R1.158 C=C(C)CCSc1ncccc1O 62a_100000730704_100000034122 [0,1,0,0,0,2|1,0,0]=4 14971 B13R1.158 C=C(C)CNCc1ccccc1Br 2230a_100000689332_100000748629 [0,1,0,0,0,2|0,0,0]=3 14972 B13R1.158 C=C(C)CNCc1ccccc1Br 34a_100000689332_100000748629 [0,1,0,0,0,2|0,0,0]=3 14973 B13R1.158 C=C(C)CNCc1ccccc1C 34a_100000174972_100000748629 [0,1,0,0,0,2|0,0,0]=3 14974 B13R1.158 C=C(C)CNCc1ccccc1Cl 2230a_100000174879_100000748629 [0,1,0,0,0,2|0,0,0]=3 14975 B13R1.158 C=C(C)CNCc1ccccc1Cl 34a_100000174879_100000748629 [0,1,0,0,0,2|0,0,0]=3 14976 B13R1.158 C=C(C)CNCc1ccccc1F 34a_100000174869_100000748629 [0,1,0,0,0,2|0,0,0]=3 14977 B13R1.158 C=C(C)CNCc1ccccc1O 34a_100000185550_100000748629 [0,1,0,0,0,2|0,0,0]=3 14978 B13R1.158 C=C(C)CNCc1cccnc1Br 2230a_100009818023_100000748629 [0,1,0,0,0,2|1,0,0]=4 14979 B13R1.158 C=C(C)CNCc1cccnc1Br 34a_100009818023_100000748629 [0,1,0,0,0,2|1,0,0]=4 14980 B13R1.158 C=C(C)CNCc1cccnc1Cl 2230a_100015189234_100000748629 [0,1,0,0,0,2|1,0,0]=4 14981 B13R1.158 C=C(C)CNCc1cccnc1Cl 34a_100015189234_100000748629 [0,1,0,0,0,2|1,0,0]=4 14982 B13R1.158 C=C(C)CNCc1cccnc1F 34a_100000724633_100000748629 [0,1,0,0,0,2|1,0,0]=4 14983 B13R1.158 C=C(C)CNCc1ccncc1F 34a_100011935246_100000748629 [0,1,0,0,0,2|1,0,0]=4 14984 B13R1.158 C=C(C)CNCc1ncccc1C 34a_100011223789_100000748629 [0,1,0,0,0,2|1,0,0]=4 14985 B13R1.158 C=C(C)CNCc1ncccc1Cl 2230a_100015189233_100000748629 [0,1,0,0,0,2|1,0,0]=4 14986 B13R1.158 C=C(C)CNCc1ncccc1F 34a_100000690088_100000748629 [0,1,0,0,0,2|1,0,0]=4 14987 B13R1.158 C=C(C)COCc1ccccc1Br 34a_100000210245_100000184730 [0,1,0,0,0,2|0,0,0]=3 14988 B13R1.158 C=C(C)COCc1ccccc1Br 34a_100000756307_100000748629 [0,1,0,0,0,2|0,0,0]=3 14989 B13R1.158 C=C(C)COCc1ccccc1Br 7a_100000756307_100000748629 [0,1,0,0,0,2|0,0,0]=3 14990 B13R1.158 C=C(C)COCc1ccccc1C 34a_100000210245_100000211839 [0,1,0,0,0,2|0,0,0]=3 14991 B13R1.158 C=C(C)COCc1ccccc1C 34a_100000698903_100000748629 [0,1,0,0,0,2|0,0,0]=3 14992 B13R1.158 C=C(C)COCc1ccccc1C 7a_100000698903_100000748629 [0,1,0,0,0,2|0,0,0]=3 14993 B13R1.158 C=C(C)COCc1ccccc1Cl 34a_100000210245_100000187162 [0,1,0,0,0,2|0,0,0]=3 14994 B13R1.158 C=C(C)COCc1ccccc1Cl 34a_100000210847_100000748629 [0,1,0,0,0,2|0,0,0]=3 14995 B13R1.158 C=C(C)COCc1ccccc1Cl 7a_100000210847_100000748629 [0,1,0,0,0,2|0,0,0]=3 14996 B13R1.158 C=C(C)COCc1ccccc1F 34a_100000210245_100000211605 [0,1,0,0,0,2|0,0,0]=3 14997 B13R1.158 C=C(C)COCc1ccccc1F 34a_100000211962_100000748629 [0,1,0,0,0,2|0,0,0]=3 14998 B13R1.158 C=C(C)COCc1ccccc1F 7a_100000211962_100000748629 [0,1,0,0,0,2|0,0,0]=3 14999 B13R1.158 C=C(C)COCc1ccccc1I 34a_100000187465_100000748629 [0,1,0,0,0,2|0,0,0]=3 15000 B13R1.158 C=C(C)COCc1ccccc1I 34a_100000210245_100011215278 [0,1,0,0,0,2|0,0,0]=3 15001 B13R1.158 C=C(C)COCc1ccccc1I 7a_100000187465_100000748629 [0,1,0,0,0,2|0,0,0]=3 15002 B13R1.158 C=C(C)COCc1ccccc1N 34a_100000212039_100000748629 [0,1,0,0,0,2|0,0,0]=3 15003 B13R1.158 C=C(C)COCc1cccnc1Br 34a_100000210245_100010140945 [0,1,0,0,0,2|1,0,0]=4 15004 B13R1.158 C=C(C)COCc1cccnc1Br 34a_100000719692_100000748629 [0,1,0,0,0,2|1,0,0]=4 15005 B13R1.158 C=C(C)COCc1cccnc1Br 7a_100000719692_100000748629 [0,1,0,0,0,2|1,0,0]=4 15006 B13R1.158 C=C(C)COCc1cccnc1C 34a_100000210245_100000732876 [0,1,0,0,0,2|1,0,0]=4 15007 B13R1.158 C=C(C)COCc1cccnc1C 34a_100000729262_100000748629 [0,1,0,0,0,2|1,0,0]=4 15008 B13R1.158 C=C(C)COCc1cccnc1C 7a_100000729262_100000748629 [0,1,0,0,0,2|1,0,0]=4 15009 B13R1.158 C=C(C)COCc1cccnc1Cl 34a_100000210245_100000045678 [0,1,0,0,0,2|1,0,0]=4 15010 B13R1.158 C=C(C)COCc1cccnc1Cl 34a_100000748726_100000748629 [0,1,0,0,0,2|1,0,0]=4 15011 B13R1.158 C=C(C)COCc1cccnc1Cl 7a_100000748726_100000748629 [0,1,0,0,0,2|1,0,0]=4 15012 B13R1.158 C=C(C)COCc1cccnc1F 34a_100000079888_100000748629 [0,1,0,0,0,2|1,0,0]=4 15013 B13R1.158 C=C(C)COCc1cccnc1F 34a_100000210245_100000099810 [0,1,0,0,0,2|1,0,0]=4 15014 B13R1.158 C=C(C)COCc1cccnc1F 7a_100000079888_100000748629 [0,1,0,0,0,2|1,0,0]=4 15015 B13R1.158 C=C(C)COCc1ccncc1C 34a_100000210245_100020672809 [0,1,0,0,0,2|1,0,0]=4 15016 B13R1.158 C=C(C)COCc1ccncc1C 34a_100011997032_100000748629 [0,1,0,0,0,2|1,0,0]=4 15017 B13R1.158 C=C(C)COCc1ccncc1F 34a_100012172863_100000748629 [0,1,0,0,0,2|1,0,0]=4 15018 B13R1.158 C=C(C)COCc1cnccc1C 34a_100000210245_100000690890 [0,1,0,0,0,2|1,0,0]=4 15019 B13R1.158 C=C(C)COCc1cnccc1C 34a_100011996381_100000748629 [0,1,0,0,0,2|1,0,0]=4 15020 B13R1.158 C=C(C)COCc1cnccc1Cl 34a_100000117392_100000748629 [0,1,0,0,0,2|1,0,0]=4 15021 B13R1.158 C=C(C)COCc1ncccc1Br 34a_100000210245_100025702911 [0,1,0,0,0,2|1,0,0]=4 15022 B13R1.158 C=C(C)COCc1ncccc1Br 34a_100011996772_100000748629 [0,1,0,0,0,2|1,0,0]=4 15023 B13R1.158 C=C(C)COCc1ncccc1C 34a_100000210245_100000696600 [0,1,0,0,0,2|1,0,0]=4 15024 B13R1.158 C=C(C)COCc1ncccc1C 34a_100000698912_100000748629 [0,1,0,0,0,2|1,0,0]=4 15025 B13R1.158 C=C(C)COCc1ncccc1Cl 34a_100012002383_100000748629 [0,1,0,0,0,2|1,0,0]=4 15026 B13R1.158 C=C(C)COCc1ncccc1F 34a_100000210245_100000104219 [0,1,0,0,0,2|1,0,0]=4 15027 B13R1.158 C=C(C)COCc1ncccc1F 34a_100011934865_100000748629 [0,1,0,0,0,2|1,0,0]=4 15028 B13R1.158 C=C(C)COCc1ncccc1N 34a_114873767017_100000748629 [0,1,0,0,0,2|1,0,0]=4 15029 B13R1.158 C=C(C)COCc1ncccc1O 34a_100000210245_200020655725 [0,1,0,0,0,2|1,0,0]=4 15030 B13R1.158 C=C(C)CSCc1ccccc1Br 62a_100000184730_100000211660 [0,1,0,0,0,2|0,0,0]=3 15031 B13R1.158 C=C(C)CSCc1ccccc1Br 62a_100000748629_100000184730 [0,1,0,0,0,2|0,0,0]=3 15032 B13R1.158 C=C(C)CSCc1ccccc1C 62a_100000211839_100000211660 [0,1,0,0,0,2|0,0,0]=3 15033 B13R1.158 C=C(C)CSCc1ccccc1C 62a_100000748629_100000211839 [0,1,0,0,0,2|0,0,0]=3 15034 B13R1.158 C=C(C)CSCc1ccccc1Cl 62a_100000187162_100000211660 [0,1,0,0,0,2|0,0,0]=3 15035 B13R1.158 C=C(C)CSCc1ccccc1Cl 62a_100000748629_100000187162 [0,1,0,0,0,2|0,0,0]=3 15036 B13R1.158 C=C(C)CSCc1ccccc1F 62a_100000211605_100000211660 [0,1,0,0,0,2|0,0,0]=3 15037 B13R1.158 C=C(C)CSCc1ccccc1F 62a_100000748629_100000211605 [0,1,0,0,0,2|0,0,0]=3 15038 B13R1.158 C=C(C)CSCc1ccccc1I 62a_100000748629_100011216222 [0,1,0,0,0,2|0,0,0]=3 15039 B13R1.158 C=C(C)CSCc1ccccc1I 62a_100011216222_100000211660 [0,1,0,0,0,2|0,0,0]=3 15040 B13R1.158 C=C(C)CSCc1cccnc1Br 62a_100000748629_100010140945 [0,1,0,0,0,2|1,0,0]=4 15041 B13R1.158 C=C(C)CSCc1cccnc1Br 62a_100010140945_100000211660 [0,1,0,0,0,2|1,0,0]=4 15042 B13R1.158 C=C(C)CSCc1cccnc1C 62a_100000732876_100000211660 [0,1,0,0,0,2|1,0,0]=4 15043 B13R1.158 C=C(C)CSCc1cccnc1C 62a_100000748629_100000732876 [0,1,0,0,0,2|1,0,0]=4 15044 B13R1.158 C=C(C)CSCc1cccnc1Cl 62a_100000045678_100000211660 [0,1,0,0,0,2|1,0,0]=4 15045 B13R1.158 C=C(C)CSCc1cccnc1Cl 62a_100000748629_100000045678 [0,1,0,0,0,2|1,0,0]=4 15046 B13R1.158 C=C(C)CSCc1cccnc1F 62a_100000099810_100000211660 [0,1,0,0,0,2|1,0,0]=4 15047 B13R1.158 C=C(C)CSCc1cccnc1F 62a_100000748629_100000099810 [0,1,0,0,0,2|1,0,0]=4 15048 B13R1.158 C=C(C)CSCc1ccncc1C 62a_100000748629_100020672808 [0,1,0,0,0,2|1,0,0]=4 15049 B13R1.158 C=C(C)CSCc1ccncc1C 62a_100020672808_100000211660 [0,1,0,0,0,2|1,0,0]=4 15050 B13R1.158 C=C(C)CSCc1ccncc1Cl 62a_100000748629_100000763264 [0,1,0,0,0,2|1,0,0]=4 15051 B13R1.158 C=C(C)CSCc1ccncc1Cl 62a_100000763264_100000211660 [0,1,0,0,0,2|1,0,0]=4 15052 B13R1.158 C=C(C)CSCc1cnccc1C 62a_100000690890_100000211660 [0,1,0,0,0,2|1,0,0]=4 15053 B13R1.158 C=C(C)CSCc1cnccc1C 62a_100000748629_100000690890 [0,1,0,0,0,2|1,0,0]=4 15054 B13R1.158 C=C(C)CSCc1ncccc1Br 62a_100000748629_100025702911 [0,1,0,0,0,2|1,0,0]=4 15055 B13R1.158 C=C(C)CSCc1ncccc1Br 62a_100025702911_100000211660 [0,1,0,0,0,2|1,0,0]=4 15056 B13R1.158 C=C(C)CSCc1ncccc1C 62a_100000696600_100000211660 [0,1,0,0,0,2|1,0,0]=4 15057 B13R1.158 C=C(C)CSCc1ncccc1C 62a_100000748629_100000696600 [0,1,0,0,0,2|1,0,0]=4 15058 B13R1.158 C=C(C)CSCc1ncccc1Cl 62a_100000099807_100000211660 [0,1,0,0,0,2|1,0,0]=4 15059 B13R1.158 C=C(C)CSCc1ncccc1Cl 62a_100000748629_100000099807 [0,1,0,0,0,2|1,0,0]=4 15060 B13R1.158 C=C(C)CSCc1ncccc1F 62a_100000104219_100000211660 [0,1,0,0,0,2|1,0,0]=4 15061 B13R1.158 C=C(C)CSCc1ncccc1F 62a_100000748629_100000104219 [0,1,0,0,0,2|1,0,0]=4 15062 B13R1.158 C=C(C)CSCc1ncccc1O 62a_100000748629_200020655725 [0,1,0,0,0,2|1,0,0]=4 15063 B13R1.158 C=C(C)CSCc1ncccc1O 62a_200020655725_100000211660 [0,1,0,0,0,2|1,0,0]=4 15064 B13R1.158 C=C(F)CNCc1ccccc1Br 2230a_100000689332_100009893438 [0,1,0,0,0,2|1,0,0]=4 15065 B13R1.158 C=C(F)CNCc1ccccc1Br 34a_100000689332_100009893438 [0,1,0,0,0,2|1,0,0]=4 15066 B13R1.158 C=C(F)CNCc1ccccc1C 34a_100000174972_100009893438 [0,1,0,0,0,2|1,0,0]=4 15067 B13R1.158 C=C(F)CNCc1ccccc1Cl 2230a_100000174879_100009893438 [0,1,0,0,0,2|1,0,0]=4 15068 B13R1.158 C=C(F)CNCc1ccccc1Cl 34a_100000174879_100009893438 [0,1,0,0,0,2|1,0,0]=4 15069 B13R1.158 C=C(F)CNCc1ccccc1F 34a_100000174869_100009893438 [0,1,0,0,0,2|1,0,0]=4 15070 B13R1.158 C=C(F)CNCc1ccccc1O 34a_100000185550_100009893438 [0,1,0,0,0,2|1,0,0]=4 15071 B13R1.158 C=C(F)COCc1ccccc1Br 34a_100000756307_100009893438 [0,1,0,0,0,2|1,0,0]=4 15072 B13R1.158 C=C(F)COCc1ccccc1Br 34a_200010262243_100000184730 [0,1,0,0,0,2|1,0,0]=4 15073 B13R1.158 C=C(F)COCc1ccccc1Br 7a_100000756307_100000042424 [0,1,0,0,0,2|1,0,0]=4 15074 B13R1.158 C=C(F)COCc1ccccc1C 34a_100000698903_100009893438 [0,1,0,0,0,2|1,0,0]=4 15075 B13R1.158 C=C(F)COCc1ccccc1C 34a_200010262243_100000211839 [0,1,0,0,0,2|1,0,0]=4 15076 B13R1.158 C=C(F)COCc1ccccc1C 7a_100000698903_100000042424 [0,1,0,0,0,2|1,0,0]=4 15077 B13R1.158 C=C(F)COCc1ccccc1Cl 34a_100000210847_100009893438 [0,1,0,0,0,2|1,0,0]=4 15078 B13R1.158 C=C(F)COCc1ccccc1Cl 34a_200010262243_100000187162 [0,1,0,0,0,2|1,0,0]=4 15079 B13R1.158 C=C(F)COCc1ccccc1Cl 7a_100000210847_100000042424 [0,1,0,0,0,2|1,0,0]=4 15080 B13R1.158 C=C(F)COCc1ccccc1F 34a_100000211962_100009893438 [0,1,0,0,0,2|1,0,0]=4 15081 B13R1.158 C=C(F)COCc1ccccc1F 34a_200010262243_100000211605 [0,1,0,0,0,2|1,0,0]=4 15082 B13R1.158 C=C(F)COCc1ccccc1F 7a_100000211962_100000042424 [0,1,0,0,0,2|1,0,0]=4 15083 B13R1.158 C=C(F)COCc1ccccc1I 34a_100000187465_100009893438 [0,1,0,0,0,2|1,0,0]=4 15084 B13R1.158 C=C(F)COCc1ccccc1I 34a_200010262243_100011215278 [0,1,0,0,0,2|1,0,0]=4 15085 B13R1.158 C=C(F)COCc1ccccc1I 7a_100000187465_100000042424 [0,1,0,0,0,2|1,0,0]=4 15086 B13R1.158 C=C(F)COCc1ccccc1N 34a_100000212039_100009893438 [0,1,0,0,0,2|1,0,0]=4 15087 B13R1.158 C=C(F)CSCc1ccccc1Br 62a_100000042424_100000184730 [0,1,0,0,0,2|1,0,0]=4 15088 B13R1.158 C=C(F)CSCc1ccccc1Br 62a_100000184730_100000042424 [0,1,0,0,0,2|1,0,0]=4 15089 B13R1.158 C=C(F)CSCc1ccccc1C 62a_100000042424_100000211839 [0,1,0,0,0,2|1,0,0]=4 15090 B13R1.158 C=C(F)CSCc1ccccc1C 62a_100000211839_100000042424 [0,1,0,0,0,2|1,0,0]=4 15091 B13R1.158 C=C(F)CSCc1ccccc1Cl 62a_100000042424_100000187162 [0,1,0,0,0,2|1,0,0]=4 15092 B13R1.158 C=C(F)CSCc1ccccc1Cl 62a_100000187162_100000042424 [0,1,0,0,0,2|1,0,0]=4 15093 B13R1.158 C=C(F)CSCc1ccccc1F 62a_100000042424_100000211605 [0,1,0,0,0,2|1,0,0]=4 15094 B13R1.158 C=C(F)CSCc1ccccc1F 62a_100000211605_100000042424 [0,1,0,0,0,2|1,0,0]=4 15095 B13R1.158 C=C(F)CSCc1ccccc1I 62a_100000042424_100011216222 [0,1,0,0,0,2|1,0,0]=4 15096 B13R1.158 C=C(F)CSCc1ccccc1I 62a_100011216222_100000042424 [0,1,0,0,0,2|1,0,0]=4 15097 B13R1.158 CC(=CCNc1ccccc1Br)C 34a_100000210017_100000761012 [0,1,0,0,0,2|0,0,1]=4 15098 B13R1.158 CC(=CCNc1ccccc1C)C 34a_100015192222_100000761012 [0,1,0,0,0,2|0,0,1]=4 15099 B13R1.158 CC(=CCNc1ccccc1Cl)C 34a_100000185783_100000761012 [0,1,0,0,0,2|0,0,1]=4 15100 B13R1.158 CC(=CCNc1ccccc1F)C 34a_100000210422_100000761012 [0,1,0,0,0,2|0,0,1]=4 15101 B13R1.158 CC(=CCNc1ccccc1I)C 34a_100000210053_100000761012 [0,1,0,0,0,2|0,0,1]=4 15102 B13R1.158 CC(=CCNc1ccccc1O)C 34a_100000185747_100000761012 [0,1,0,0,0,2|0,0,1]=4 15103 B13R1.158 CC(=CCOc1ccccc1Br)C 34a_100000181306_100000761012 [0,1,0,0,0,2|0,0,1]=4 15104 B13R1.158 CC(=CCOc1ccccc1Br)C 7a_100000181306_100000761012 [0,1,0,0,0,2|0,0,1]=4 15105 B13R1.158 CC(=CCOc1ccccc1C)C 34a_100000210338_100000761012 [0,1,0,0,0,2|0,0,1]=4 15106 B13R1.158 CC(=CCOc1ccccc1C)C 7a_100000210338_100000761012 [0,1,0,0,0,2|0,0,1]=4 15107 B13R1.158 CC(=CCOc1ccccc1Cl)C 34a_100000210172_100000761012 [0,1,0,0,0,2|0,0,1]=4 15108 B13R1.158 CC(=CCOc1ccccc1Cl)C 7a_100000210172_100000761012 [0,1,0,0,0,2|0,0,1]=4 15109 B13R1.158 CC(=CCOc1ccccc1F)C 34a_100000210171_100000761012 [0,1,0,0,0,2|0,0,1]=4 15110 B13R1.158 CC(=CCOc1ccccc1F)C 7a_100000210171_100000761012 [0,1,0,0,0,2|0,0,1]=4 15111 B13R1.158 CC(=CCOc1ccccc1I)C 34a_100000739446_100000761012 [0,1,0,0,0,2|0,0,1]=4 15112 B13R1.158 CC(=CCOc1ccccc1I)C 7a_100000739446_100000761012 [0,1,0,0,0,2|0,0,1]=4 15113 B13R1.158 CC(=CCOc1ccccc1N)C 34a_100000185747_100000761012 [0,1,0,0,0,2|0,0,1]=4 15114 B13R1.158 CC(=CCOc1ccccc1N)C 7a_100000185747_100000761012 [0,1,0,0,0,2|0,0,1]=4 15115 B13R1.158 CC(=CCSc1ccccc1Br)C 62a_100000695589_100000761012 [0,1,0,0,0,2|0,0,1]=4 15116 B13R1.158 CC(=CCSc1ccccc1Br)C 62a_100000761012_100000695589 [0,1,0,0,0,2|0,0,1]=4 15117 B13R1.158 CC(=CCSc1ccccc1C)C 62a_100000210755_100000761012 [0,1,0,0,0,2|0,0,1]=4 15118 B13R1.158 CC(=CCSc1ccccc1C)C 62a_100000761012_100000210755 [0,1,0,0,0,2|0,0,1]=4 15119 B13R1.158 CC(=CCSc1ccccc1Cl)C 62a_100000761012_100000764095 [0,1,0,0,0,2|0,0,1]=4 15120 B13R1.158 CC(=CCSc1ccccc1Cl)C 62a_100000764095_100000761012 [0,1,0,0,0,2|0,0,1]=4 15121 B13R1.158 CC(=CCSc1ccccc1F)C 62a_100000761012_100011215700 [0,1,0,0,0,2|0,0,1]=4 15122 B13R1.158 CC(=CCSc1ccccc1F)C 62a_100011215700_100000761012 [0,1,0,0,0,2|0,0,1]=4 15123 B13R1.158 CC(=CCSc1ccccc1N)C 62a_100000210017_100000761012 [0,1,0,0,0,2|0,0,1]=4 15124 B13R1.158 CC(=CCSc1ccccc1N)C 62a_100000761012_100000210017 [0,1,0,0,0,2|0,0,1]=4 15125 B13R1.158 CC(=CCSc1ccccc1O)C 62a_100000739446_100000761012 [0,1,0,0,0,2|0,0,1]=4 15126 B13R1.158 CC(=CCSc1ccccc1O)C 62a_100000761012_100000739446 [0,1,0,0,0,2|0,0,1]=4 15127 B13R1.158 CC(=O)CC#Cc1ccccc1Br 1458a_100000070787_100010706765 [0,1,0,0,0,2|1,0,0]=4 15128 B13R1.158 CC(=O)CC#Cc1ccccc1F 1458a_100000070787_100010404167 [0,1,0,0,0,2|1,0,0]=4 15129 B13R1.158 CC(=O)CCCc1ccccc1Br 1458a_100000070787_200011713681 [0,1,0,0,0,2|1,0,0]=4 15130 B13R1.158 CC(=O)CCCc1ccccc1Cl 1458a_100000700343_200000210301 [0,1,0,0,0,2|1,0,0]=4 15131 B13R1.158 CC(=O)CCCc1ccccc1O 1458a_100009859317_200000210301 [0,1,0,0,0,2|1,0,0]=4 15132 B13R1.158 CC(=O)CCOc1ccccc1Br 1458a_100000070787_100000695877 [0,1,0,0,0,2|1,0,0]=4 15133 B13R1.158 CC(=O)CCOc1ccccc1Br 1458a_100000740817_200000210301 [0,1,0,0,0,2|1,0,0]=4 15134 B13R1.158 CC(=O)CCOc1ccccc1Br 7a_100000181306_100000053229 [0,1,0,0,0,2|1,0,0]=4 15135 B13R1.158 CC(=O)CCOc1ccccc1C 1458a_100000070787_100000184434 [0,1,0,0,0,2|1,0,0]=4 15136 B13R1.158 CC(=O)CCOc1ccccc1C 1458a_100000182324_200000210301 [0,1,0,0,0,2|1,0,0]=4 15137 B13R1.158 CC(=O)CCOc1ccccc1C 7a_100000210338_100000053229 [0,1,0,0,0,2|1,0,0]=4 15138 B13R1.158 CC(=O)CCOc1ccccc1Cl 1458a_100000240438_200000210301 [0,1,0,0,0,2|1,0,0]=4 15139 B13R1.158 CC(=O)CCOc1ccccc1Cl 7a_100000210172_100000053229 [0,1,0,0,0,2|1,0,0]=4 15140 B13R1.158 CC(=O)CCOc1ccccc1F 1458a_100000070787_100000183290 [0,1,0,0,0,2|1,0,0]=4 15141 B13R1.158 CC(=O)CCOc1ccccc1F 1458a_100000184057_200000210301 [0,1,0,0,0,2|1,0,0]=4 15142 B13R1.158 CC(=O)CCOc1ccccc1F 7a_100000210171_100000053229 [0,1,0,0,0,2|1,0,0]=4 15143 B13R1.158 CC(=O)CCOc1ccccc1I 7a_100000739446_100000053229 [0,1,0,0,0,2|1,0,0]=4 15144 B13R1.158 CC(=O)CCOc1ccccc1N 7a_100000185747_100000053229 [0,1,0,0,0,2|1,0,0]=4 15145 B13R1.158 CC(=O)CCSc1ccccc1Br 62a_100000053229_100000695589 [0,1,0,0,0,2|1,0,0]=4 15146 B13R1.158 CC(=O)CCSc1ccccc1Br 62a_100000695589_100000053229 [0,1,0,0,0,2|1,0,0]=4 15147 B13R1.158 CC(=O)CCSc1ccccc1C 62a_100000053229_100000210755 [0,1,0,0,0,2|1,0,0]=4 15148 B13R1.158 CC(=O)CCSc1ccccc1C 62a_100000210755_100000053229 [0,1,0,0,0,2|1,0,0]=4 15149 B13R1.158 CC(=O)CCSc1ccccc1Cl 62a_100000053229_100000764095 [0,1,0,0,0,2|1,0,0]=4 15150 B13R1.158 CC(=O)CCSc1ccccc1Cl 62a_100000764095_100000053229 [0,1,0,0,0,2|1,0,0]=4 15151 B13R1.158 CC(=O)CCSc1ccccc1F 1458a_100000208832_200000210301 [0,1,0,0,0,2|1,0,0]=4 15152 B13R1.158 CC(=O)CCSc1ccccc1F 62a_100000053229_100011215700 [0,1,0,0,0,2|1,0,0]=4 15153 B13R1.158 CC(=O)CCSc1ccccc1F 62a_100011215700_100000053229 [0,1,0,0,0,2|1,0,0]=4 15154 B13R1.158 CC(=O)CCSc1ccccc1N 62a_100000053229_100000210017 [0,1,0,0,0,2|1,0,0]=4 15155 B13R1.158 CC(=O)CCSc1ccccc1N 62a_100000210017_100000053229 [0,1,0,0,0,2|1,0,0]=4 15156 B13R1.158 CC(=O)CCSc1ccccc1O 62a_100000053229_100000739446 [0,1,0,0,0,2|1,0,0]=4 15157 B13R1.158 CC(=O)CCSc1ccccc1O 62a_100000739446_100000053229 [0,1,0,0,0,2|1,0,0]=4 15158 B13R1.158 CC(=O)COCc1ccccc1Br 34a_100000211253_100000184730 [0,1,0,0,0,2|1,0,0]=4 15159 B13R1.158 CC(=O)COCc1ccccc1C 34a_100000211253_100000211839 [0,1,0,0,0,2|1,0,0]=4 15160 B13R1.158 CC(=O)COCc1ccccc1Cl 34a_100000211253_100000187162 [0,1,0,0,0,2|1,0,0]=4 15161 B13R1.158 CC(=O)COCc1ccccc1F 34a_100000211253_100000211605 [0,1,0,0,0,2|1,0,0]=4 15162 B13R1.158 CC(=O)COCc1ccccc1I 34a_100000211253_100011215278 [0,1,0,0,0,2|1,0,0]=4 15163 B13R1.158 CC(=O)CSCc1ccccc1C 1458a_100000150258_200000210301 [0,1,0,0,0,2|1,0,0]=4 15164 B13R1.158 CC(=O)CSCc1ccccc1Cl 1458a_100000150270_200000210301 [0,1,0,0,0,2|1,0,0]=4 15165 B13R1.158 CC(=O)CSCc1ccccc1F 1458a_100000150260_200000210301 [0,1,0,0,0,2|1,0,0]=4 15166 B13R1.158 CC(=O)NCCc1ccccc1Br 11a_100000747383_100015343762 [0,1,0,0,0,2|1,0,0]=4 15167 B13R1.158 CC(=O)NCCc1ccccc1Br 1626a_100000747383_100015343762 [0,1,0,0,0,2|1,0,0]=4 15168 B13R1.158 CC(=O)NCCc1ccccc1Br 240690a_100000747383_100015343762 [0,1,0,0,0,2|1,0,0]=4 15169 B13R1.158 CC(=O)NCCc1ccccc1Br 527a_100000747383_100103153847 [0,1,0,0,0,2|1,0,0]=4 15170 B13R1.158 CC(=O)NCCc1ccccc1C 11a_100000685071_100015343762 [0,1,0,0,0,2|1,0,0]=4 15171 B13R1.158 CC(=O)NCCc1ccccc1C 1626a_100000685071_100015343762 [0,1,0,0,0,2|1,0,0]=4 15172 B13R1.158 CC(=O)NCCc1ccccc1C 240690a_100000685071_100015343762 [0,1,0,0,0,2|1,0,0]=4 15173 B13R1.158 CC(=O)NCCc1ccccc1C 527a_100000685071_100103153847 [0,1,0,0,0,2|1,0,0]=4 15174 B13R1.158 CC(=O)NCCc1ccccc1Cl 11a_100011207228_100015343762 [0,1,0,0,0,2|1,0,0]=4 15175 B13R1.158 CC(=O)NCCc1ccccc1Cl 1626a_100011207228_100015343762 [0,1,0,0,0,2|1,0,0]=4 15176 B13R1.158 CC(=O)NCCc1ccccc1Cl 240690a_100011207228_100015343762 [0,1,0,0,0,2|1,0,0]=4 15177 B13R1.158 CC(=O)NCCc1ccccc1Cl 527a_100011207228_100103153847 [0,1,0,0,0,2|1,0,0]=4 15178 B13R1.158 CC(=O)NCCc1ccccc1F 11a_100000185272_100015343762 [0,1,0,0,0,2|1,0,0]=4 15179 B13R1.158 CC(=O)NCCc1ccccc1F 1626a_100000185272_100015343762 [0,1,0,0,0,2|1,0,0]=4 15180 B13R1.158 CC(=O)NCCc1ccccc1F 240690a_100000185272_100015343762 [0,1,0,0,0,2|1,0,0]=4 15181 B13R1.158 CC(=O)NCCc1ccccc1F 527a_100000185272_100103153847 [0,1,0,0,0,2|1,0,0]=4 15182 B13R1.158 CC(=O)NCCc1ccccc1O 240690a_100011207237_100015343762 [0,1,0,0,0,2|1,0,0]=4 15183 B13R1.158 CC(=O)NCCc1ccccc1O 527a_100011207237_100103153847 [0,1,0,0,0,2|1,0,0]=4 15184 B13R1.158 CC(=O)NNCc1ccccc1Br 22a_200016993956_100000070787 [0,1,0,0,0,2|1,0,0]=4 15185 B13R1.158 CC(=O)NNCc1ccccc1C 22a_100000737298_100000070787 [0,1,0,0,0,2|1,0,0]=4 15186 B13R1.158 CC(=O)NNCc1ccccc1Cl 22a_100015187261_100000070787 [0,1,0,0,0,2|1,0,0]=4 15187 B13R1.158 CC(=O)NNCc1ccccc1F 22a_100015200773_100000070787 [0,1,0,0,0,2|1,0,0]=4 15188 B13R1.158 CC(=O)OCNc1ccccc1Br 34a_100000210017_100009813279 [0,1,0,0,0,2|1,0,0]=4 15189 B13R1.158 CC(=O)OCNc1ccccc1C 34a_100015192222_100009813279 [0,1,0,0,0,2|1,0,0]=4 15190 B13R1.158 CC(=O)OCNc1ccccc1Cl 34a_100000185783_100009813279 [0,1,0,0,0,2|1,0,0]=4 15191 B13R1.158 CC(=O)OCNc1ccccc1F 34a_100000210422_100009813279 [0,1,0,0,0,2|1,0,0]=4 15192 B13R1.158 CC(=O)OCNc1ccccc1I 34a_100000210053_100009813279 [0,1,0,0,0,2|1,0,0]=4 15193 B13R1.158 CC(=O)OCNc1ccccc1O 34a_100000185747_100009813279 [0,1,0,0,0,2|1,0,0]=4 15194 B13R1.158 CC(=O)OCOc1ccccc1Br 34a_100000181306_100009813279 [0,1,0,0,0,2|1,0,0]=4 15195 B13R1.158 CC(=O)OCOc1ccccc1C 34a_100000210338_100009813279 [0,1,0,0,0,2|1,0,0]=4 15196 B13R1.158 CC(=O)OCOc1ccccc1Cl 34a_100000210172_100009813279 [0,1,0,0,0,2|1,0,0]=4 15197 B13R1.158 CC(=O)OCOc1ccccc1F 34a_100000210171_100009813279 [0,1,0,0,0,2|1,0,0]=4 15198 B13R1.158 CC(=O)OCOc1ccccc1I 34a_100000739446_100009813279 [0,1,0,0,0,2|1,0,0]=4 15199 B13R1.158 CC(=O)OCOc1ccccc1N 34a_100000185747_100009813279 [0,1,0,0,0,2|1,0,0]=4 15200 B13R1.158 CC(=O)OCSc1ccccc1Br 62a_100000076356_100000695589 [0,1,0,0,0,2|1,0,0]=4 15201 B13R1.158 CC(=O)OCSc1ccccc1Br 62a_100000695589_100000076356 [0,1,0,0,0,2|1,0,0]=4 15202 B13R1.158 CC(=O)OCSc1ccccc1C 62a_100000076356_100000210755 [0,1,0,0,0,2|1,0,0]=4 15203 B13R1.158 CC(=O)OCSc1ccccc1C 62a_100000210755_100000076356 [0,1,0,0,0,2|1,0,0]=4 15204 B13R1.158 CC(=O)OCSc1ccccc1Cl 62a_100000076356_100000764095 [0,1,0,0,0,2|1,0,0]=4 15205 B13R1.158 CC(=O)OCSc1ccccc1Cl 62a_100000764095_100000076356 [0,1,0,0,0,2|1,0,0]=4 15206 B13R1.158 CC(=O)OCSc1ccccc1F 62a_100000076356_100011215700 [0,1,0,0,0,2|1,0,0]=4 15207 B13R1.158 CC(=O)OCSc1ccccc1F 62a_100011215700_100000076356 [0,1,0,0,0,2|1,0,0]=4 15208 B13R1.158 CC(=O)OCSc1ccccc1N 62a_100000076356_100000210017 [0,1,0,0,0,2|1,0,0]=4 15209 B13R1.158 CC(=O)OCSc1ccccc1N 62a_100000210017_100000076356 [0,1,0,0,0,2|1,0,0]=4 15210 B13R1.158 CC(=O)OCSc1ccccc1O 62a_100000076356_100000739446 [0,1,0,0,0,2|1,0,0]=4 15211 B13R1.158 CC(=O)OCSc1ccccc1O 62a_100000739446_100000076356 [0,1,0,0,0,2|1,0,0]=4 15212 B13R1.158 Cc1ccccc1CSCC(=O)[13CH3] 1458a_100000150258_200025704644 [0,1,0,0,0,2|1,0,0]=4 15213 B13R1.158 Cc1ccccc1OCCC(=O)[13CH3] 1458a_100000182324_200025704644 [0,1,0,0,0,2|1,0,0]=4 15214 B13R1.158 [13CH3]C(=O)CCCc1ccccc1Cl 1458a_100000700343_200025704644 [0,1,0,0,0,2|1,0,0]=4 15215 B13R1.158 [13CH3]C(=O)CCCc1ccccc1O 1458a_100009859317_200025704644 [0,1,0,0,0,2|1,0,0]=4 15216 B13R1.158 [13CH3]C(=O)CCOc1ccccc1Br 1458a_100000740817_200025704644 [0,1,0,0,0,2|1,0,0]=4 15217 B13R1.158 [13CH3]C(=O)CCOc1ccccc1Cl 1458a_100000240438_200025704644 [0,1,0,0,0,2|1,0,0]=4 15218 B13R1.158 [13CH3]C(=O)CCOc1ccccc1F 1458a_100000184057_200025704644 [0,1,0,0,0,2|1,0,0]=4 15219 B13R1.158 [13CH3]C(=O)CCSc1ccccc1F 1458a_100000208832_200025704644 [0,1,0,0,0,2|1,0,0]=4 15220 B13R1.158 [13CH3]C(=O)CSCc1ccccc1Cl 1458a_100000150270_200025704644 [0,1,0,0,0,2|1,0,0]=4 15221 B13R1.158 [13CH3]C(=O)CSCc1ccccc1F 1458a_100000150260_200025704644 [0,1,0,0,0,2|1,0,0]=4 15222 B13R1.348 C=C(C)CC(=O)C[n+]1ccccc1 1458a_200000086051_100000748629 [0,1,0,0,0,2|1,0,0]=4 15223 B13R1.348 C=C(C)CC(=O)Cc1ccccn1 1458a_100000233486_100000748629 [0,1,0,0,0,2|1,0,0]=4 15224 B13R1.348 C=C(C)CC(=O)Cc1cccnc1 1458a_100000737805_100000748629 [0,1,0,0,0,2|1,0,0]=4 15225 B13R1.348 C=C(C)CN(C)Cc1ccccc1 2230a_100000186898_100000748629 [0,1,0,0,0,2|0,0,0]=3 15226 B13R1.348 C=C(C)CN(C)Cc1ccccc1 2230a_100000225649_100015291786 [0,1,0,0,0,2|0,0,0]=3 15227 B13R1.348 C=C(C)CN(C)Cc1ccccc1 2230a_100015184565_200000210301 [0,1,0,0,0,2|0,0,0]=3 15228 B13R1.348 C=C(C)CN(C)Cc1ccccc1 269982a_100000186898_100000748629 [0,1,0,0,0,2|0,0,0]=3 15229 B13R1.348 C=C(C)CN(C)Cc1ccccc1 269982a_100000225649_100000211182 [0,1,0,0,0,2|0,0,0]=3 15230 B13R1.348 C=C(C)CN(C)Cc1ccccc1 269982a_100015184565_200000210301 [0,1,0,0,0,2|0,0,0]=3 15231 B13R1.348 C=C(C)CN(C)Cc1ccccc1 270004a_100000225649_100015611070 [0,1,0,0,0,2|0,0,0]=3 15232 B13R1.348 C=C(C)CN(C)Cc1ccccn1 2230a_100000207498_100000748629 [0,1,0,0,0,2|1,0,0]=4 15233 B13R1.348 C=C(C)CN(C)Cc1ccccn1 2230a_100000225649_100000721315 [0,1,0,0,0,2|1,0,0]=4 15234 B13R1.348 C=C(C)CN(C)Cc1ccccn1 269982a_100000207498_100000748629 [0,1,0,0,0,2|1,0,0]=4 15235 B13R1.348 C=C(C)CN(C)Cc1ccccn1 269982a_100000225649_100000721315 [0,1,0,0,0,2|1,0,0]=4 15236 B13R1.348 C=C(C)CN(C)Cc1ccccn1 270004a_100000225649_100000209966 [0,1,0,0,0,2|1,0,0]=4 15237 B13R1.348 C=C(C)CN(C)Cc1cccnc1 2230a_100000184577_100000748629 [0,1,0,0,0,2|1,0,0]=4 15238 B13R1.348 C=C(C)CN(C)Cc1cccnc1 2230a_100000225649_100000741622 [0,1,0,0,0,2|1,0,0]=4 15239 B13R1.348 C=C(C)CN(C)Cc1cccnc1 269982a_100000184577_100000748629 [0,1,0,0,0,2|1,0,0]=4 15240 B13R1.348 C=C(C)CN(C)Cc1cccnc1 269982a_100000225649_100000733263 [0,1,0,0,0,2|1,0,0]=4 15241 B13R1.348 C=C(C)CN(C)Cc1cccnc1 270004a_100000225649_100000209961 [0,1,0,0,0,2|1,0,0]=4 15242 B13R1.348 C=C(C)CN(C)Cc1ccncc1 2230a_100000187231_100000748629 [0,1,0,0,0,2|1,0,0]=4 15243 B13R1.348 C=C(C)CN(C)Cc1ccncc1 2230a_100000225649_100015193705 [0,1,0,0,0,2|1,0,0]=4 15244 B13R1.348 C=C(C)CN(C)Cc1ccncc1 269982a_100000187231_100000748629 [0,1,0,0,0,2|1,0,0]=4 15245 B13R1.348 C=C(C)CN(C)Cc1ccncc1 269982a_100000225649_100015193705 [0,1,0,0,0,2|1,0,0]=4 15246 B13R1.348 C=C(C)CN([13CH3])Cc1ccccc1 2230a_100015184565_200025704644 [0,1,0,0,0,2|0,0,0]=3 15247 B13R1.348 C=C(C)CN([13CH3])Cc1ccccc1 269982a_100015184565_200025704644 [0,1,0,0,0,2|0,0,0]=3 15248 B13R1.348 C=C(F)CN(C)Cc1ccccc1 2230a_100000186898_100009893438 [0,1,0,0,0,2|1,0,0]=4 15249 B13R1.348 C=C(F)CN(C)Cc1ccccc1 269982a_100000186898_100009893438 [0,1,0,0,0,2|1,0,0]=4 15250 B13R1.348 CC(=CC(=O)Cc1ccccc1)C 1458a_100000211388_100015291786 [0,1,0,0,0,2|0,0,1]=4 15251 B13R1.348 CC(=CC(=O)Cc1ccccc1)Cl 1458a_200042562850_100015291786 [0,1,0,0,0,2|1,0,0]=4 15252 B13R1.348 CC(=CC(=O)Cc1ccccc1)I 1458a_100025716642_100015291786 [0,1,0,0,0,2|1,0,0]=4 15253 B13R1.348 CC(=O)CC(=O)Cc1ccccc1 1458a_100000070787_100000233483 [0,1,0,0,0,2|1,0,0]=4 15254 B13R1.348 CC(=O)CC(=O)Nc1ccccc1 1458a_100000070787_100000182850 [0,1,0,0,0,2|1,0,0]=4 15255 B13R1.348 CC(=O)CC(=O)Oc1ccccc1 1458a_100000070787_100009813826 [0,1,0,0,0,2|1,0,0]=4 15256 B13R1.348 CC(=O)CN(C)Cc1ccccc1 1458a_100000745601_200000210301 [0,1,0,0,0,2|1,0,0]=4 15257 B13R1.348 CC(=O)OC(C)Sc1ccccc1 62a_100000719477_100009818208 [0,1,0,0,0,2|1,0,0]=4 15258 B13R1.348 CC(=O)OC(C)Sc1ccccc1 62a_100009818208_100000041952 [0,1,0,0,0,2|1,0,0]=4 15259 B13R1.348 CN(CC(=O)[13CH3])Cc1ccccc1 1458a_100000745601_200025704644 [0,1,0,0,0,2|1,0,0]=4 15260 B13R1.351 C=C(Br)C(=O)NCc1ccccc1 11a_100015324214_100009813364 [0,1,0,0,0,2|1,0,0]=4 15261 B13R1.351 C=C(Br)C(=O)NCc1ccccc1 1626a_100015324214_100009813364 [0,1,0,0,0,2|1,0,0]=4 15262 B13R1.351 C=C(C)C(=NNc1ccccc1)C 4a_100015195140_100011216138 [0,1,0,0,0,2|0,0,1]=4 15263 B13R1.351 C=C(C)C(=O)CCc1ccccc1 1458a_100000185857_100000765856 [0,1,0,0,0,2|0,0,0]=3 15264 B13R1.351 C=C(C)C(=O)CCc1ccccn1 1458a_100000185857_100015183660 [0,1,0,0,0,2|1,0,0]=4 15265 B13R1.351 C=C(C)C(=O)CCc1cccnc1 1458a_100000185857_200011713674 [0,1,0,0,0,2|1,0,0]=4 15266 B13R1.351 C=C(C)C(=O)CCc1ccncc1 1458a_100000185857_100000723409 [0,1,0,0,0,2|1,0,0]=4 15267 B13R1.351 C=C(C)C(=O)NCc1ccccc1 11a_100015324214_100000185857 [0,1,0,0,0,2|0,0,0]=3 15268 B13R1.351 C=C(C)C(=O)NCc1ccccc1 1626a_100015324214_100000185857 [0,1,0,0,0,2|0,0,0]=3 15269 B13R1.351 C=C(C)C(=O)NCc1ccccn1 11a_100000210449_100000185857 [0,1,0,0,0,2|1,0,0]=4 15270 B13R1.351 C=C(C)C(=O)NCc1ccccn1 1626a_100000210449_100000185857 [0,1,0,0,0,2|1,0,0]=4 15271 B13R1.351 C=C(C)C(=O)NCc1cccnc1 11a_100000210453_100000185857 [0,1,0,0,0,2|1,0,0]=4 15272 B13R1.351 C=C(C)C(=O)NCc1ccncc1 11a_100000210450_100000185857 [0,1,0,0,0,2|1,0,0]=4 15273 B13R1.351 C=C(C)C(=O)NCc1ccncc1 1626a_100000210450_100000185857 [0,1,0,0,0,2|1,0,0]=4 15274 B13R1.351 C=C(C)C(=O)NNc1ccccc1 22a_100015195140_100000185857 [0,1,0,0,0,2|0,0,1]=4 15275 B13R1.351 C=C(C)C(C)NCc1ccccc1 269862a_100015324214_100011216138 [0,1,0,0,0,2|0,0,0]=3 15276 B13R1.351 C=C(C)C(C)NCc1cccnc1 269862a_100000210453_100011216138 [0,1,0,0,0,2|1,0,0]=4 15277 B13R1.351 C=C(C)C(C)NCc1ccncc1 269862a_100000210450_100011216138 [0,1,0,0,0,2|1,0,0]=4 15278 B13R1.351 C=C(Cl)C(=O)NCc1ccccc1 11a_100015324214_100000039160 [0,1,0,0,0,2|1,0,0]=4 15279 B13R1.351 C=C(Cl)C(=O)NCc1ccccc1 1626a_100015324214_100000039160 [0,1,0,0,0,2|1,0,0]=4 15280 B13R1.351 C=C(F)C(=O)NCc1ccccc1 11a_100015324214_100000036797 [0,1,0,0,0,2|1,0,0]=4 15281 B13R1.351 C=C(F)C(=O)NCc1ccccc1 1626a_100015324214_100000036797 [0,1,0,0,0,2|1,0,0]=4 15282 B13R1.351 CC(=O)C(=O)CNc1ccccc1 34a_100000106764_100011261029 [0,1,0,0,0,2|1,0,0]=4 15283 B13R1.351 CC(=O)C(=O)COc1ccccc1 34a_100000210340_100011261029 [0,1,0,0,0,2|1,0,0]=4 15284 B13R1.351 CC(=O)C(=O)CSc1ccccc1 62a_100000719477_100011261029 [0,1,0,0,0,2|1,0,0]=4 15285 B13R1.351 CC(=O)C(=O)CSc1ccccc1 62a_100011261029_100000041952 [0,1,0,0,0,2|1,0,0]=4 15286 B13R1.351 CC(=O)C(C)CCc1ccccc1 1458a_100011435293_200000210301 [0,1,0,0,0,2|1,0,0]=4 15287 B13R1.351 CC(=O)C(C)NCc1ccccc1 2230a_100015324214_100009814033 [0,1,0,0,0,2|1,0,0]=4 15288 B13R1.351 CC(=O)C(C)OCc1ccccc1 34a_100000212229_100015291786 [0,1,0,0,0,2|1,0,0]=4 15289 B13R1.351 CC(=O)C(C)OCc1ccccc1 7a_100000210790_100000179758 [0,1,0,0,0,2|1,0,0]=4 15290 B13R1.351 CC(=O)C(C)SCc1ccccc1 1458a_100000149570_200000210301 [0,1,0,0,0,2|1,0,0]=4 15291 B13R1.351 CC(=O)C(C)SCc1ccccc1 62a_100000211182_100009814033 [0,1,0,0,0,2|1,0,0]=4 15292 B13R1.351 CC(=O)C(C)SCc1ccccc1 62a_100009814033_100015291786 [0,1,0,0,0,2|1,0,0]=4 15293 B13R1.351 CC(=O)C(O)CCc1ccccc1 1458a_100000242596_200000210301 [0,1,0,0,0,2|1,0,0]=4 15294 B13R1.351 CC(=O)N(C)CCc1ccccc1 11a_100000207497_100015343762 [0,1,0,0,0,2|1,0,0]=4 15295 B13R1.351 CC(=O)N(C)CCc1ccccc1 1626a_100000207497_100015343762 [0,1,0,0,0,2|1,0,0]=4 15296 B13R1.351 CC(=O)N(C)CCc1ccccc1 240690a_100000207497_100015343762 [0,1,0,0,0,2|1,0,0]=4 15297 B13R1.351 CC(=O)N(C)CCc1ccccc1 527a_100000207497_100103153847 [0,1,0,0,0,2|1,0,0]=4 15298 B13R1.351 CC(=O)[C@H](C)OCc1ccccc1 1458a_100000703211_200000210301 [0,1,0,0,0,2|1,0,0]=4 15299 B13R1.351 CC(CCc1ccccc1)C(=O)[13CH3] 1458a_100011435293_200025704644 [0,1,0,0,0,2|1,0,0]=4 15300 B13R1.351 CC(SCc1ccccc1)C(=O)[13CH3] 1458a_100000149570_200025704644 [0,1,0,0,0,2|1,0,0]=4 15301 B13R1.351 C[C@H](OCc1ccccc1)C(=O)[13CH3] 1458a_100000703211_200025704644 [0,1,0,0,0,2|1,0,0]=4 15302 B13R1.351 [13CH3]C(=O)C(O)CCc1ccccc1 1458a_100000242596_200025704644 [0,1,0,0,0,2|1,0,0]=4 15303 B13R1.513 C=C(C)C=NNc1ccc(cc1)Br 4a_100000735608_100000210575 [0,1,0,0,0,2|0,0,1]=4 15304 B13R1.513 C=C(C)C=NNc1ccc(cc1)C 4a_100000683527_100000210575 [0,1,0,0,0,2|0,0,1]=4 15305 B13R1.513 C=C(C)C=NNc1ccc(cc1)Cl 4a_100000683521_100000210575 [0,1,0,0,0,2|0,0,1]=4 15306 B13R1.513 C=C(C)C=NNc1ccc(cc1)F 4a_100000728448_100000210575 [0,1,0,0,0,2|0,0,1]=4 15307 B13R1.513 C=C(C)C=NNc1ccc(cc1)I 4a_100016988836_100000210575 [0,1,0,0,0,2|0,0,1]=4 15308 B13R1.513 C=C(C)CCNc1ccc(cc1)Br 2230a_100000210018_100000730704 [0,1,0,0,0,2|0,0,0]=3 15309 B13R1.513 C=C(C)CCNc1ccc(cc1)Br 34a_100000210018_100000730704 [0,1,0,0,0,2|0,0,0]=3 15310 B13R1.513 C=C(C)CCNc1ccc(cc1)C 34a_100000124888_100000730704 [0,1,0,0,0,2|0,0,0]=3 15311 B13R1.513 C=C(C)CCNc1ccc(cc1)Cl 2230a_100000210052_100000730704 [0,1,0,0,0,2|0,0,0]=3 15312 B13R1.513 C=C(C)CCNc1ccc(cc1)Cl 34a_100000210052_100000730704 [0,1,0,0,0,2|0,0,0]=3 15313 B13R1.513 C=C(C)CCNc1ccc(cc1)F 34a_100000185862_100000730704 [0,1,0,0,0,2|0,0,0]=3 15314 B13R1.513 C=C(C)CCNc1ccc(cc1)I 34a_100000185761_100000730704 [0,1,0,0,0,2|0,0,0]=3 15315 B13R1.513 C=C(C)CCNc1ccc(cc1)O 34a_100000185829_100000730704 [0,1,0,0,0,2|0,0,0]=3 15316 B13R1.513 C=C(C)CCOc1ccc(=O)[nH]c1 34a_100000075641_100000730704 [0,1,0,0,0,2|1,0,0]=4 15317 B13R1.513 C=C(C)CCOc1ccc(cc1)Br 34a_100000185759_100000730704 [0,1,0,0,0,2|0,0,0]=3 15318 B13R1.513 C=C(C)CCOc1ccc(cc1)Br 7a_100000185759_100000730704 [0,1,0,0,0,2|0,0,0]=3 15319 B13R1.513 C=C(C)CCOc1ccc(cc1)C 34a_100000210336_100000730704 [0,1,0,0,0,2|0,0,0]=3 15320 B13R1.513 C=C(C)CCOc1ccc(cc1)C 7a_100000210336_100000730704 [0,1,0,0,0,2|0,0,0]=3 15321 B13R1.513 C=C(C)CCOc1ccc(cc1)Cl 34a_100000210216_100000730704 [0,1,0,0,0,2|0,0,0]=3 15322 B13R1.513 C=C(C)CCOc1ccc(cc1)Cl 7a_100000210216_100000730704 [0,1,0,0,0,2|0,0,0]=3 15323 B13R1.513 C=C(C)CCOc1ccc(cc1)F 34a_100000210339_100000730704 [0,1,0,0,0,2|0,0,0]=3 15324 B13R1.513 C=C(C)CCOc1ccc(cc1)I 34a_100000212066_100000730704 [0,1,0,0,0,2|0,0,0]=3 15325 B13R1.513 C=C(C)CCOc1ccc(cc1)I 7a_100000212066_100000730704 [0,1,0,0,0,2|0,0,0]=3 15326 B13R1.513 C=C(C)CCOc1ccc(cc1)N 34a_100000185829_100000730704 [0,1,0,0,0,2|0,0,0]=3 15327 B13R1.513 C=C(C)CCOc1ccc(cn1)C 34a_100000759353_100000730704 [0,1,0,0,0,2|1,0,0]=4 15328 B13R1.513 C=C(C)CCOc1ccc(cn1)Cl 34a_100011215309_100000730704 [0,1,0,0,0,2|1,0,0]=4 15329 B13R1.513 C=C(C)CCOc1ccc(cn1)F 34a_100000742473_100000730704 [0,1,0,0,0,2|1,0,0]=4 15330 B13R1.513 C=C(C)CCOc1ccc(cn1)N 34a_100000729260_100000730704 [0,1,0,0,0,2|1,0,0]=4 15331 B13R1.513 C=C(C)CCOc1ccc(nc1)Br 34a_100000685995_100000730704 [0,1,0,0,0,2|1,0,0]=4 15332 B13R1.513 C=C(C)CCOc1ccc(nc1)Br 7a_100000685995_100000730704 [0,1,0,0,0,2|1,0,0]=4 15333 B13R1.513 C=C(C)CCOc1ccc(nc1)C 34a_100000745506_100000730704 [0,1,0,0,0,2|1,0,0]=4 15334 B13R1.513 C=C(C)CCOc1ccc(nc1)C 7a_100000745506_100000730704 [0,1,0,0,0,2|1,0,0]=4 15335 B13R1.513 C=C(C)CCOc1ccc(nc1)Cl 34a_100000744096_100000730704 [0,1,0,0,0,2|1,0,0]=4 15336 B13R1.513 C=C(C)CCOc1ccc(nc1)Cl 7a_100000744096_100000730704 [0,1,0,0,0,2|1,0,0]=4 15337 B13R1.513 C=C(C)CCOc1ccc(nc1)F 34a_100000688820_100000730704 [0,1,0,0,0,2|1,0,0]=4 15338 B13R1.513 C=C(C)CCOc1ccc(nc1)F 7a_100000688820_100000730704 [0,1,0,0,0,2|1,0,0]=4 15339 B13R1.513 C=C(C)CCOc1ccc(nc1)I 34a_100000687607_100000730704 [0,1,0,0,0,2|1,0,0]=4 15340 B13R1.513 C=C(C)CCOc1ccc(nc1)I 7a_100000687607_100000730704 [0,1,0,0,0,2|1,0,0]=4 15341 B13R1.513 C=C(C)CCOc1ccc(nc1)N 34a_100015188713_100000730704 [0,1,0,0,0,2|1,0,0]=4 15342 B13R1.513 C=C(C)CCOc1ccc(nc1)N 7a_100015188713_100000730704 [0,1,0,0,0,2|1,0,0]=4 15343 B13R1.513 C=C(C)CCSc1cc[n+](cc1)[O-] 62a_100000730704_100000039755 [0,1,0,0,0,2|1,0,0]=4 15344 B13R1.513 C=C(C)CCSc1ccc(=O)[nH]c1 62a_100000212171_100000730704 [0,1,0,0,0,2|1,0,0]=4 15345 B13R1.513 C=C(C)CCSc1ccc(=O)[nH]c1 62a_100000730704_100000212171 [0,1,0,0,0,2|1,0,0]=4 15346 B13R1.513 C=C(C)CCSc1ccc(cc1)Br 62a_100000730704_100000752885 [0,1,0,0,0,2|0,0,0]=3 15347 B13R1.513 C=C(C)CCSc1ccc(cc1)Br 62a_100000752885_100000730704 [0,1,0,0,0,2|0,0,0]=3 15348 B13R1.513 C=C(C)CCSc1ccc(cc1)C 62a_100000186775_100000730704 [0,1,0,0,0,2|0,0,0]=3 15349 B13R1.513 C=C(C)CCSc1ccc(cc1)C 62a_100000730704_100000186775 [0,1,0,0,0,2|0,0,0]=3 15350 B13R1.513 C=C(C)CCSc1ccc(cc1)Cl 62a_100000730704_100000755918 [0,1,0,0,0,2|0,0,0]=3 15351 B13R1.513 C=C(C)CCSc1ccc(cc1)Cl 62a_100000755918_100000730704 [0,1,0,0,0,2|0,0,0]=3 15352 B13R1.513 C=C(C)CCSc1ccc(cc1)F 62a_100000211213_100000730704 [0,1,0,0,0,2|0,0,0]=3 15353 B13R1.513 C=C(C)CCSc1ccc(cc1)F 62a_100000730704_100000211213 [0,1,0,0,0,2|0,0,0]=3 15354 B13R1.513 C=C(C)CCSc1ccc(cc1)N 62a_100000185761_100000730704 [0,1,0,0,0,2|0,0,0]=3 15355 B13R1.513 C=C(C)CCSc1ccc(cc1)N 62a_100000730704_100000185761 [0,1,0,0,0,2|0,0,0]=3 15356 B13R1.513 C=C(C)CCSc1ccc(cc1)O 62a_100000730704_100000185759 [0,1,0,0,0,2|0,0,0]=3 15357 B13R1.513 C=C(C)CCSc1ccc(cn1)Br 62a_100000686858_100000730704 [0,1,0,0,0,2|1,0,0]=4 15358 B13R1.513 C=C(C)CCSc1ccc(cn1)Br 62a_100000730704_100000686858 [0,1,0,0,0,2|1,0,0]=4 15359 B13R1.513 C=C(C)CCSc1ccc(cn1)C 62a_100000730704_100000754016 [0,1,0,0,0,2|1,0,0]=4 15360 B13R1.513 C=C(C)CCSc1ccc(cn1)C 62a_100011192072_100000730704 [0,1,0,0,0,2|1,0,0]=4 15361 B13R1.513 C=C(C)CCSc1ccc(cn1)Cl 62a_100000730704_100011356976 [0,1,0,0,0,2|1,0,0]=4 15362 B13R1.513 C=C(C)CCSc1ccc(cn1)Cl 62a_100011356976_100000730704 [0,1,0,0,0,2|1,0,0]=4 15363 B13R1.513 C=C(C)CCSc1ccc(cn1)F 62a_100000730704_100000744514 [0,1,0,0,0,2|1,0,0]=4 15364 B13R1.513 C=C(C)CCSc1ccc(cn1)F 62a_100000744514_100000730704 [0,1,0,0,0,2|1,0,0]=4 15365 B13R1.513 C=C(C)CCSc1ccc(cn1)N 62a_100000730704_100000737798 [0,1,0,0,0,2|1,0,0]=4 15366 B13R1.513 C=C(C)CCSc1ccc(cn1)N 62a_100000737798_100000730704 [0,1,0,0,0,2|1,0,0]=4 15367 B13R1.513 C=C(C)CCSc1ccc(cn1)O 62a_100000685995_100000730704 [0,1,0,0,0,2|1,0,0]=4 15368 B13R1.513 C=C(C)CCSc1ccc(cn1)O 62a_100000730704_100000744096 [0,1,0,0,0,2|1,0,0]=4 15369 B13R1.513 C=C(C)CCSc1ccc(nc1)Br 62a_100000730704_100009814638 [0,1,0,0,0,2|1,0,0]=4 15370 B13R1.513 C=C(C)CCSc1ccc(nc1)Br 62a_100009814638_100000730704 [0,1,0,0,0,2|1,0,0]=4 15371 B13R1.513 C=C(C)CCSc1ccc(nc1)C 62a_100000730704_100000751577 [0,1,0,0,0,2|1,0,0]=4 15372 B13R1.513 C=C(C)CCSc1ccc(nc1)C 62a_100000751577_100000730704 [0,1,0,0,0,2|1,0,0]=4 15373 B13R1.513 C=C(C)CCSc1ccc(nc1)Cl 62a_100000034144_100000730704 [0,1,0,0,0,2|1,0,0]=4 15374 B13R1.513 C=C(C)CCSc1ccc(nc1)Cl 62a_100000730704_100000034144 [0,1,0,0,0,2|1,0,0]=4 15375 B13R1.513 C=C(C)CCSc1ccc(nc1)F 62a_100000042367_100000730704 [0,1,0,0,0,2|1,0,0]=4 15376 B13R1.513 C=C(C)CCSc1ccc(nc1)F 62a_100000730704_100000042367 [0,1,0,0,0,2|1,0,0]=4 15377 B13R1.513 C=C(C)CCSc1ccc(nc1)N 62a_100000187370_100000730704 [0,1,0,0,0,2|1,0,0]=4 15378 B13R1.513 C=C(C)CCSc1ccc(nc1)N 62a_100000730704_100000187370 [0,1,0,0,0,2|1,0,0]=4 15379 B13R1.513 C=C(C)CNCc1ccc(cc1)Br 2230a_100000174875_100000748629 [0,1,0,0,0,2|0,0,0]=3 15380 B13R1.513 C=C(C)CNCc1ccc(cc1)Br 34a_100000174875_100000748629 [0,1,0,0,0,2|0,0,0]=3 15381 B13R1.513 C=C(C)CNCc1ccc(cc1)C 2230a_100000174908_100000748629 [0,1,0,0,0,2|0,0,0]=3 15382 B13R1.513 C=C(C)CNCc1ccc(cc1)C 34a_100000174908_100000748629 [0,1,0,0,0,2|0,0,0]=3 15383 B13R1.513 C=C(C)CNCc1ccc(cc1)Cl 2230a_100000174871_100000748629 [0,1,0,0,0,2|0,0,0]=3 15384 B13R1.513 C=C(C)CNCc1ccc(cc1)Cl 34a_100000174871_100000748629 [0,1,0,0,0,2|0,0,0]=3 15385 B13R1.513 C=C(C)CNCc1ccc(cc1)F 2230a_100000174882_100000748629 [0,1,0,0,0,2|0,0,0]=3 15386 B13R1.513 C=C(C)CNCc1ccc(cc1)F 34a_100000174882_100000748629 [0,1,0,0,0,2|0,0,0]=3 15387 B13R1.513 C=C(C)CNCc1ccc(cc1)I 2230a_100016989417_100000748629 [0,1,0,0,0,2|0,0,0]=3 15388 B13R1.513 C=C(C)CNCc1ccc(cc1)I 34a_100016989417_100000748629 [0,1,0,0,0,2|0,0,0]=3 15389 B13R1.513 C=C(C)CNCc1ccc(cc1)O 34a_100000185549_100000748629 [0,1,0,0,0,2|0,0,0]=3 15390 B13R1.513 C=C(C)CNCc1ccc(cn1)Br 34a_100015188789_100000748629 [0,1,0,0,0,2|1,0,0]=4 15391 B13R1.513 C=C(C)CNCc1ccc(cn1)C 34a_100015187455_100000748629 [0,1,0,0,0,2|1,0,0]=4 15392 B13R1.513 C=C(C)CNCc1ccc(cn1)Cl 34a_100000697193_100000748629 [0,1,0,0,0,2|1,0,0]=4 15393 B13R1.513 C=C(C)CNCc1ccc(cn1)F 34a_100020620131_100000748629 [0,1,0,0,0,2|1,0,0]=4 15394 B13R1.513 C=C(C)CNCc1ccc(nc1)Br 2230a_100009817727_100000748629 [0,1,0,0,0,2|1,0,0]=4 15395 B13R1.513 C=C(C)CNCc1ccc(nc1)Br 34a_100009817727_100000748629 [0,1,0,0,0,2|1,0,0]=4 15396 B13R1.513 C=C(C)CNCc1ccc(nc1)C 34a_100000740942_100000748629 [0,1,0,0,0,2|1,0,0]=4 15397 B13R1.513 C=C(C)CNCc1ccc(nc1)Cl 2230a_100000735879_100000748629 [0,1,0,0,0,2|1,0,0]=4 15398 B13R1.513 C=C(C)CNCc1ccc(nc1)Cl 34a_100000735879_100000748629 [0,1,0,0,0,2|1,0,0]=4 15399 B13R1.513 C=C(C)CNCc1ccc(nc1)F 2230a_100000101913_100000748629 [0,1,0,0,0,2|1,0,0]=4 15400 B13R1.513 C=C(C)CNCc1ccc(nc1)F 34a_100000101913_100000748629 [0,1,0,0,0,2|1,0,0]=4 15401 B13R1.513 C=C(C)CNCc1ccc(nc1)O 2230a_100000757128_100000748629 [0,1,0,0,0,2|1,0,0]=4 15402 B13R1.513 C=C(C)COCc1cc[n+](cc1)C 34a_100009831711_100000748629 [0,1,0,0,0,2|1,0,0]=4 15403 B13R1.513 C=C(C)COCc1cc[n+](cc1)[O-] 34a_100000031831_100000748629 [0,1,0,0,0,2|1,0,0]=4 15404 B13R1.513 C=C(C)COCc1cc[n+](cc1)[O-] 7a_100000031831_100000748629 [0,1,0,0,0,2|1,0,0]=4 15405 B13R1.513 C=C(C)COCc1ccc(=O)[nH]c1 34a_100011999846_100000748629 [0,1,0,0,0,2|1,0,0]=4 15406 B13R1.513 C=C(C)COCc1ccc(cc1)Br 34a_100000210245_100000189115 [0,1,0,0,0,2|0,0,0]=3 15407 B13R1.513 C=C(C)COCc1ccc(cc1)Br 34a_100000695286_100000748629 [0,1,0,0,0,2|0,0,0]=3 15408 B13R1.513 C=C(C)COCc1ccc(cc1)C 34a_100000210245_100000210814 [0,1,0,0,0,2|0,0,0]=3 15409 B13R1.513 C=C(C)COCc1ccc(cc1)C 34a_100011215236_100000748629 [0,1,0,0,0,2|0,0,0]=3 15410 B13R1.513 C=C(C)COCc1ccc(cc1)C 7a_100011215236_100000748629 [0,1,0,0,0,2|0,0,0]=3 15411 B13R1.513 C=C(C)COCc1ccc(cc1)Cl 34a_100000210245_100000694040 [0,1,0,0,0,2|0,0,0]=3 15412 B13R1.513 C=C(C)COCc1ccc(cc1)Cl 34a_100000211118_100000748629 [0,1,0,0,0,2|0,0,0]=3 15413 B13R1.513 C=C(C)COCc1ccc(cc1)Cl 7a_100000211118_100000748629 [0,1,0,0,0,2|0,0,0]=3 15414 B13R1.513 C=C(C)COCc1ccc(cc1)F 34a_100000210245_100000198546 [0,1,0,0,0,2|0,0,0]=3 15415 B13R1.513 C=C(C)COCc1ccc(cc1)F 34a_100000210977_100000748629 [0,1,0,0,0,2|0,0,0]=3 15416 B13R1.513 C=C(C)COCc1ccc(cc1)F 7a_100000210977_100000748629 [0,1,0,0,0,2|0,0,0]=3 15417 B13R1.513 C=C(C)COCc1ccc(cc1)I 34a_100000210245_100000189116 [0,1,0,0,0,2|0,0,0]=3 15418 B13R1.513 C=C(C)COCc1ccc(cc1)I 34a_100000690907_100000748629 [0,1,0,0,0,2|0,0,0]=3 15419 B13R1.513 C=C(C)COCc1ccc(cc1)I 7a_100000690907_100000748629 [0,1,0,0,0,2|0,0,0]=3 15420 B13R1.513 C=C(C)COCc1ccc(cc1)N 34a_100011215238_100000748629 [0,1,0,0,0,2|0,0,0]=3 15421 B13R1.513 C=C(C)COCc1ccc(cn1)Br 34a_100000210245_100000702658 [0,1,0,0,0,2|1,0,0]=4 15422 B13R1.513 C=C(C)COCc1ccc(cn1)Br 34a_100000754261_100000748629 [0,1,0,0,0,2|1,0,0]=4 15423 B13R1.513 C=C(C)COCc1ccc(cn1)C 34a_100000210245_100000691093 [0,1,0,0,0,2|1,0,0]=4 15424 B13R1.513 C=C(C)COCc1ccc(cn1)C 34a_100012001401_100000748629 [0,1,0,0,0,2|1,0,0]=4 15425 B13R1.513 C=C(C)COCc1ccc(cn1)Cl 34a_100000210245_100012066911 [0,1,0,0,0,2|1,0,0]=4 15426 B13R1.513 C=C(C)COCc1ccc(cn1)Cl 34a_100000703999_100000748629 [0,1,0,0,0,2|1,0,0]=4 15427 B13R1.513 C=C(C)COCc1ccc(cn1)F 34a_100000210245_100000703193 [0,1,0,0,0,2|1,0,0]=4 15428 B13R1.513 C=C(C)COCc1ccc(cn1)F 34a_100011999454_100000748629 [0,1,0,0,0,2|1,0,0]=4 15429 B13R1.513 C=C(C)COCc1ccc(cn1)N 34a_100011998161_100000748629 [0,1,0,0,0,2|1,0,0]=4 15430 B13R1.513 C=C(C)COCc1ccc(nc1)Br 34a_100000210245_100009831999 [0,1,0,0,0,2|1,0,0]=4 15431 B13R1.513 C=C(C)COCc1ccc(nc1)Br 34a_100009816760_100000748629 [0,1,0,0,0,2|1,0,0]=4 15432 B13R1.513 C=C(C)COCc1ccc(nc1)Br 7a_100009816760_100000748629 [0,1,0,0,0,2|1,0,0]=4 15433 B13R1.513 C=C(C)COCc1ccc(nc1)C 34a_100000210245_100016987292 [0,1,0,0,0,2|1,0,0]=4 15434 B13R1.513 C=C(C)COCc1ccc(nc1)C 34a_100011248133_100000748629 [0,1,0,0,0,2|1,0,0]=4 15435 B13R1.513 C=C(C)COCc1ccc(nc1)Cl 34a_100000210245_100000735431 [0,1,0,0,0,2|1,0,0]=4 15436 B13R1.513 C=C(C)COCc1ccc(nc1)Cl 34a_100000755211_100000748629 [0,1,0,0,0,2|1,0,0]=4 15437 B13R1.513 C=C(C)COCc1ccc(nc1)Cl 7a_100000755211_100000748629 [0,1,0,0,0,2|1,0,0]=4 15438 B13R1.513 C=C(C)COCc1ccc(nc1)F 34a_100000079959_100000748629 [0,1,0,0,0,2|1,0,0]=4 15439 B13R1.513 C=C(C)COCc1ccc(nc1)F 34a_100000210245_100000099788 [0,1,0,0,0,2|1,0,0]=4 15440 B13R1.513 C=C(C)COCc1ccc(nc1)N 34a_100000704267_100000748629 [0,1,0,0,0,2|1,0,0]=4 15441 B13R1.513 C=C(C)CSCc1ccc(cc1)Br 62a_100000189115_100000211660 [0,1,0,0,0,2|0,0,0]=3 15442 B13R1.513 C=C(C)CSCc1ccc(cc1)Br 62a_100000748629_100000189115 [0,1,0,0,0,2|0,0,0]=3 15443 B13R1.513 C=C(C)CSCc1ccc(cc1)C 62a_100000210814_100000211660 [0,1,0,0,0,2|0,0,0]=3 15444 B13R1.513 C=C(C)CSCc1ccc(cc1)C 62a_100000748629_100000210814 [0,1,0,0,0,2|0,0,0]=3 15445 B13R1.513 C=C(C)CSCc1ccc(cc1)Cl 62a_100000187161_100000211660 [0,1,0,0,0,2|0,0,0]=3 15446 B13R1.513 C=C(C)CSCc1ccc(cc1)Cl 62a_100000748629_100000187161 [0,1,0,0,0,2|0,0,0]=3 15447 B13R1.513 C=C(C)CSCc1ccc(cc1)F 62a_100000198546_100000211660 [0,1,0,0,0,2|0,0,0]=3 15448 B13R1.513 C=C(C)CSCc1ccc(cc1)F 62a_100000748629_100000187164 [0,1,0,0,0,2|0,0,0]=3 15449 B13R1.513 C=C(C)CSCc1ccc(cc1)I 62a_100000189116_100000211660 [0,1,0,0,0,2|0,0,0]=3 15450 B13R1.513 C=C(C)CSCc1ccc(cc1)I 62a_100000748629_100000189116 [0,1,0,0,0,2|0,0,0]=3 15451 B13R1.513 C=C(C)CSCc1ccc(cn1)Br 62a_100000702658_100000211660 [0,1,0,0,0,2|1,0,0]=4 15452 B13R1.513 C=C(C)CSCc1ccc(cn1)Br 62a_100000748629_100000702658 [0,1,0,0,0,2|1,0,0]=4 15453 B13R1.513 C=C(C)CSCc1ccc(cn1)C 62a_100000691093_100000211660 [0,1,0,0,0,2|1,0,0]=4 15454 B13R1.513 C=C(C)CSCc1ccc(cn1)C 62a_100000748629_100000691093 [0,1,0,0,0,2|1,0,0]=4 15455 B13R1.513 C=C(C)CSCc1ccc(cn1)Cl 62a_100000748629_100000697101 [0,1,0,0,0,2|1,0,0]=4 15456 B13R1.513 C=C(C)CSCc1ccc(cn1)Cl 62a_100012066911_100000211660 [0,1,0,0,0,2|1,0,0]=4 15457 B13R1.513 C=C(C)CSCc1ccc(cn1)F 62a_100000703193_100000211660 [0,1,0,0,0,2|1,0,0]=4 15458 B13R1.513 C=C(C)CSCc1ccc(cn1)F 62a_100000748629_100000703193 [0,1,0,0,0,2|1,0,0]=4 15459 B13R1.513 C=C(C)CSCc1ccc(nc1)Br 62a_100000748629_100009831999 [0,1,0,0,0,2|1,0,0]=4 15460 B13R1.513 C=C(C)CSCc1ccc(nc1)Br 62a_100009831999_100000211660 [0,1,0,0,0,2|1,0,0]=4 15461 B13R1.513 C=C(C)CSCc1ccc(nc1)C 62a_100000748629_100016987292 [0,1,0,0,0,2|1,0,0]=4 15462 B13R1.513 C=C(C)CSCc1ccc(nc1)C 62a_100016987292_100000211660 [0,1,0,0,0,2|1,0,0]=4 15463 B13R1.513 C=C(C)CSCc1ccc(nc1)Cl 62a_100000735431_100000211660 [0,1,0,0,0,2|1,0,0]=4 15464 B13R1.513 C=C(C)CSCc1ccc(nc1)Cl 62a_100000748629_100000735431 [0,1,0,0,0,2|1,0,0]=4 15465 B13R1.513 C=C(C)CSCc1ccc(nc1)F 62a_100000748629_100000099788 [0,1,0,0,0,2|1,0,0]=4 15466 B13R1.513 C=C(C)CSCc1ccc(nc1)F 62a_100009820150_100000211660 [0,1,0,0,0,2|1,0,0]=4 15467 B13R1.513 C=C(F)CNCc1ccc(cc1)Br 2230a_100000174875_100009893438 [0,1,0,0,0,2|1,0,0]=4 15468 B13R1.513 C=C(F)CNCc1ccc(cc1)Br 34a_100000174875_100009893438 [0,1,0,0,0,2|1,0,0]=4 15469 B13R1.513 C=C(F)CNCc1ccc(cc1)C 2230a_100000174908_100009893438 [0,1,0,0,0,2|1,0,0]=4 15470 B13R1.513 C=C(F)CNCc1ccc(cc1)C 34a_100000174908_100009893438 [0,1,0,0,0,2|1,0,0]=4 15471 B13R1.513 C=C(F)CNCc1ccc(cc1)Cl 2230a_100000174871_100009893438 [0,1,0,0,0,2|1,0,0]=4 15472 B13R1.513 C=C(F)CNCc1ccc(cc1)Cl 34a_100000174871_100009893438 [0,1,0,0,0,2|1,0,0]=4 15473 B13R1.513 C=C(F)CNCc1ccc(cc1)F 2230a_100000174882_100009893438 [0,1,0,0,0,2|1,0,0]=4 15474 B13R1.513 C=C(F)CNCc1ccc(cc1)F 34a_100000174882_100009893438 [0,1,0,0,0,2|1,0,0]=4 15475 B13R1.513 C=C(F)CNCc1ccc(cc1)I 2230a_100016989417_100009893438 [0,1,0,0,0,2|1,0,0]=4 15476 B13R1.513 C=C(F)CNCc1ccc(cc1)I 34a_100016989417_100009893438 [0,1,0,0,0,2|1,0,0]=4 15477 B13R1.513 C=C(F)CNCc1ccc(cc1)O 34a_100000185549_100009893438 [0,1,0,0,0,2|1,0,0]=4 15478 B13R1.513 C=C(F)COCc1ccc(cc1)Br 34a_100000695286_100009893438 [0,1,0,0,0,2|1,0,0]=4 15479 B13R1.513 C=C(F)COCc1ccc(cc1)Br 34a_200010262243_100000189115 [0,1,0,0,0,2|1,0,0]=4 15480 B13R1.513 C=C(F)COCc1ccc(cc1)C 34a_100011215236_100009893438 [0,1,0,0,0,2|1,0,0]=4 15481 B13R1.513 C=C(F)COCc1ccc(cc1)C 34a_200010262243_100000210814 [0,1,0,0,0,2|1,0,0]=4 15482 B13R1.513 C=C(F)COCc1ccc(cc1)C 7a_100011215236_100000042424 [0,1,0,0,0,2|1,0,0]=4 15483 B13R1.513 C=C(F)COCc1ccc(cc1)Cl 34a_100000211118_100009893438 [0,1,0,0,0,2|1,0,0]=4 15484 B13R1.513 C=C(F)COCc1ccc(cc1)Cl 34a_200010262243_100000694040 [0,1,0,0,0,2|1,0,0]=4 15485 B13R1.513 C=C(F)COCc1ccc(cc1)Cl 7a_100000211118_100000042424 [0,1,0,0,0,2|1,0,0]=4 15486 B13R1.513 C=C(F)COCc1ccc(cc1)F 34a_100000210977_100009893438 [0,1,0,0,0,2|1,0,0]=4 15487 B13R1.513 C=C(F)COCc1ccc(cc1)F 34a_200010262243_100000198546 [0,1,0,0,0,2|1,0,0]=4 15488 B13R1.513 C=C(F)COCc1ccc(cc1)F 7a_100000210977_100000042424 [0,1,0,0,0,2|1,0,0]=4 15489 B13R1.513 C=C(F)COCc1ccc(cc1)I 34a_100000690907_100009893438 [0,1,0,0,0,2|1,0,0]=4 15490 B13R1.513 C=C(F)COCc1ccc(cc1)I 34a_200010262243_100000189116 [0,1,0,0,0,2|1,0,0]=4 15491 B13R1.513 C=C(F)COCc1ccc(cc1)I 7a_100000690907_100000042424 [0,1,0,0,0,2|1,0,0]=4 15492 B13R1.513 C=C(F)COCc1ccc(cc1)N 34a_100011215238_100009893438 [0,1,0,0,0,2|1,0,0]=4 15493 B13R1.513 C=C(F)CSCc1ccc(cc1)Br 62a_100000042424_100000189115 [0,1,0,0,0,2|1,0,0]=4 15494 B13R1.513 C=C(F)CSCc1ccc(cc1)Br 62a_100000189115_100000042424 [0,1,0,0,0,2|1,0,0]=4 15495 B13R1.513 C=C(F)CSCc1ccc(cc1)C 62a_100000042424_100000210814 [0,1,0,0,0,2|1,0,0]=4 15496 B13R1.513 C=C(F)CSCc1ccc(cc1)C 62a_100000210814_100000042424 [0,1,0,0,0,2|1,0,0]=4 15497 B13R1.513 C=C(F)CSCc1ccc(cc1)Cl 62a_100000042424_100000187161 [0,1,0,0,0,2|1,0,0]=4 15498 B13R1.513 C=C(F)CSCc1ccc(cc1)Cl 62a_100000187161_100000042424 [0,1,0,0,0,2|1,0,0]=4 15499 B13R1.513 C=C(F)CSCc1ccc(cc1)F 62a_100000042424_100000187164 [0,1,0,0,0,2|1,0,0]=4 15500 B13R1.513 C=C(F)CSCc1ccc(cc1)F 62a_100000198546_100000042424 [0,1,0,0,0,2|1,0,0]=4 15501 B13R1.513 C=C(F)CSCc1ccc(cc1)I 62a_100000042424_100000189116 [0,1,0,0,0,2|1,0,0]=4 15502 B13R1.513 C=C(F)CSCc1ccc(cc1)I 62a_100000189116_100000042424 [0,1,0,0,0,2|1,0,0]=4 15503 B13R1.513 CC(=CCNc1ccc(cc1)Br)C 2230a_100000210018_100000761012 [0,1,0,0,0,2|0,0,1]=4 15504 B13R1.513 CC(=CCNc1ccc(cc1)Br)C 34a_100000210018_100000761012 [0,1,0,0,0,2|0,0,1]=4 15505 B13R1.513 CC(=CCNc1ccc(cc1)C)C 34a_100000124888_100000761012 [0,1,0,0,0,2|0,0,1]=4 15506 B13R1.513 CC(=CCNc1ccc(cc1)Cl)C 2230a_100000210052_100000761012 [0,1,0,0,0,2|0,0,1]=4 15507 B13R1.513 CC(=CCNc1ccc(cc1)Cl)C 34a_100000210052_100000761012 [0,1,0,0,0,2|0,0,1]=4 15508 B13R1.513 CC(=CCNc1ccc(cc1)F)C 34a_100000185862_100000761012 [0,1,0,0,0,2|0,0,1]=4 15509 B13R1.513 CC(=CCNc1ccc(cc1)I)C 34a_100000185761_100000761012 [0,1,0,0,0,2|0,0,1]=4 15510 B13R1.513 CC(=CCNc1ccc(cc1)O)C 34a_100000185829_100000761012 [0,1,0,0,0,2|0,0,1]=4 15511 B13R1.513 CC(=CCOc1ccc(cc1)Br)C 34a_100000185759_100000761012 [0,1,0,0,0,2|0,0,1]=4 15512 B13R1.513 CC(=CCOc1ccc(cc1)Br)C 7a_100000185759_100000761012 [0,1,0,0,0,2|0,0,1]=4 15513 B13R1.513 CC(=CCOc1ccc(cc1)C)C 34a_100000210336_100000761012 [0,1,0,0,0,2|0,0,1]=4 15514 B13R1.513 CC(=CCOc1ccc(cc1)C)C 7a_100000210336_100000761012 [0,1,0,0,0,2|0,0,1]=4 15515 B13R1.513 CC(=CCOc1ccc(cc1)Cl)C 34a_100000210216_100000761012 [0,1,0,0,0,2|0,0,1]=4 15516 B13R1.513 CC(=CCOc1ccc(cc1)Cl)C 7a_100000210216_100000761012 [0,1,0,0,0,2|0,0,1]=4 15517 B13R1.513 CC(=CCOc1ccc(cc1)F)C 34a_100000210339_100000761012 [0,1,0,0,0,2|0,0,1]=4 15518 B13R1.513 CC(=CCOc1ccc(cc1)I)C 34a_100000212066_100000761012 [0,1,0,0,0,2|0,0,1]=4 15519 B13R1.513 CC(=CCOc1ccc(cc1)I)C 7a_100000212066_100000761012 [0,1,0,0,0,2|0,0,1]=4 15520 B13R1.513 CC(=CCOc1ccc(cc1)N)C 34a_100000185829_100000761012 [0,1,0,0,0,2|0,0,1]=4 15521 B13R1.513 CC(=CCSc1ccc(cc1)Br)C 62a_100000752885_100000761012 [0,1,0,0,0,2|0,0,1]=4 15522 B13R1.513 CC(=CCSc1ccc(cc1)Br)C 62a_100000761012_100000752885 [0,1,0,0,0,2|0,0,1]=4 15523 B13R1.513 CC(=CCSc1ccc(cc1)C)C 62a_100000186775_100000761012 [0,1,0,0,0,2|0,0,1]=4 15524 B13R1.513 CC(=CCSc1ccc(cc1)C)C 62a_100000761012_100000186775 [0,1,0,0,0,2|0,0,1]=4 15525 B13R1.513 CC(=CCSc1ccc(cc1)Cl)C 62a_100000755918_100000761012 [0,1,0,0,0,2|0,0,1]=4 15526 B13R1.513 CC(=CCSc1ccc(cc1)Cl)C 62a_100000761012_100000755918 [0,1,0,0,0,2|0,0,1]=4 15527 B13R1.513 CC(=CCSc1ccc(cc1)F)C 62a_100000211213_100000761012 [0,1,0,0,0,2|0,0,1]=4 15528 B13R1.513 CC(=CCSc1ccc(cc1)F)C 62a_100000761012_100000211213 [0,1,0,0,0,2|0,0,1]=4 15529 B13R1.513 CC(=CCSc1ccc(cc1)N)C 62a_100000185761_100000761012 [0,1,0,0,0,2|0,0,1]=4 15530 B13R1.513 CC(=CCSc1ccc(cc1)N)C 62a_100000761012_100000185761 [0,1,0,0,0,2|0,0,1]=4 15531 B13R1.513 CC(=CCSc1ccc(cc1)O)C 62a_100000761012_100000185759 [0,1,0,0,0,2|0,0,1]=4 15532 B13R1.513 CC(=O)CC#Cc1ccc(cc1)Br 1458a_100000070787_100010706785 [0,1,0,0,0,2|1,0,0]=4 15533 B13R1.513 CC(=O)CC#Cc1ccc(cc1)F 1458a_100000070787_100010402171 [0,1,0,0,0,2|1,0,0]=4 15534 B13R1.513 CC(=O)CCCc1ccc(cc1)Br 1458a_100000070787_100011713682 [0,1,0,0,0,2|1,0,0]=4 15535 B13R1.513 CC(=O)CCCc1ccc(cc1)Br 1458a_100011236545_200000210301 [0,1,0,0,0,2|1,0,0]=4 15536 B13R1.513 CC(=O)CCCc1ccc(cc1)C 1458a_100000741418_200000210301 [0,1,0,0,0,2|1,0,0]=4 15537 B13R1.513 CC(=O)CCCc1ccc(cc1)Cl 1458a_100000070787_100000759440 [0,1,0,0,0,2|1,0,0]=4 15538 B13R1.513 CC(=O)CCCc1ccc(cc1)Cl 1458a_100000741339_200000210301 [0,1,0,0,0,2|1,0,0]=4 15539 B13R1.513 CC(=O)CCCc1ccc(cc1)F 1458a_100000070787_200011713563 [0,1,0,0,0,2|1,0,0]=4 15540 B13R1.513 CC(=O)CCCc1ccc(cc1)F 1458a_100011219804_200000210301 [0,1,0,0,0,2|1,0,0]=4 15541 B13R1.513 CC(=O)CCCc1ccc(cc1)I 1458a_100011236544_200000210301 [0,1,0,0,0,2|1,0,0]=4 15542 B13R1.513 CC(=O)CCCc1ccc(cc1)O 1458a_100000116853_200000210301 [0,1,0,0,0,2|1,0,0]=4 15543 B13R1.513 CC(=O)CCOc1ccc(cc1)Br 1458a_100000070787_100000183278 [0,1,0,0,0,2|1,0,0]=4 15544 B13R1.513 CC(=O)CCOc1ccc(cc1)Br 1458a_100000738328_200000210301 [0,1,0,0,0,2|1,0,0]=4 15545 B13R1.513 CC(=O)CCOc1ccc(cc1)Br 7a_100000185759_100000053229 [0,1,0,0,0,2|1,0,0]=4 15546 B13R1.513 CC(=O)CCOc1ccc(cc1)C 1458a_100000070787_100000183172 [0,1,0,0,0,2|1,0,0]=4 15547 B13R1.513 CC(=O)CCOc1ccc(cc1)C 1458a_100000182323_200000210301 [0,1,0,0,0,2|1,0,0]=4 15548 B13R1.513 CC(=O)CCOc1ccc(cc1)C 7a_100000210336_100000053229 [0,1,0,0,0,2|1,0,0]=4 15549 B13R1.513 CC(=O)CCOc1ccc(cc1)Cl 1458a_100000070787_100000184122 [0,1,0,0,0,2|1,0,0]=4 15550 B13R1.513 CC(=O)CCOc1ccc(cc1)Cl 1458a_100000186438_200000210301 [0,1,0,0,0,2|1,0,0]=4 15551 B13R1.513 CC(=O)CCOc1ccc(cc1)Cl 7a_100000210216_100000053229 [0,1,0,0,0,2|1,0,0]=4 15552 B13R1.513 CC(=O)CCOc1ccc(cc1)F 1458a_100000070787_100000184936 [0,1,0,0,0,2|1,0,0]=4 15553 B13R1.513 CC(=O)CCOc1ccc(cc1)F 1458a_100000737396_200000210301 [0,1,0,0,0,2|1,0,0]=4 15554 B13R1.513 CC(=O)CCOc1ccc(cc1)I 7a_100000212066_100000053229 [0,1,0,0,0,2|1,0,0]=4 15555 B13R1.513 CC(=O)CCSc1ccc(cc1)Br 1458a_100000208627_200000210301 [0,1,0,0,0,2|1,0,0]=4 15556 B13R1.513 CC(=O)CCSc1ccc(cc1)Br 62a_100000053229_100000752885 [0,1,0,0,0,2|1,0,0]=4 15557 B13R1.513 CC(=O)CCSc1ccc(cc1)Br 62a_100000752885_100000053229 [0,1,0,0,0,2|1,0,0]=4 15558 B13R1.513 CC(=O)CCSc1ccc(cc1)C 1458a_100000182377_200000210301 [0,1,0,0,0,2|1,0,0]=4 15559 B13R1.513 CC(=O)CCSc1ccc(cc1)C 62a_100000053229_100000186775 [0,1,0,0,0,2|1,0,0]=4 15560 B13R1.513 CC(=O)CCSc1ccc(cc1)C 62a_100000186775_100000053229 [0,1,0,0,0,2|1,0,0]=4 15561 B13R1.513 CC(=O)CCSc1ccc(cc1)Cl 1458a_100000182369_200000210301 [0,1,0,0,0,2|1,0,0]=4 15562 B13R1.513 CC(=O)CCSc1ccc(cc1)Cl 62a_100000053229_100000755918 [0,1,0,0,0,2|1,0,0]=4 15563 B13R1.513 CC(=O)CCSc1ccc(cc1)Cl 62a_100000755918_100000053229 [0,1,0,0,0,2|1,0,0]=4 15564 B13R1.513 CC(=O)CCSc1ccc(cc1)F 1458a_100000199091_200000210301 [0,1,0,0,0,2|1,0,0]=4 15565 B13R1.513 CC(=O)CCSc1ccc(cc1)F 62a_100000053229_100000211213 [0,1,0,0,0,2|1,0,0]=4 15566 B13R1.513 CC(=O)CCSc1ccc(cc1)F 62a_100000211213_100000053229 [0,1,0,0,0,2|1,0,0]=4 15567 B13R1.513 CC(=O)CCSc1ccc(cc1)N 62a_100000053229_100000185761 [0,1,0,0,0,2|1,0,0]=4 15568 B13R1.513 CC(=O)CCSc1ccc(cc1)N 62a_100000185761_100000053229 [0,1,0,0,0,2|1,0,0]=4 15569 B13R1.513 CC(=O)CCSc1ccc(cc1)O 62a_100000053229_100000185759 [0,1,0,0,0,2|1,0,0]=4 15570 B13R1.513 CC(=O)COCc1ccc(cc1)Br 1458a_200012349173_200000210301 [0,1,0,0,0,2|1,0,0]=4 15571 B13R1.513 CC(=O)COCc1ccc(cc1)Br 34a_100000211253_100000189115 [0,1,0,0,0,2|1,0,0]=4 15572 B13R1.513 CC(=O)COCc1ccc(cc1)C 34a_100000211253_100000210814 [0,1,0,0,0,2|1,0,0]=4 15573 B13R1.513 CC(=O)COCc1ccc(cc1)Cl 34a_100000211253_100000694040 [0,1,0,0,0,2|1,0,0]=4 15574 B13R1.513 CC(=O)COCc1ccc(cc1)F 34a_100000211253_100000198546 [0,1,0,0,0,2|1,0,0]=4 15575 B13R1.513 CC(=O)COCc1ccc(cc1)I 34a_100000211253_100000189116 [0,1,0,0,0,2|1,0,0]=4 15576 B13R1.513 CC(=O)CSCc1ccc(cc1)Br 1458a_100000150267_200000210301 [0,1,0,0,0,2|1,0,0]=4 15577 B13R1.513 CC(=O)CSCc1ccc(cc1)Cl 1458a_100000150262_200000210301 [0,1,0,0,0,2|1,0,0]=4 15578 B13R1.513 CC(=O)CSCc1ccc(cc1)F 1458a_100000150272_200000210301 [0,1,0,0,0,2|1,0,0]=4 15579 B13R1.513 CC(=O)NCCc1ccc(cc1)Br 11a_100000755846_100015343762 [0,1,0,0,0,2|1,0,0]=4 15580 B13R1.513 CC(=O)NCCc1ccc(cc1)Br 1626a_100000755846_100015343762 [0,1,0,0,0,2|1,0,0]=4 15581 B13R1.513 CC(=O)NCCc1ccc(cc1)Br 240690a_100000755846_100015343762 [0,1,0,0,0,2|1,0,0]=4 15582 B13R1.513 CC(=O)NCCc1ccc(cc1)Br 527a_100000755846_100103153847 [0,1,0,0,0,2|1,0,0]=4 15583 B13R1.513 CC(=O)NCCc1ccc(cc1)C 11a_100000705350_100015343762 [0,1,0,0,0,2|1,0,0]=4 15584 B13R1.513 CC(=O)NCCc1ccc(cc1)C 1626a_100000705350_100015343762 [0,1,0,0,0,2|1,0,0]=4 15585 B13R1.513 CC(=O)NCCc1ccc(cc1)C 240690a_100000705350_100015343762 [0,1,0,0,0,2|1,0,0]=4 15586 B13R1.513 CC(=O)NCCc1ccc(cc1)C 527a_100000705350_100103153847 [0,1,0,0,0,2|1,0,0]=4 15587 B13R1.513 CC(=O)NCCc1ccc(cc1)Cl 11a_100000185265_100015343762 [0,1,0,0,0,2|1,0,0]=4 15588 B13R1.513 CC(=O)NCCc1ccc(cc1)Cl 1626a_100000185265_100015343762 [0,1,0,0,0,2|1,0,0]=4 15589 B13R1.513 CC(=O)NCCc1ccc(cc1)Cl 240690a_100000185265_100015343762 [0,1,0,0,0,2|1,0,0]=4 15590 B13R1.513 CC(=O)NCCc1ccc(cc1)Cl 527a_100000185265_100103153847 [0,1,0,0,0,2|1,0,0]=4 15591 B13R1.513 CC(=O)NCCc1ccc(cc1)F 11a_100000199005_100015343762 [0,1,0,0,0,2|1,0,0]=4 15592 B13R1.513 CC(=O)NCCc1ccc(cc1)F 1626a_100000199005_100015343762 [0,1,0,0,0,2|1,0,0]=4 15593 B13R1.513 CC(=O)NCCc1ccc(cc1)F 240690a_100000199005_100015343762 [0,1,0,0,0,2|1,0,0]=4 15594 B13R1.513 CC(=O)NCCc1ccc(cc1)F 527a_100000199005_100103153847 [0,1,0,0,0,2|1,0,0]=4 15595 B13R1.513 CC(=O)NCCc1ccc(cc1)O 240690a_100000743037_100015343762 [0,1,0,0,0,2|1,0,0]=4 15596 B13R1.513 CC(=O)NCCc1ccc(cc1)O 527a_100000743037_100103153847 [0,1,0,0,0,2|1,0,0]=4 15597 B13R1.513 CC(=O)NNCc1ccc(cc1)Br 22a_100016993955_100000070787 [0,1,0,0,0,2|1,0,0]=4 15598 B13R1.513 CC(=O)NNCc1ccc(cc1)C 22a_100011197965_100000070787 [0,1,0,0,0,2|1,0,0]=4 15599 B13R1.513 CC(=O)NNCc1ccc(cc1)Cl 22a_100000689899_100000070787 [0,1,0,0,0,2|1,0,0]=4 15600 B13R1.513 CC(=O)NNCc1ccc(cc1)F 22a_100000689900_100000070787 [0,1,0,0,0,2|1,0,0]=4 15601 B13R1.513 CC(=O)NNCc1ccc(cc1)I 22a_102495363730_100000070787 [0,1,0,0,0,2|1,0,0]=4 15602 B13R1.513 CC(=O)OCCc1ccc(cc1)O 271570a_203496583355_200016374084 [0,1,0,0,0,2|1,0,0]=4 15603 B13R1.513 CC(=O)OCNc1ccc(cc1)Br 34a_100000210018_100009813279 [0,1,0,0,0,2|1,0,0]=4 15604 B13R1.513 CC(=O)OCNc1ccc(cc1)C 34a_100000124888_100009813279 [0,1,0,0,0,2|1,0,0]=4 15605 B13R1.513 CC(=O)OCNc1ccc(cc1)Cl 34a_100000210052_100009813279 [0,1,0,0,0,2|1,0,0]=4 15606 B13R1.513 CC(=O)OCNc1ccc(cc1)F 34a_100000185862_100009813279 [0,1,0,0,0,2|1,0,0]=4 15607 B13R1.513 CC(=O)OCNc1ccc(cc1)I 34a_100000185761_100009813279 [0,1,0,0,0,2|1,0,0]=4 15608 B13R1.513 CC(=O)OCNc1ccc(cc1)O 34a_100000185829_100009813279 [0,1,0,0,0,2|1,0,0]=4 15609 B13R1.513 CC(=O)OCOc1ccc(cc1)Br 34a_100000185759_100009813279 [0,1,0,0,0,2|1,0,0]=4 15610 B13R1.513 CC(=O)OCOc1ccc(cc1)C 34a_100000210336_100009813279 [0,1,0,0,0,2|1,0,0]=4 15611 B13R1.513 CC(=O)OCOc1ccc(cc1)Cl 34a_100000210216_100009813279 [0,1,0,0,0,2|1,0,0]=4 15612 B13R1.513 CC(=O)OCOc1ccc(cc1)F 34a_100000210339_100009813279 [0,1,0,0,0,2|1,0,0]=4 15613 B13R1.513 CC(=O)OCOc1ccc(cc1)I 34a_100000212066_100009813279 [0,1,0,0,0,2|1,0,0]=4 15614 B13R1.513 CC(=O)OCOc1ccc(cc1)N 34a_100000185829_100009813279 [0,1,0,0,0,2|1,0,0]=4 15615 B13R1.513 CC(=O)OCSc1ccc(cc1)Br 62a_100000076356_100000752885 [0,1,0,0,0,2|1,0,0]=4 15616 B13R1.513 CC(=O)OCSc1ccc(cc1)Br 62a_100000752885_100000076356 [0,1,0,0,0,2|1,0,0]=4 15617 B13R1.513 CC(=O)OCSc1ccc(cc1)C 62a_100000076356_100000186775 [0,1,0,0,0,2|1,0,0]=4 15618 B13R1.513 CC(=O)OCSc1ccc(cc1)C 62a_100000186775_100000076356 [0,1,0,0,0,2|1,0,0]=4 15619 B13R1.513 CC(=O)OCSc1ccc(cc1)Cl 62a_100000076356_100000755918 [0,1,0,0,0,2|1,0,0]=4 15620 B13R1.513 CC(=O)OCSc1ccc(cc1)Cl 62a_100000755918_100000076356 [0,1,0,0,0,2|1,0,0]=4 15621 B13R1.513 CC(=O)OCSc1ccc(cc1)F 62a_100000076356_100000211213 [0,1,0,0,0,2|1,0,0]=4 15622 B13R1.513 CC(=O)OCSc1ccc(cc1)F 62a_100000211213_100000076356 [0,1,0,0,0,2|1,0,0]=4 15623 B13R1.513 CC(=O)OCSc1ccc(cc1)N 62a_100000076356_100000185761 [0,1,0,0,0,2|1,0,0]=4 15624 B13R1.513 CC(=O)OCSc1ccc(cc1)N 62a_100000185761_100000076356 [0,1,0,0,0,2|1,0,0]=4 15625 B13R1.513 CC(=O)OCSc1ccc(cc1)O 62a_100000076356_100000185759 [0,1,0,0,0,2|1,0,0]=4 15626 B13R1.513 Cc1ccc(cc1)CCCC(=O)[13CH3] 1458a_100000741418_200025704644 [0,1,0,0,0,2|1,0,0]=4 15627 B13R1.513 Cc1ccc(cc1)OCCC(=O)[13CH3] 1458a_100000182323_200025704644 [0,1,0,0,0,2|1,0,0]=4 15628 B13R1.513 Cc1ccc(cc1)SCCC(=O)[13CH3] 1458a_100000182377_200025704644 [0,1,0,0,0,2|1,0,0]=4 15629 B13R1.513 [13CH3]C(=O)CCCc1ccc(cc1)Br 1458a_100011236545_200025704644 [0,1,0,0,0,2|1,0,0]=4 15630 B13R1.513 [13CH3]C(=O)CCCc1ccc(cc1)Cl 1458a_100000741339_200025704644 [0,1,0,0,0,2|1,0,0]=4 15631 B13R1.513 [13CH3]C(=O)CCCc1ccc(cc1)F 1458a_100011219804_200025704644 [0,1,0,0,0,2|1,0,0]=4 15632 B13R1.513 [13CH3]C(=O)CCCc1ccc(cc1)I 1458a_100011236544_200025704644 [0,1,0,0,0,2|1,0,0]=4 15633 B13R1.513 [13CH3]C(=O)CCCc1ccc(cc1)O 1458a_100000116853_200025704644 [0,1,0,0,0,2|1,0,0]=4 15634 B13R1.513 [13CH3]C(=O)CCOc1ccc(cc1)Br 1458a_100000738328_200025704644 [0,1,0,0,0,2|1,0,0]=4 15635 B13R1.513 [13CH3]C(=O)CCOc1ccc(cc1)Cl 1458a_100000186438_200025704644 [0,1,0,0,0,2|1,0,0]=4 15636 B13R1.513 [13CH3]C(=O)CCOc1ccc(cc1)F 1458a_100000737396_200025704644 [0,1,0,0,0,2|1,0,0]=4 15637 B13R1.513 [13CH3]C(=O)CCSc1ccc(cc1)Br 1458a_100000208627_200025704644 [0,1,0,0,0,2|1,0,0]=4 15638 B13R1.513 [13CH3]C(=O)CCSc1ccc(cc1)Cl 1458a_100000182369_200025704644 [0,1,0,0,0,2|1,0,0]=4 15639 B13R1.513 [13CH3]C(=O)CCSc1ccc(cc1)F 1458a_100000199091_200025704644 [0,1,0,0,0,2|1,0,0]=4 15640 B13R1.513 [13CH3]C(=O)COCc1ccc(cc1)Br 1458a_200012349173_200025704644 [0,1,0,0,0,2|1,0,0]=4 15641 B13R1.513 [13CH3]C(=O)CSCc1ccc(cc1)Br 1458a_100000150267_200025704644 [0,1,0,0,0,2|1,0,0]=4 15642 B13R1.513 [13CH3]C(=O)CSCc1ccc(cc1)Cl 1458a_100000150262_200025704644 [0,1,0,0,0,2|1,0,0]=4 15643 B13R1.513 [13CH3]C(=O)CSCc1ccc(cc1)F 1458a_100000150272_200025704644 [0,1,0,0,0,2|1,0,0]=4 15644 B13R1.718 C#CC(=NNCc1ccccc1)C 4a_100000007032_100000690481 [0,1,0,0,0,2|0,0,1]=4 15645 B13R1.718 C/C(=C/N)/C=NNc1ccccc1 4a_100015195140_100050415766 [0,1,0,0,0,2|0,0,1]=4 15646 B13R1.718 C/C=C(\C)/C=NNc1ccccc1 4a_100015195140_100020587592 [0,1,0,0,0,2|0,0,1]=4 15647 B13R1.718 C=C(C#N)CNCc1ccccc1 2230a_100015324214_100000694840 [0,1,0,0,0,2|0,0,1]=4 15648 B13R1.718 C=C(C#N)CNCc1ccccc1 34a_100015324214_100000694840 [0,1,0,0,0,2|0,0,1]=4 15649 B13R1.718 C=C(C#N)COCc1ccccc1 34a_100000210790_100000694840 [0,1,0,0,0,2|0,0,1]=4 15650 B13R1.718 C=C(C#N)CSCc1ccccc1 62a_100000211182_100000694840 [0,1,0,0,0,2|0,0,1]=4 15651 B13R1.718 C=CC(=NNCc1ccccc1)C 4a_100000007032_200015361842 [0,1,0,0,0,2|0,0,0]=3 15652 B13R1.718 C=CC(=NNCc1ccccn1)C 4a_100000736832_200015361842 [0,1,0,0,0,2|1,0,0]=4 15653 B13R1.718 C=CC(=NNCc1cccnc1)C 4a_100000738295_200015361842 [0,1,0,0,0,2|1,0,0]=4 15654 B13R1.718 C=CC(=NNCc1ccncc1)C 4a_100000736929_200015361842 [0,1,0,0,0,2|1,0,0]=4 15655 B13R1.718 C=CC(=O)C/C=C/c1ccccc1 1458a_100000185746_100016265936 [0,1,0,0,0,2|1,0,0]=4 15656 B13R1.718 C=CC(=O)CC#Cc1ccccc1 1458a_100000185746_100011352542 [0,1,0,0,0,2|1,0,0]=4 15657 B13R1.718 C=CC(=O)CCCc1ccccc1 1458a_100000185746_100000211621 [0,1,0,0,0,2|1,0,0]=4 15658 B13R1.718 C=CC(=O)CCOc1ccccc1 1458a_100000185746_100000184471 [0,1,0,0,0,2|1,0,0]=4 15659 B13R1.718 C=CC(=O)CCSc1ccccc1 1458a_100000185746_100000246102 [0,1,0,0,0,2|1,0,0]=4 15660 B13R1.718 C=CC(=O)CSCc1ccccc1 1458a_100000185746_200011217039 [0,1,0,0,0,2|1,0,0]=4 15661 B13R1.718 C=CC(=O)NCCc1ccccc1 1626a_100000106460_100000185746 [0,1,0,0,0,2|1,0,0]=4 15662 B13R1.718 C=CC(=O)NCCc1ccccc1 240690a_100000106460_200121576911 [0,1,0,0,0,2|1,0,0]=4 15663 B13R1.718 C=CC(=O)NNCc1ccccc1 22a_100000007032_100000185746 [0,1,0,0,0,2|1,0,0]=4 15664 B13R1.718 C=CC(C)COCc1ccccc1 34a_100011215527_100015291786 [0,1,0,0,0,2|0,0,1]=4 15665 B13R1.718 C=CC(C)COCc1ccccc1 7a_100011215527_100000211182 [0,1,0,0,0,2|0,0,1]=4 15666 B13R1.718 C=CC(C)OCCc1ccccc1 34a_100000695699_100000765856 [0,1,0,0,0,2|0,0,1]=4 15667 B13R1.718 C=CC(C)SCCc1ccccc1 62a_100011215867_100011218657 [0,1,0,0,0,2|0,0,1]=4 15668 B13R1.718 C=CC(C)SCSc1ccccc1 62a_100011215867_100011218342 [0,1,0,0,0,2|0,0,1]=4 15669 B13R1.718 CC(=NNCc1ccccc1)CF 4a_100000007032_100000039719 [0,1,0,0,0,2|0,0,1]=4 15670 B13R1.718 CC(=NNCc1ccccc1)CO 4a_100000007032_100000211253 [0,1,0,0,0,2|0,0,1]=4 15671 B13R1.718 CCC(=O)C/C=C/c1ccccc1 1458a_100000210414_100016265936 [0,1,0,0,0,2|1,0,0]=4 15672 B13R1.718 CCC(=O)C/C=C/c1ccccc1 1458a_100011219626_100000210202 [0,1,0,0,0,2|1,0,0]=4 15673 B13R1.718 CCC(=O)CC#Cc1ccccc1 1458a_100000210414_100011352542 [0,1,0,0,0,2|1,0,0]=4 15674 B13R1.718 CCC(=O)CCCc1ccccc1 1458a_100000210414_100000211621 [0,1,0,0,0,2|1,0,0]=4 15675 B13R1.718 CCC(=O)CCCc1ccccc1 1458a_100011207963_100000210202 [0,1,0,0,0,2|1,0,0]=4 15676 B13R1.718 CCC(=O)CCOc1ccccc1 1458a_100000182761_100000210202 [0,1,0,0,0,2|1,0,0]=4 15677 B13R1.718 CCC(=O)CCOc1ccccc1 1458a_100000210414_100000184471 [0,1,0,0,0,2|1,0,0]=4 15678 B13R1.718 CCC(=O)CCSc1ccccc1 1458a_100000182436_100000210202 [0,1,0,0,0,2|1,0,0]=4 15679 B13R1.718 CCC(=O)CCSc1ccccc1 1458a_100000210414_100000246102 [0,1,0,0,0,2|1,0,0]=4 15680 B13R1.718 CCC(=O)COCc1ccccc1 1458a_100000230186_100000210202 [0,1,0,0,0,2|1,0,0]=4 15681 B13R1.718 CCC(=O)COCc1ccccc1 34a_100000725409_100015291786 [0,1,0,0,0,2|1,0,0]=4 15682 B13R1.718 CCC(=O)COCc1ccccc1 7a_100000210790_100000747405 [0,1,0,0,0,2|1,0,0]=4 15683 B13R1.718 CCC(=O)CSCc1ccccc1 1458a_100000150264_100000210202 [0,1,0,0,0,2|1,0,0]=4 15684 B13R1.718 CCC(=O)CSCc1ccccc1 1458a_100000210414_200011217039 [0,1,0,0,0,2|1,0,0]=4 15685 B13R1.718 CCC(=O)CSCc1ccccc1 62a_100000211182_100000747405 [0,1,0,0,0,2|1,0,0]=4 15686 B13R1.718 CCC(=O)CSCc1ccccc1 62a_100000747405_100015291786 [0,1,0,0,0,2|1,0,0]=4 15687 B13R1.718 CCC(=O)NCCc1ccccc1 11a_100000106460_100000210414 [0,1,0,0,0,2|1,0,0]=4 15688 B13R1.718 CCC(=O)NCCc1ccccc1 1626a_100000106460_100000210414 [0,1,0,0,0,2|1,0,0]=4 15689 B13R1.718 CCC(=O)NCCc1ccccc1 240690a_100000106460_100000210414 [0,1,0,0,0,2|1,0,0]=4 15690 B13R1.718 CCC(=O)NCCc1ccccc1 527a_100000106460_100000210414 [0,1,0,0,0,2|1,0,0]=4 15691 B13R1.718 CCC(=O)NNCc1ccccc1 22a_100000007032_100000210414 [0,1,0,0,0,2|1,0,0]=4 15692 B13R1.718 CNC(=O)C/C=C/c1ccccc1 11a_106832991635_100011219626 [0,1,0,0,0,2|1,0,0]=4 15693 B13R1.718 CNC(=O)C/C=C/c1ccccc1 1626a_100102657272_100011219626 [0,1,0,0,0,2|1,0,0]=4 15694 B13R1.718 CNC(=O)C/C=C/c1ccccc1 240690a_100102657272_100011219626 [0,1,0,0,0,2|1,0,0]=4 15695 B13R1.718 CNC(=O)CCCc1ccccc1 11a_106832991635_100011207963 [0,1,0,0,0,2|1,0,0]=4 15696 B13R1.718 CNC(=O)CCCc1ccccc1 1626a_100102657272_100011207963 [0,1,0,0,0,2|1,0,0]=4 15697 B13R1.718 CNC(=O)CCCc1ccccc1 240690a_100102657272_100011207963 [0,1,0,0,0,2|1,0,0]=4 15698 B13R1.718 CNC(=O)CCCc1ccccc1 527a_100102657272_100011207963 [0,1,0,0,0,2|1,0,0]=4 15699 B13R1.718 CNC(=O)CCNc1ccccc1 34a_100000106764_100012179268 [0,1,0,0,0,2|1,0,0]=4 15700 B13R1.718 CNC(=O)CCOc1ccccc1 11a_106832991635_100000182761 [0,1,0,0,0,2|1,0,0]=4 15701 B13R1.718 CNC(=O)CCOc1ccccc1 1626a_100102657272_100000182761 [0,1,0,0,0,2|1,0,0]=4 15702 B13R1.718 CNC(=O)CCOc1ccccc1 240690a_100102657272_100000182761 [0,1,0,0,0,2|1,0,0]=4 15703 B13R1.718 CNC(=O)CCOc1ccccc1 34a_100000210340_100012179268 [0,1,0,0,0,2|1,0,0]=4 15704 B13R1.718 CNC(=O)CCOc1ccccc1 7a_100000210340_100000737683 [0,1,0,0,0,2|1,0,0]=4 15705 B13R1.718 CNC(=O)CCSc1ccccc1 11a_106832991635_100000182436 [0,1,0,0,0,2|1,0,0]=4 15706 B13R1.718 CNC(=O)CCSc1ccccc1 1626a_100102657272_100000182436 [0,1,0,0,0,2|1,0,0]=4 15707 B13R1.718 CNC(=O)CCSc1ccccc1 240690a_100102657272_100000182436 [0,1,0,0,0,2|1,0,0]=4 15708 B13R1.718 CNC(=O)CCSc1ccccc1 62a_100000719477_100000737683 [0,1,0,0,0,2|1,0,0]=4 15709 B13R1.718 CNC(=O)CCSc1ccccc1 62a_100000737683_100000041952 [0,1,0,0,0,2|1,0,0]=4 15710 B13R1.718 CNC(=O)CNCc1ccccc1 207a_100000693194_100015611070 [0,1,0,0,0,2|1,0,0]=4 15711 B13R1.718 CNC(=O)CNCc1ccccc1 2230a_100000693194_100015291786 [0,1,0,0,0,2|1,0,0]=4 15712 B13R1.718 CNC(=O)CNCc1ccccc1 2230a_100015324214_100000183359 [0,1,0,0,0,2|1,0,0]=4 15713 B13R1.718 CNC(=O)CNCc1ccccc1 270004a_100000693194_100015611070 [0,1,0,0,0,2|1,0,0]=4 15714 B13R1.718 CNC(=O)CNCc1ccccc1 34a_100015324214_100000183359 [0,1,0,0,0,2|1,0,0]=4 15715 B13R1.718 CNC(=O)COCc1ccccc1 11a_106832991635_100000230186 [0,1,0,0,0,2|1,0,0]=4 15716 B13R1.718 CNC(=O)COCc1ccccc1 1626a_100102657272_100000230186 [0,1,0,0,0,2|1,0,0]=4 15717 B13R1.718 CNC(=O)COCc1ccccc1 240690a_100102657272_100000230186 [0,1,0,0,0,2|1,0,0]=4 15718 B13R1.718 CNC(=O)COCc1ccccc1 34a_100000210790_100000183359 [0,1,0,0,0,2|1,0,0]=4 15719 B13R1.718 CNC(=O)COCc1ccccc1 34a_100000750040_100015291786 [0,1,0,0,0,2|1,0,0]=4 15720 B13R1.718 CNC(=O)COCc1ccccc1 527a_100102657272_100000230186 [0,1,0,0,0,2|1,0,0]=4 15721 B13R1.718 CNC(=O)COCc1ccccc1 7a_100000210790_100000183359 [0,1,0,0,0,2|1,0,0]=4 15722 B13R1.718 CNC(=O)CSCc1ccccc1 11a_106832991635_100000150264 [0,1,0,0,0,2|1,0,0]=4 15723 B13R1.718 CNC(=O)CSCc1ccccc1 1626a_100102657272_100000150264 [0,1,0,0,0,2|1,0,0]=4 15724 B13R1.718 CNC(=O)CSCc1ccccc1 240690a_100102657272_100000150264 [0,1,0,0,0,2|1,0,0]=4 15725 B13R1.718 CNC(=O)CSCc1ccccc1 527a_100102657272_100000150264 [0,1,0,0,0,2|1,0,0]=4 15726 B13R1.718 CNC(=O)CSCc1ccccc1 62a_100000183359_100015291786 [0,1,0,0,0,2|1,0,0]=4 15727 B13R1.718 CNC(=O)CSCc1ccccc1 62a_100000211182_100000183359 [0,1,0,0,0,2|1,0,0]=4 15728 B13R1.718 CNC(=O)NCCc1ccccc1 2708a_100000106460_106832991635 [0,1,0,0,0,2|1,0,0]=4 15729 B13R1.718 CNC(=O)NCCc1ccccc1 2708a_100102657272_100000106460 [0,1,0,0,0,2|1,0,0]=4 15730 B13R1.718 CNC(=O)NCCc1ccccc1 273464a_100000106460_100102657272 [0,1,0,0,0,2|1,0,0]=4 15731 B13R1.718 CNC(=O)NCCc1ccccc1 273464a_100102657272_100000106460 [0,1,0,0,0,2|1,0,0]=4 15732 B13R1.718 CNC(=O)NCCc1ccccc1 512a_100000106460_100102657272 [0,1,0,0,0,2|1,0,0]=4 15733 B13R1.718 CNC(=O)NCCc1ccccc1 512a_106832991638_100000106460 [0,1,0,0,0,2|1,0,0]=4 15734 B13R1.718 CNC(=O)NNCc1ccccc1 273464a_100102657272_100000007032 [0,1,0,0,0,2|1,0,0]=4 15735 B13R1.718 CNC(=O)NNCc1ccccc1 512a_106832991638_100000007032 [0,1,0,0,0,2|1,0,0]=4 15736 B13R1.718 COC(=O)CCNc1ccccc1 34a_100000106764_100000742370 [0,1,0,0,0,2|1,0,0]=4 15737 B13R1.718 COC(=O)CCOc1ccccc1 34a_100000210340_100000742370 [0,1,0,0,0,2|1,0,0]=4 15738 B13R1.718 COC(=O)CCOc1ccccc1 7a_100000210340_100000204255 [0,1,0,0,0,2|1,0,0]=4 15739 B13R1.718 COC(=O)CCSc1ccccc1 62a_100000204255_100000041952 [0,1,0,0,0,2|1,0,0]=4 15740 B13R1.718 COC(=O)CCSc1ccccc1 62a_100000719477_100000204255 [0,1,0,0,0,2|1,0,0]=4 15741 B13R1.718 COC(=O)CNCc1ccccc1 2230a_100015324214_100000747449 [0,1,0,0,0,2|1,0,0]=4 15742 B13R1.718 COC(=O)CNCc1ccccc1 34a_100015324214_100000747449 [0,1,0,0,0,2|1,0,0]=4 15743 B13R1.718 COC(=O)COCc1ccccc1 34a_100000210790_100000747449 [0,1,0,0,0,2|1,0,0]=4 15744 B13R1.718 COC(=O)COCc1ccccc1 7a_100000210790_100000747449 [0,1,0,0,0,2|1,0,0]=4 15745 B13R1.718 COC(=O)CSCc1ccccc1 62a_100000211182_100000747449 [0,1,0,0,0,2|1,0,0]=4 15746 B13R1.718 COC(=O)CSCc1ccccc1 62a_100000747449_100015291786 [0,1,0,0,0,2|1,0,0]=4 15747 B13R1.718 COC(=O)OCSc1ccccc1 62a_100000719477_100000139417 [0,1,0,0,0,2|1,0,0]=4 15748 B13R1.718 O=C(CF)C/C=C/c1ccccc1 1458a_100011219626_100015361967 [0,1,0,0,0,2|1,0,0]=4 15749 B13R1.718 O=C(CF)CCCc1ccccc1 1458a_100011207963_100015361967 [0,1,0,0,0,2|1,0,0]=4 15750 B13R1.718 O=C(CF)CCOc1ccccc1 1458a_100000182761_100015361967 [0,1,0,0,0,2|1,0,0]=4 15751 B13R1.718 O=C(CF)CCSc1ccccc1 1458a_100000182436_100015361967 [0,1,0,0,0,2|1,0,0]=4 15752 B13R1.718 O=C(CF)COCc1ccccc1 1458a_100000230186_100015361967 [0,1,0,0,0,2|1,0,0]=4 15753 B13R1.718 O=C(CF)CSCc1ccccc1 1458a_100000150264_100015361967 [0,1,0,0,0,2|1,0,0]=4 15754 B13R1.718 O=C(CO)C/C=C/c1ccccc1 1458a_100000210174_100016265936 [0,1,0,0,0,2|1,0,0]=4 15755 B13R1.718 O=C(CO)CC#Cc1ccccc1 1458a_100000210174_100011352542 [0,1,0,0,0,2|1,0,0]=4 15756 B13R1.718 O=C(CO)CCCc1ccccc1 1458a_100000210174_100000211621 [0,1,0,0,0,2|1,0,0]=4 15757 B13R1.718 O=C(CO)CCOc1ccccc1 1458a_100000210174_100000184471 [0,1,0,0,0,2|1,0,0]=4 15758 B13R1.718 O=C(CO)CCSc1ccccc1 1458a_100000210174_100000246102 [0,1,0,0,0,2|1,0,0]=4 15759 B13R1.718 O=C(CO)CSCc1ccccc1 1458a_100000210174_200011217039 [0,1,0,0,0,2|1,0,0]=4 15760 B13R1.718 O=C(CO)NCCc1ccccc1 240690a_100000106460_100000210174 [0,1,0,0,0,2|1,0,0]=4 15761 B13R1.718 O=C(CO)NCCc1ccccc1 527a_100000106460_100000210174 [0,1,0,0,0,2|1,0,0]=4 15762 B13R1.718 O=C(CO)NNCc1ccccc1 22a_100000007032_100000210174 [0,1,0,0,0,2|1,0,0]=4 15763 B13R1.280 C=C(C)COc1cccccc1=O 34a_100000036025_100000748629 [0,1,0,0,0,2|0,0,0]=3 15764 B13R1.280 C=C(C)COc1cccccc1=O 7a_100000036025_100000748629 [0,1,0,0,0,2|0,0,0]=3 15765 B13R1.280 C=C(F)COc1cccccc1=O 34a_100000036025_100009893438 [0,1,0,0,0,2|1,0,0]=4 15766 B13R1.280 C=C(F)COc1cccccc1=O 7a_100000036025_100000042424 [0,1,0,0,0,2|1,0,0]=4 15767 B13R1.3 C#Cc1ccc(cc1)CNC(=O)C 11a_100015199678_100015343762 [0,2,0,0,0,1|1,0,0]=4 15768 B13R1.3 C#Cc1ccc(cc1)CNC(=O)C 1626a_100015199678_100015343762 [0,2,0,0,0,1|1,0,0]=4 15769 B13R1.3 C#Cc1ccc(cc1)CNC(=O)C 240690a_100015199678_100015343762 [0,2,0,0,0,1|1,0,0]=4 15770 B13R1.3 C#Cc1ccc(cc1)CNC(=O)C 527a_100015199678_100103153847 [0,2,0,0,0,1|1,0,0]=4 15771 B13R1.3 C#Cc1ccc(cc1)NCC(=C)C 34a_100011215031_100000748629 [0,2,0,0,0,1|0,0,0]=3 15772 B13R1.3 C#Cc1ccc(cc1)NCC(=C)F 34a_100011215031_100009893438 [0,2,0,0,0,1|1,0,0]=4 15773 B13R1.3 C#Cc1ccc(nc1)OCC(=C)C 34a_200009884252_100000748629 [0,2,0,0,0,1|1,0,0]=4 15774 B13R1.3 C=C(C)CNc1ccc(cc1)C#N 34a_100000185469_100000748629 [0,2,0,0,0,1|0,0,0]=3 15775 B13R1.3 C=C(C)CNc1ccc(cc1)CC 2230a_100000211069_100000748629 [0,2,0,0,0,1|0,0,0]=3 15776 B13R1.3 C=C(C)CNc1ccc(cc1)CC 34a_100000211069_100000748629 [0,2,0,0,0,1|0,0,0]=3 15777 B13R1.3 C=C(C)CNc1ccc(cc1)CO 2230a_100011215238_100000748629 [0,2,0,0,0,1|0,0,0]=3 15778 B13R1.3 C=C(C)CNc1ccc(cc1)CO 34a_100011215238_100000748629 [0,2,0,0,0,1|0,0,0]=3 15779 B13R1.3 C=C(C)CNc1ccc(cc1)OC 34a_100000184247_100000748629 [0,2,0,0,0,1|0,0,0]=3 15780 B13R1.3 C=C(C)CNc1ccc(cc1)SC 34a_100000212337_100000748629 [0,2,0,0,0,1|0,0,0]=3 15781 B13R1.3 C=C(C)CNc1ccc(cn1)C#N 27a_100000765925_100000241038 [0,2,0,0,0,1|1,0,0]=4 15782 B13R1.3 C=C(C)CNc1ccc(cn1)SC 27a_100000765925_100009820866 [0,2,0,0,0,1|1,0,0]=4 15783 B13R1.3 C=C(C)COc1ccc(cc1)C#N 34a_100000210344_100000748629 [0,2,0,0,0,1|0,0,0]=3 15784 B13R1.3 C=C(C)COc1ccc(cc1)C#N 7a_100000210344_100000748629 [0,2,0,0,0,1|0,0,0]=3 15785 B13R1.3 C=C(C)COc1ccc(cc1)CC 34a_100000211359_100000748629 [0,2,0,0,0,1|0,0,0]=3 15786 B13R1.3 C=C(C)COc1ccc(cc1)CC 7a_100000211359_100000748629 [0,2,0,0,0,1|0,0,0]=3 15787 B13R1.3 C=C(C)COc1ccc(cc1)CN 34a_100000185549_100000748629 [0,2,0,0,0,1|0,0,0]=3 15788 B13R1.3 C=C(C)COc1ccc(cc1)CO 34a_100000211755_100000748629 [0,2,0,0,0,1|0,0,0]=3 15789 B13R1.3 C=C(C)COc1ccc(cc1)NC 2230a_200015186533_200000210301 [0,2,0,0,0,1|0,0,0]=3 15790 B13R1.3 C=C(C)COc1ccc(cc1)NC 34a_100000182112_100000748629 [0,2,0,0,0,1|0,0,0]=3 15791 B13R1.3 C=C(C)COc1ccc(cc1)NC 34a_200015186533_200000210301 [0,2,0,0,0,1|0,0,0]=3 15792 B13R1.3 C=C(C)COc1ccc(cc1)N[13CH3] 2230a_200015186533_200025704644 [0,2,0,0,0,1|0,0,0]=3 15793 B13R1.3 C=C(C)COc1ccc(cc1)N[13CH3] 34a_200015186533_200025704644 [0,2,0,0,0,1|0,0,0]=3 15794 B13R1.3 C=C(C)COc1ccc(cc1)OC 34a_100000210503_100000748629 [0,2,0,0,0,1|0,0,0]=3 15795 B13R1.3 C=C(C)COc1ccc(cc1)SC 34a_100000211864_100000748629 [0,2,0,0,0,1|0,0,0]=3 15796 B13R1.3 C=C(C)COc1ccc(cn1)CN 34a_100000757128_100000748629 [0,2,0,0,0,1|1,0,0]=4 15797 B13R1.3 C=C(C)COc1ccc(cn1)OC 34a_100012002028_100000748629 [0,2,0,0,0,1|1,0,0]=4 15798 B13R1.3 C=C(C)COc1ccc(nc1)C#N 34a_100011934750_100000748629 [0,2,0,0,0,1|1,0,0]=4 15799 B13R1.3 C=C(C)COc1ccc(nc1)C#N 7a_100011934750_100000748629 [0,2,0,0,0,1|1,0,0]=4 15800 B13R1.3 C=C(C)COc1ccc(nc1)CN 34a_100020605196_100000748629 [0,2,0,0,0,1|1,0,0]=4 15801 B13R1.3 C=C(C)COc1ccc(nc1)CO 34a_103436540053_100000748629 [0,2,0,0,0,1|1,0,0]=4 15802 B13R1.3 C=C(C)COc1ccc(nc1)OC 34a_100011934560_100000748629 [0,2,0,0,0,1|1,0,0]=4 15803 B13R1.3 C=C(C)CSc1ccc(cc1)C#N 62a_100000748629_100000184291 [0,2,0,0,0,1|0,0,0]=3 15804 B13R1.3 C=C(C)CSc1ccc(cc1)C=O 62a_100000188517_100000211660 [0,2,0,0,0,1|0,0,0]=3 15805 B13R1.3 C=C(C)CSc1ccc(cc1)C=O 62a_100000748629_100000188517 [0,2,0,0,0,1|0,0,0]=3 15806 B13R1.3 C=C(C)CSc1ccc(cc1)CC 62a_100000748629_100011215824 [0,2,0,0,0,1|0,0,0]=3 15807 B13R1.3 C=C(C)CSc1ccc(cc1)CC 62a_100011215824_100000211660 [0,2,0,0,0,1|0,0,0]=3 15808 B13R1.3 C=C(C)CSc1ccc(cc1)CF 62a_100000748629_100010268989 [0,2,0,0,0,1|0,0,0]=3 15809 B13R1.3 C=C(C)CSc1ccc(cc1)CF 62a_100010268989_100000211660 [0,2,0,0,0,1|0,0,0]=3 15810 B13R1.3 C=C(C)CSc1ccc(cc1)CN 62a_100000748629_100016989417 [0,2,0,0,0,1|0,0,0]=3 15811 B13R1.3 C=C(C)CSc1ccc(cc1)CN 62a_100016989417_100000211660 [0,2,0,0,0,1|0,0,0]=3 15812 B13R1.3 C=C(C)CSc1ccc(cc1)CO 62a_100000690907_100000211660 [0,2,0,0,0,1|0,0,0]=3 15813 B13R1.3 C=C(C)CSc1ccc(cc1)CO 62a_100000748629_100000690907 [0,2,0,0,0,1|0,0,0]=3 15814 B13R1.3 C=C(C)CSc1ccc(cc1)NC 62a_100000743151_100000211660 [0,2,0,0,0,1|0,0,0]=3 15815 B13R1.3 C=C(C)CSc1ccc(cc1)NC 62a_100000748629_100000743151 [0,2,0,0,0,1|0,0,0]=3 15816 B13R1.3 C=C(C)CSc1ccc(cc1)NN 62a_100000748629_100016988836 [0,2,0,0,0,1|0,0,0]=3 15817 B13R1.3 C=C(C)CSc1ccc(cc1)NN 62a_100016988836_100000211660 [0,2,0,0,0,1|0,0,0]=3 15818 B13R1.3 C=C(C)CSc1ccc(cc1)OC 62a_100000748629_100000171711 [0,2,0,0,0,1|0,0,0]=3 15819 B13R1.3 C=C(C)CSc1ccc(cc1)SC 62a_100000748629_100011263217 [0,2,0,0,0,1|0,0,0]=3 15820 B13R1.3 C=C(C)CSc1ccc(cc1)SC 62a_100011263217_100000211660 [0,2,0,0,0,1|0,0,0]=3 15821 B13R1.3 C=C(C)CSc1ccc(cn1)C#N 62a_100000748629_100000241038 [0,2,0,0,0,1|1,0,0]=4 15822 B13R1.3 C=C(C)CSc1ccc(cn1)C=O 62a_100000748629_100000766901 [0,2,0,0,0,1|1,0,0]=4 15823 B13R1.3 C=C(C)CSc1ccc(cn1)C=O 62a_100000766901_100000211660 [0,2,0,0,0,1|1,0,0]=4 15824 B13R1.3 C=C(C)CSc1ccc(cn1)CC 62a_100000748629_100009843584 [0,2,0,0,0,1|1,0,0]=4 15825 B13R1.3 C=C(C)CSc1ccc(cn1)CC 62a_100009843584_100000211660 [0,2,0,0,0,1|1,0,0]=4 15826 B13R1.3 C=C(C)CSc1ccc(cn1)CN 62a_100000735879_100000211660 [0,2,0,0,0,1|1,0,0]=4 15827 B13R1.3 C=C(C)CSc1ccc(cn1)CN 62a_100000748629_100000735879 [0,2,0,0,0,1|1,0,0]=4 15828 B13R1.3 C=C(C)CSc1ccc(cn1)CO 62a_100000748629_100009816760 [0,2,0,0,0,1|1,0,0]=4 15829 B13R1.3 C=C(C)CSc1ccc(cn1)CO 62a_100009816760_100000211660 [0,2,0,0,0,1|1,0,0]=4 15830 B13R1.3 C=C(C)CSc1ccc(cn1)NC 62a_100000748629_100000764248 [0,2,0,0,0,1|1,0,0]=4 15831 B13R1.3 C=C(C)CSc1ccc(cn1)NC 62a_100000764248_100000211660 [0,2,0,0,0,1|1,0,0]=4 15832 B13R1.3 C=C(C)CSc1ccc(cn1)NN 62a_100000748629_100000119030 [0,2,0,0,0,1|1,0,0]=4 15833 B13R1.3 C=C(C)CSc1ccc(cn1)NN 62a_100000755011_100000211660 [0,2,0,0,0,1|1,0,0]=4 15834 B13R1.3 C=C(C)CSc1ccc(cn1)OC 62a_100000748629_100000744180 [0,2,0,0,0,1|1,0,0]=4 15835 B13R1.3 C=C(C)CSc1ccc(cn1)OC 62a_100000755202_100000211660 [0,2,0,0,0,1|1,0,0]=4 15836 B13R1.3 C=C(C)CSc1ccc(cn1)SC 62a_100000748629_100009820866 [0,2,0,0,0,1|1,0,0]=4 15837 B13R1.3 C=C(C)CSc1ccc(cn1)SC 62a_100009820866_100000211660 [0,2,0,0,0,1|1,0,0]=4 15838 B13R1.3 C=C(C)CSc1ccc(nc1)C#N 62a_100000748629_100000760455 [0,2,0,0,0,1|1,0,0]=4 15839 B13R1.3 C=C(C)CSc1ccc(nc1)C=O 62a_100000748629_100000754260 [0,2,0,0,0,1|1,0,0]=4 15840 B13R1.3 C=C(C)CSc1ccc(nc1)C=O 62a_100000754260_100000211660 [0,2,0,0,0,1|1,0,0]=4 15841 B13R1.3 C=C(C)CSc1ccc(nc1)CC 62a_100000748629_100009820025 [0,2,0,0,0,1|1,0,0]=4 15842 B13R1.3 C=C(C)CSc1ccc(nc1)CC 62a_100009820025_100000211660 [0,2,0,0,0,1|1,0,0]=4 15843 B13R1.3 C=C(C)CSc1ccc(nc1)CN 62a_100000748629_100015188789 [0,2,0,0,0,1|1,0,0]=4 15844 B13R1.3 C=C(C)CSc1ccc(nc1)CN 62a_100015188789_100000211660 [0,2,0,0,0,1|1,0,0]=4 15845 B13R1.3 C=C(C)CSc1ccc(nc1)CO 62a_100000748629_100000754261 [0,2,0,0,0,1|1,0,0]=4 15846 B13R1.3 C=C(C)CSc1ccc(nc1)CO 62a_100000754261_100000211660 [0,2,0,0,0,1|1,0,0]=4 15847 B13R1.3 C=C(C)CSc1ccc(nc1)NC 62a_100000741341_100000211660 [0,2,0,0,0,1|1,0,0]=4 15848 B13R1.3 C=C(C)CSc1ccc(nc1)NC 62a_100000748629_100000741341 [0,2,0,0,0,1|1,0,0]=4 15849 B13R1.3 C=C(C)CSc1ccc(nc1)NN 62a_100000748629_100000750576 [0,2,0,0,0,1|1,0,0]=4 15850 B13R1.3 C=C(C)CSc1ccc(nc1)NN 62a_100000750576_100000211660 [0,2,0,0,0,1|1,0,0]=4 15851 B13R1.3 C=C(C)CSc1ccc(nc1)OC 62a_100000047065_100000211660 [0,2,0,0,0,1|1,0,0]=4 15852 B13R1.3 C=C(C)CSc1ccc(nc1)OC 62a_100000748629_100000047065 [0,2,0,0,0,1|1,0,0]=4 15853 B13R1.3 C=C(C)CSc1ccc(nc1)SC 62a_100000748629_100011408404 [0,2,0,0,0,1|1,0,0]=4 15854 B13R1.3 C=C(C)CSc1ccc(nc1)SC 62a_100011408404_100000211660 [0,2,0,0,0,1|1,0,0]=4 15855 B13R1.3 C=C(F)CNc1ccc(cc1)C#N 34a_100000185469_100009893438 [0,2,0,0,0,1|1,0,0]=4 15856 B13R1.3 C=C(F)CNc1ccc(cc1)CC 2230a_100000211069_100009893438 [0,2,0,0,0,1|1,0,0]=4 15857 B13R1.3 C=C(F)CNc1ccc(cc1)CC 34a_100000211069_100009893438 [0,2,0,0,0,1|1,0,0]=4 15858 B13R1.3 C=C(F)CNc1ccc(cc1)CO 2230a_100011215238_100009893438 [0,2,0,0,0,1|1,0,0]=4 15859 B13R1.3 C=C(F)CNc1ccc(cc1)CO 34a_100011215238_100009893438 [0,2,0,0,0,1|1,0,0]=4 15860 B13R1.3 C=C(F)CNc1ccc(cc1)OC 34a_100000184247_100009893438 [0,2,0,0,0,1|1,0,0]=4 15861 B13R1.3 C=C(F)CNc1ccc(cc1)SC 34a_100000212337_100009893438 [0,2,0,0,0,1|1,0,0]=4 15862 B13R1.3 C=C(F)COc1ccc(cc1)C#N 34a_100000210344_100009893438 [0,2,0,0,0,1|1,0,0]=4 15863 B13R1.3 C=C(F)COc1ccc(cc1)C#N 7a_100000210344_100000042424 [0,2,0,0,0,1|1,0,0]=4 15864 B13R1.3 C=C(F)COc1ccc(cc1)CC 34a_100000211359_100009893438 [0,2,0,0,0,1|1,0,0]=4 15865 B13R1.3 C=C(F)COc1ccc(cc1)CC 7a_100000211359_100000042424 [0,2,0,0,0,1|1,0,0]=4 15866 B13R1.3 C=C(F)COc1ccc(cc1)CN 34a_100000185549_100009893438 [0,2,0,0,0,1|1,0,0]=4 15867 B13R1.3 C=C(F)COc1ccc(cc1)CO 34a_100000211755_100009893438 [0,2,0,0,0,1|1,0,0]=4 15868 B13R1.3 C=C(F)COc1ccc(cc1)NC 34a_100000182112_100009893438 [0,2,0,0,0,1|1,0,0]=4 15869 B13R1.3 C=C(F)COc1ccc(cc1)OC 34a_100000210503_100009893438 [0,2,0,0,0,1|1,0,0]=4 15870 B13R1.3 C=C(F)COc1ccc(cc1)SC 34a_100000211864_100009893438 [0,2,0,0,0,1|1,0,0]=4 15871 B13R1.3 C=C(F)CSc1ccc(cc1)C#N 62a_100000042424_100000184291 [0,2,0,0,0,1|1,0,0]=4 15872 B13R1.3 C=C(F)CSc1ccc(cc1)C=O 62a_100000042424_100000188517 [0,2,0,0,0,1|1,0,0]=4 15873 B13R1.3 C=C(F)CSc1ccc(cc1)C=O 62a_100000188517_100000042424 [0,2,0,0,0,1|1,0,0]=4 15874 B13R1.3 C=C(F)CSc1ccc(cc1)CC 62a_100000042424_100011215824 [0,2,0,0,0,1|1,0,0]=4 15875 B13R1.3 C=C(F)CSc1ccc(cc1)CC 62a_100011215824_100000042424 [0,2,0,0,0,1|1,0,0]=4 15876 B13R1.3 C=C(F)CSc1ccc(cc1)CF 62a_100000042424_100010268989 [0,2,0,0,0,1|1,0,0]=4 15877 B13R1.3 C=C(F)CSc1ccc(cc1)CF 62a_100010268989_100000042424 [0,2,0,0,0,1|1,0,0]=4 15878 B13R1.3 C=C(F)CSc1ccc(cc1)CN 62a_100000042424_100016989417 [0,2,0,0,0,1|1,0,0]=4 15879 B13R1.3 C=C(F)CSc1ccc(cc1)CN 62a_100016989417_100000042424 [0,2,0,0,0,1|1,0,0]=4 15880 B13R1.3 C=C(F)CSc1ccc(cc1)CO 62a_100000042424_100000690907 [0,2,0,0,0,1|1,0,0]=4 15881 B13R1.3 C=C(F)CSc1ccc(cc1)CO 62a_100000690907_100000042424 [0,2,0,0,0,1|1,0,0]=4 15882 B13R1.3 C=C(F)CSc1ccc(cc1)NC 62a_100000042424_100000743151 [0,2,0,0,0,1|1,0,0]=4 15883 B13R1.3 C=C(F)CSc1ccc(cc1)NC 62a_100000743151_100000042424 [0,2,0,0,0,1|1,0,0]=4 15884 B13R1.3 C=C(F)CSc1ccc(cc1)NN 62a_100000042424_100016988836 [0,2,0,0,0,1|1,0,0]=4 15885 B13R1.3 C=C(F)CSc1ccc(cc1)NN 62a_100016988836_100000042424 [0,2,0,0,0,1|1,0,0]=4 15886 B13R1.3 C=C(F)CSc1ccc(cc1)OC 62a_100000042424_100000171711 [0,2,0,0,0,1|1,0,0]=4 15887 B13R1.3 C=C(F)CSc1ccc(cc1)SC 62a_100000042424_100011263217 [0,2,0,0,0,1|1,0,0]=4 15888 B13R1.3 C=C(F)CSc1ccc(cc1)SC 62a_100011263217_100000042424 [0,2,0,0,0,1|1,0,0]=4 15889 B13R1.3 C=Cc1ccc(cc1)CCC(=O)C 1458a_100000070787_100000142037 [0,2,0,0,0,1|1,0,0]=4 15890 B13R1.3 C=Cc1ccc(cc1)CCC(=O)C 271570a_100011290941_100000723691 [0,2,0,0,0,1|1,0,0]=4 15891 B13R1.3 C=Cc1ccc(cc1)CNC(=O)C 11a_200011934891_100015343762 [0,2,0,0,0,1|1,0,0]=4 15892 B13R1.3 C=Cc1ccc(cc1)CNC(=O)C 1626a_200011934891_100015343762 [0,2,0,0,0,1|1,0,0]=4 15893 B13R1.3 C=Cc1ccc(cc1)CNC(=O)C 240690a_200011934891_100015343762 [0,2,0,0,0,1|1,0,0]=4 15894 B13R1.3 C=Cc1ccc(cc1)CNC(=O)C 271570a_100011290941_200000685173 [0,2,0,0,0,1|1,0,0]=4 15895 B13R1.3 C=Cc1ccc(cc1)CNC(=O)C 527a_200011934891_100103153847 [0,2,0,0,0,1|1,0,0]=4 15896 B13R1.3 C=Cc1ccc(cc1)NCC(=C)C 34a_100011218248_100000748629 [0,2,0,0,0,1|0,0,0]=3 15897 B13R1.3 C=Cc1ccc(cc1)NCC(=C)F 34a_100011218248_100009893438 [0,2,0,0,0,1|1,0,0]=4 15898 B13R1.3 C=Cc1ccc(cc1)OCC(=C)C 34a_100000189437_100000748629 [0,2,0,0,0,1|0,0,0]=3 15899 B13R1.3 C=Cc1ccc(cc1)OCC(=C)C 7a_100000189437_100000748629 [0,2,0,0,0,1|0,0,0]=3 15900 B13R1.3 C=Cc1ccc(cc1)OCC(=C)F 34a_100000189437_100009893438 [0,2,0,0,0,1|1,0,0]=4 15901 B13R1.3 C=Cc1ccc(cc1)OCC(=C)F 7a_100000189437_100000042424 [0,2,0,0,0,1|1,0,0]=4 15902 B13R1.3 C=Cc1ccc(cc1)SCC(=C)C 62a_100000748128_100000211660 [0,2,0,0,0,1|0,0,0]=3 15903 B13R1.3 C=Cc1ccc(cc1)SCC(=C)C 62a_100000748629_100000748128 [0,2,0,0,0,1|0,0,0]=3 15904 B13R1.3 C=Cc1ccc(cc1)SCC(=C)F 62a_100000042424_100000748128 [0,2,0,0,0,1|1,0,0]=4 15905 B13R1.3 C=Cc1ccc(cc1)SCC(=C)F 62a_100000748128_100000042424 [0,2,0,0,0,1|1,0,0]=4 15906 B13R1.3 C=Cc1ccc(nc1)SCC(=C)C 62a_100000748629_103436540071 [0,2,0,0,0,1|1,0,0]=4 15907 B13R1.3 C=Cc1ccc(nc1)SCC(=C)C 62a_103436540071_100000211660 [0,2,0,0,0,1|1,0,0]=4 15908 B13R1.3 CC(=O)CCc1ccc(cc1)C#N 1458a_100000021948_200000210301 [0,2,0,0,0,1|1,0,0]=4 15909 B13R1.3 CC(=O)CCc1ccc(cc1)C#N 1458a_100000070787_100012161189 [0,2,0,0,0,1|1,0,0]=4 15910 B13R1.3 CC(=O)CCc1ccc(cc1)O[13CH3] 34a_100000198047_200025704644 [0,2,0,0,0,1|1,0,0]=4 15911 B13R1.3 CC(=O)CCc1ccc(cc1)O[13CH3] 7a_100000198047_200025704644 [0,2,0,0,0,1|1,0,0]=4 15912 B13R1.3 CC(=O)CCc1ccc(cc1)S[13CH3] 62a_100000723691_200025704644 [0,2,0,0,0,1|1,0,0]=4 15913 B13R1.3 CC(=O)CCc1ccc(cc1)S[13CH3] 62a_200025704644_100000723691 [0,2,0,0,0,1|1,0,0]=4 15914 B13R1.3 CC(=O)COc1ccc(cc1)C#N 1458a_100000182482_200000210301 [0,2,0,0,0,1|1,0,0]=4 15915 B13R1.3 CC(=O)COc1ccc(cc1)CO 1458a_100000730898_200000210301 [0,2,0,0,0,1|1,0,0]=4 15916 B13R1.3 CC(=O)NCc1ccc(cc1)C#N 11a_100015207190_100015343762 [0,2,0,0,0,1|1,0,0]=4 15917 B13R1.3 CC(=O)NCc1ccc(cc1)C#N 1626a_100015207190_100015343762 [0,2,0,0,0,1|1,0,0]=4 15918 B13R1.3 CC(=O)NCc1ccc(cc1)C#N 240690a_100015207190_100015343762 [0,2,0,0,0,1|1,0,0]=4 15919 B13R1.3 CC(=O)NCc1ccc(cc1)C#N 527a_100015207190_100103153847 [0,2,0,0,0,1|1,0,0]=4 15920 B13R1.3 CC(=O)NCc1ccc(cc1)CO 240690a_100015189231_100015343762 [0,2,0,0,0,1|1,0,0]=4 15921 B13R1.3 CC(=O)NCc1ccc(cc1)CO 527a_100015189231_100103153847 [0,2,0,0,0,1|1,0,0]=4 15922 B13R1.3 CC(=O)NCc1ccc(cc1)N[13CH3] 34a_100000755463_200025704644 [0,2,0,0,0,1|1,0,0]=4 15923 B13R1.3 CC(=O)NCc1ccc(cc1)S[13CH3] 62a_200000685173_200025704644 [0,2,0,0,0,1|1,0,0]=4 15924 B13R1.3 CC(=O)NCc1ccc(cc1)S[13CH3] 62a_200025704644_200000685173 [0,2,0,0,0,1|1,0,0]=4 15925 B13R1.3 CCc1ccc(cc1)CCC(=O)C 1458a_100000195522_200000210301 [0,2,0,0,0,1|1,0,0]=4 15926 B13R1.3 CCc1ccc(cc1)CCC(=O)[13CH3] 1458a_100000195522_200025704644 [0,2,0,0,0,1|1,0,0]=4 15927 B13R1.3 CCc1ccc(cc1)CNC(=O)C 11a_100000721222_100015343762 [0,2,0,0,0,1|1,0,0]=4 15928 B13R1.3 CCc1ccc(cc1)CNC(=O)C 1626a_100000721222_100015343762 [0,2,0,0,0,1|1,0,0]=4 15929 B13R1.3 CCc1ccc(cc1)CNC(=O)C 240690a_100000721222_100015343762 [0,2,0,0,0,1|1,0,0]=4 15930 B13R1.3 CCc1ccc(cc1)CNC(=O)C 527a_100000721222_100103153847 [0,2,0,0,0,1|1,0,0]=4 15931 B13R1.3 CCc1ccc(cc1)OCC(=O)C 1458a_100000182499_200000210301 [0,2,0,0,0,1|1,0,0]=4 15932 B13R1.3 CCc1ccc(cc1)OCC(=O)[13CH3] 1458a_100000182499_200025704644 [0,2,0,0,0,1|1,0,0]=4 15933 B13R1.3 CNc1ccc(cc1)CNC(=O)C 34a_100000755463_200000210301 [0,2,0,0,0,1|1,0,0]=4 15934 B13R1.3 COc1ccc(cc1)CCC(=O)C 1458a_100000070787_100000184700 [0,2,0,0,0,1|1,0,0]=4 15935 B13R1.3 COc1ccc(cc1)CCC(=O)C 1458a_100000211712_200000210301 [0,2,0,0,0,1|1,0,0]=4 15936 B13R1.3 COc1ccc(cc1)CCC(=O)C 34a_100000198047_200000210301 [0,2,0,0,0,1|1,0,0]=4 15937 B13R1.3 COc1ccc(cc1)CCC(=O)C 7a_100000198047_200000210301 [0,2,0,0,0,1|1,0,0]=4 15938 B13R1.3 COc1ccc(cc1)CCC(=O)[13CH3] 1458a_100000211712_200025704644 [0,2,0,0,0,1|1,0,0]=4 15939 B13R1.3 COc1ccc(cc1)CNC(=O)C 11a_100000185587_100015343762 [0,2,0,0,0,1|1,0,0]=4 15940 B13R1.3 COc1ccc(cc1)CNC(=O)C 1626a_100000185587_100015343762 [0,2,0,0,0,1|1,0,0]=4 15941 B13R1.3 COc1ccc(cc1)CNC(=O)C 240690a_100000185587_100015343762 [0,2,0,0,0,1|1,0,0]=4 15942 B13R1.3 COc1ccc(cc1)CNC(=O)C 527a_100000185587_100103153847 [0,2,0,0,0,1|1,0,0]=4 15943 B13R1.3 COc1ccc(cc1)OCC(=O)C 1458a_100000186439_200000210301 [0,2,0,0,0,1|1,0,0]=4 15944 B13R1.3 COc1ccc(cc1)OCC(=O)[13CH3] 1458a_100000186439_200025704644 [0,2,0,0,0,1|1,0,0]=4 15945 B13R1.3 COc1ccc(cc1)SCC(=O)C 1458a_100000182033_200000210301 [0,2,0,0,0,1|1,0,0]=4 15946 B13R1.3 COc1ccc(cc1)SCC(=O)[13CH3] 1458a_100000182033_200025704644 [0,2,0,0,0,1|1,0,0]=4 15947 B13R1.3 CSc1ccc(cc1)CCC(=O)C 1458a_100011252364_200000210301 [0,2,0,0,0,1|1,0,0]=4 15948 B13R1.3 CSc1ccc(cc1)CCC(=O)C 62a_100000723691_200000210301 [0,2,0,0,0,1|1,0,0]=4 15949 B13R1.3 CSc1ccc(cc1)CCC(=O)C 62a_200000210301_100000723691 [0,2,0,0,0,1|1,0,0]=4 15950 B13R1.3 CSc1ccc(cc1)CCC(=O)[13CH3] 1458a_100011252364_200025704644 [0,2,0,0,0,1|1,0,0]=4 15951 B13R1.3 CSc1ccc(cc1)CNC(=O)C 11a_100000174980_100015343762 [0,2,0,0,0,1|1,0,0]=4 15952 B13R1.3 CSc1ccc(cc1)CNC(=O)C 240690a_100000174980_100015343762 [0,2,0,0,0,1|1,0,0]=4 15953 B13R1.3 CSc1ccc(cc1)CNC(=O)C 527a_100000174980_100103153847 [0,2,0,0,0,1|1,0,0]=4 15954 B13R1.3 CSc1ccc(cc1)CNC(=O)C 62a_200000210301_200000685173 [0,2,0,0,0,1|1,0,0]=4 15955 B13R1.3 CSc1ccc(cc1)CNC(=O)C 62a_200000685173_200000210301 [0,2,0,0,0,1|1,0,0]=4 15956 B13R1.3 [13CH3]C(=O)CCc1ccc(cc1)C#N 1458a_100000021948_200025704644 [0,2,0,0,0,1|1,0,0]=4 15957 B13R1.3 [13CH3]C(=O)COc1ccc(cc1)C#N 1458a_100000182482_200025704644 [0,2,0,0,0,1|1,0,0]=4 15958 B13R1.3 [13CH3]C(=O)COc1ccc(cc1)CO 1458a_100000730898_200025704644 [0,2,0,0,0,1|1,0,0]=4 15959 B13R1.14 C=C(C#N)CNc1ccc(cc1)Br 2230a_100000210018_100000694840 [0,2,0,0,0,1|0,0,1]=4 15960 B13R1.14 C=C(C#N)CNc1ccc(cc1)Br 34a_100000210018_100000694840 [0,2,0,0,0,1|0,0,1]=4 15961 B13R1.14 C=C(C#N)CNc1ccc(cc1)C 34a_100000124888_100000694840 [0,2,0,0,0,1|0,0,1]=4 15962 B13R1.14 C=C(C#N)CNc1ccc(cc1)Cl 2230a_100000210052_100000694840 [0,2,0,0,0,1|0,0,1]=4 15963 B13R1.14 C=C(C#N)CNc1ccc(cc1)Cl 34a_100000210052_100000694840 [0,2,0,0,0,1|0,0,1]=4 15964 B13R1.14 C=C(C#N)CNc1ccc(cc1)F 34a_100000185862_100000694840 [0,2,0,0,0,1|0,0,1]=4 15965 B13R1.14 C=C(C#N)CNc1ccc(cc1)I 34a_100000185761_100000694840 [0,2,0,0,0,1|0,0,1]=4 15966 B13R1.14 C=C(C#N)CNc1ccc(cc1)O 34a_100000185829_100000694840 [0,2,0,0,0,1|0,0,1]=4 15967 B13R1.14 C=C(C#N)COc1ccc(cc1)Br 34a_100000185759_100000694840 [0,2,0,0,0,1|0,0,1]=4 15968 B13R1.14 C=C(C#N)COc1ccc(cc1)C 34a_100000210336_100000694840 [0,2,0,0,0,1|0,0,1]=4 15969 B13R1.14 C=C(C#N)COc1ccc(cc1)Cl 34a_100000210216_100000694840 [0,2,0,0,0,1|0,0,1]=4 15970 B13R1.14 C=C(C#N)COc1ccc(cc1)F 34a_100000210339_100000694840 [0,2,0,0,0,1|0,0,1]=4 15971 B13R1.14 C=C(C#N)COc1ccc(cc1)I 34a_100000212066_100000694840 [0,2,0,0,0,1|0,0,1]=4 15972 B13R1.14 C=C(C#N)COc1ccc(cc1)N 34a_100000185829_100000694840 [0,2,0,0,0,1|0,0,1]=4 15973 B13R1.14 C=C(C#N)CSc1ccc(cc1)Br 62a_100000752885_100000694840 [0,2,0,0,0,1|0,0,1]=4 15974 B13R1.14 C=C(C#N)CSc1ccc(cc1)C 62a_100000186775_100000694840 [0,2,0,0,0,1|0,0,1]=4 15975 B13R1.14 C=C(C#N)CSc1ccc(cc1)Cl 62a_100000755918_100000694840 [0,2,0,0,0,1|0,0,1]=4 15976 B13R1.14 C=C(C#N)CSc1ccc(cc1)F 62a_100000211213_100000694840 [0,2,0,0,0,1|0,0,1]=4 15977 B13R1.14 C=C(C#N)CSc1ccc(cc1)N 62a_100000185761_100000694840 [0,2,0,0,0,1|0,0,1]=4 15978 B13R1.14 C=CC(=NNc1ccc(cc1)Br)C 4a_100000735608_200015361842 [0,2,0,0,0,1|1,0,0]=4 15979 B13R1.14 C=CC(=NNc1ccc(cc1)C)C 4a_100000683527_200015361842 [0,2,0,0,0,1|1,0,0]=4 15980 B13R1.14 C=CC(=NNc1ccc(cc1)Cl)C 4a_100000683521_200015361842 [0,2,0,0,0,1|1,0,0]=4 15981 B13R1.14 C=CC(=NNc1ccc(cc1)F)C 4a_100000728448_200015361842 [0,2,0,0,0,1|1,0,0]=4 15982 B13R1.14 C=CC(=NNc1ccc(cc1)I)C 4a_100016988836_200015361842 [0,2,0,0,0,1|1,0,0]=4 15983 B13R1.14 C=CC(=O)CCc1ccc(cc1)Br 1458a_100000185746_100011740612 [0,2,0,0,0,1|1,0,0]=4 15984 B13R1.14 C=CC(=O)CCc1ccc(cc1)C 1458a_100000185746_100011713686 [0,2,0,0,0,1|1,0,0]=4 15985 B13R1.14 C=CC(=O)CCc1ccc(cc1)Cl 1458a_100000185746_100011713675 [0,2,0,0,0,1|1,0,0]=4 15986 B13R1.14 C=CC(=O)CCc1ccc(cc1)F 1458a_100000185746_100011217392 [0,2,0,0,0,1|1,0,0]=4 15987 B13R1.14 C=CC(=O)CCc1ccc(cc1)O 1458a_100000185746_100009816426 [0,2,0,0,0,1|1,0,0]=4 15988 B13R1.14 C=CC(=O)NCc1ccc(cc1)Br 1626a_100000174875_100000185746 [0,2,0,0,0,1|1,0,0]=4 15989 B13R1.14 C=CC(=O)NCc1ccc(cc1)Br 240690a_100000174875_200121576911 [0,2,0,0,0,1|1,0,0]=4 15990 B13R1.14 C=CC(=O)NCc1ccc(cc1)C 1626a_100000174908_100000185746 [0,2,0,0,0,1|1,0,0]=4 15991 B13R1.14 C=CC(=O)NCc1ccc(cc1)C 240690a_100000174908_200121576911 [0,2,0,0,0,1|1,0,0]=4 15992 B13R1.14 C=CC(=O)NCc1ccc(cc1)Cl 1626a_100000174871_100000185746 [0,2,0,0,0,1|1,0,0]=4 15993 B13R1.14 C=CC(=O)NCc1ccc(cc1)Cl 240690a_100000174871_200121576911 [0,2,0,0,0,1|1,0,0]=4 15994 B13R1.14 C=CC(=O)NCc1ccc(cc1)F 1626a_100000174882_100000185746 [0,2,0,0,0,1|1,0,0]=4 15995 B13R1.14 C=CC(=O)NCc1ccc(cc1)F 240690a_100000174882_200121576911 [0,2,0,0,0,1|1,0,0]=4 15996 B13R1.14 C=CC(=O)NCc1ccc(cc1)I 1626a_100016989417_100000185746 [0,2,0,0,0,1|1,0,0]=4 15997 B13R1.14 C=CC(=O)NCc1ccc(cc1)I 240690a_100016989417_200121576911 [0,2,0,0,0,1|1,0,0]=4 15998 B13R1.14 C=CC(=O)NCc1ccc(cc1)O 240690a_100000185549_200121576911 [0,2,0,0,0,1|1,0,0]=4 15999 B13R1.14 C=CC(C)OCc1ccc(cc1)Br 34a_100000695699_100000189115 [0,2,0,0,0,1|0,0,1]=4 16000 B13R1.14 C=CC(C)OCc1ccc(cc1)C 34a_100000695699_100000210814 [0,2,0,0,0,1|0,0,1]=4 16001 B13R1.14 C=CC(C)OCc1ccc(cc1)Cl 34a_100000695699_100000694040 [0,2,0,0,0,1|0,0,1]=4 16002 B13R1.14 C=CC(C)OCc1ccc(cc1)F 34a_100000695699_100000198546 [0,2,0,0,0,1|0,0,1]=4 16003 B13R1.14 C=CC(C)OCc1ccc(cc1)I 34a_100000695699_100000189116 [0,2,0,0,0,1|0,0,1]=4 16004 B13R1.14 C=CC(C)SCc1ccc(cc1)Br 62a_100011215867_100000189115 [0,2,0,0,0,1|0,0,1]=4 16005 B13R1.14 C=CC(C)SCc1ccc(cc1)C 62a_100011215867_100000210814 [0,2,0,0,0,1|0,0,1]=4 16006 B13R1.14 C=CC(C)SCc1ccc(cc1)Cl 62a_100011215867_100000187161 [0,2,0,0,0,1|0,0,1]=4 16007 B13R1.14 C=CC(C)SCc1ccc(cc1)F 62a_100011215867_100000187164 [0,2,0,0,0,1|0,0,1]=4 16008 B13R1.14 C=CC(C)SCc1ccc(cc1)I 62a_100011215867_100000189116 [0,2,0,0,0,1|0,0,1]=4 16009 B13R1.14 CCC(=O)CCc1ccc(cc1)Br 1458a_100000210414_100011740612 [0,2,0,0,0,1|1,0,0]=4 16010 B13R1.14 CCC(=O)CCc1ccc(cc1)Br 1458a_100000217147_100000210202 [0,2,0,0,0,1|1,0,0]=4 16011 B13R1.14 CCC(=O)CCc1ccc(cc1)C 1458a_100000210414_100011713686 [0,2,0,0,0,1|1,0,0]=4 16012 B13R1.14 CCC(=O)CCc1ccc(cc1)C 1458a_100000234883_100000210202 [0,2,0,0,0,1|1,0,0]=4 16013 B13R1.14 CCC(=O)CCc1ccc(cc1)Cl 1458a_100000210414_100011713675 [0,2,0,0,0,1|1,0,0]=4 16014 B13R1.14 CCC(=O)CCc1ccc(cc1)Cl 1458a_100000235379_100000210202 [0,2,0,0,0,1|1,0,0]=4 16015 B13R1.14 CCC(=O)CCc1ccc(cc1)F 1458a_100000198493_100000210202 [0,2,0,0,0,1|1,0,0]=4 16016 B13R1.14 CCC(=O)CCc1ccc(cc1)F 1458a_100000210414_100011217392 [0,2,0,0,0,1|1,0,0]=4 16017 B13R1.14 CCC(=O)CCc1ccc(cc1)I 1458a_100011217499_100000210202 [0,2,0,0,0,1|1,0,0]=4 16018 B13R1.14 CCC(=O)CCc1ccc(cc1)O 1458a_100000210414_100009816426 [0,2,0,0,0,1|1,0,0]=4 16019 B13R1.14 CCC(=O)CCc1ccc(cc1)O 1458a_100000742835_100000210202 [0,2,0,0,0,1|1,0,0]=4 16020 B13R1.14 CCC(=O)COc1ccc(cc1)Br 1458a_100000182358_100000210202 [0,2,0,0,0,1|1,0,0]=4 16021 B13R1.14 CCC(=O)COc1ccc(cc1)Br 7a_100000185759_100000747405 [0,2,0,0,0,1|1,0,0]=4 16022 B13R1.14 CCC(=O)COc1ccc(cc1)C 1458a_100000182360_100000210202 [0,2,0,0,0,1|1,0,0]=4 16023 B13R1.14 CCC(=O)COc1ccc(cc1)C 7a_100000210336_100000747405 [0,2,0,0,0,1|1,0,0]=4 16024 B13R1.14 CCC(=O)COc1ccc(cc1)Cl 1458a_100016990877_100000210202 [0,2,0,0,0,1|1,0,0]=4 16025 B13R1.14 CCC(=O)COc1ccc(cc1)Cl 7a_100000210216_100000747405 [0,2,0,0,0,1|1,0,0]=4 16026 B13R1.14 CCC(=O)COc1ccc(cc1)F 1458a_100000184765_100000210202 [0,2,0,0,0,1|1,0,0]=4 16027 B13R1.14 CCC(=O)COc1ccc(cc1)I 1458a_100000184369_100000210202 [0,2,0,0,0,1|1,0,0]=4 16028 B13R1.14 CCC(=O)COc1ccc(cc1)I 7a_100000212066_100000747405 [0,2,0,0,0,1|1,0,0]=4 16029 B13R1.14 CCC(=O)COc1ccc(cc1)O 1458a_100000031633_100000210202 [0,2,0,0,0,1|1,0,0]=4 16030 B13R1.14 CCC(=O)CSc1ccc(cc1)Br 1458a_100000179496_100000210202 [0,2,0,0,0,1|1,0,0]=4 16031 B13R1.14 CCC(=O)CSc1ccc(cc1)Br 62a_100000747405_100000752885 [0,2,0,0,0,1|1,0,0]=4 16032 B13R1.14 CCC(=O)CSc1ccc(cc1)Br 62a_100000752885_100000747405 [0,2,0,0,0,1|1,0,0]=4 16033 B13R1.14 CCC(=O)CSc1ccc(cc1)C 1458a_100000179497_100000210202 [0,2,0,0,0,1|1,0,0]=4 16034 B13R1.14 CCC(=O)CSc1ccc(cc1)C 62a_100000186775_100000747405 [0,2,0,0,0,1|1,0,0]=4 16035 B13R1.14 CCC(=O)CSc1ccc(cc1)C 62a_100000747405_100000186775 [0,2,0,0,0,1|1,0,0]=4 16036 B13R1.14 CCC(=O)CSc1ccc(cc1)Cl 1458a_100000178402_100000210202 [0,2,0,0,0,1|1,0,0]=4 16037 B13R1.14 CCC(=O)CSc1ccc(cc1)Cl 62a_100000747405_100000755918 [0,2,0,0,0,1|1,0,0]=4 16038 B13R1.14 CCC(=O)CSc1ccc(cc1)Cl 62a_100000755918_100000747405 [0,2,0,0,0,1|1,0,0]=4 16039 B13R1.14 CCC(=O)CSc1ccc(cc1)F 1458a_100000691584_100000210202 [0,2,0,0,0,1|1,0,0]=4 16040 B13R1.14 CCC(=O)CSc1ccc(cc1)F 62a_100000211213_100000747405 [0,2,0,0,0,1|1,0,0]=4 16041 B13R1.14 CCC(=O)CSc1ccc(cc1)F 62a_100000747405_100000211213 [0,2,0,0,0,1|1,0,0]=4 16042 B13R1.14 CCC(=O)CSc1ccc(cc1)N 62a_100000185761_100000747405 [0,2,0,0,0,1|1,0,0]=4 16043 B13R1.14 CCC(=O)CSc1ccc(cc1)N 62a_100000747405_100000185761 [0,2,0,0,0,1|1,0,0]=4 16044 B13R1.14 CCC(=O)CSc1ccc(cc1)O 62a_100000747405_100000185759 [0,2,0,0,0,1|1,0,0]=4 16045 B13R1.14 CCC(=O)NCc1ccc(cc1)Br 11a_100000174875_100000210414 [0,2,0,0,0,1|1,0,0]=4 16046 B13R1.14 CCC(=O)NCc1ccc(cc1)Br 1626a_100000174875_100000210414 [0,2,0,0,0,1|1,0,0]=4 16047 B13R1.14 CCC(=O)NCc1ccc(cc1)Br 240690a_100000174875_100000210414 [0,2,0,0,0,1|1,0,0]=4 16048 B13R1.14 CCC(=O)NCc1ccc(cc1)Br 527a_100000174875_100000210414 [0,2,0,0,0,1|1,0,0]=4 16049 B13R1.14 CCC(=O)NCc1ccc(cc1)C 11a_100000174908_100000210414 [0,2,0,0,0,1|1,0,0]=4 16050 B13R1.14 CCC(=O)NCc1ccc(cc1)C 1626a_100000174908_100000210414 [0,2,0,0,0,1|1,0,0]=4 16051 B13R1.14 CCC(=O)NCc1ccc(cc1)C 240690a_100000174908_100000210414 [0,2,0,0,0,1|1,0,0]=4 16052 B13R1.14 CCC(=O)NCc1ccc(cc1)C 527a_100000174908_100000210414 [0,2,0,0,0,1|1,0,0]=4 16053 B13R1.14 CCC(=O)NCc1ccc(cc1)Cl 11a_100000174871_100000210414 [0,2,0,0,0,1|1,0,0]=4 16054 B13R1.14 CCC(=O)NCc1ccc(cc1)Cl 1626a_100000174871_100000210414 [0,2,0,0,0,1|1,0,0]=4 16055 B13R1.14 CCC(=O)NCc1ccc(cc1)Cl 240690a_100000174871_100000210414 [0,2,0,0,0,1|1,0,0]=4 16056 B13R1.14 CCC(=O)NCc1ccc(cc1)Cl 527a_100000174871_100000210414 [0,2,0,0,0,1|1,0,0]=4 16057 B13R1.14 CCC(=O)NCc1ccc(cc1)F 11a_100000174882_100000210414 [0,2,0,0,0,1|1,0,0]=4 16058 B13R1.14 CCC(=O)NCc1ccc(cc1)F 1626a_100000174882_100000210414 [0,2,0,0,0,1|1,0,0]=4 16059 B13R1.14 CCC(=O)NCc1ccc(cc1)F 240690a_100000174882_100000210414 [0,2,0,0,0,1|1,0,0]=4 16060 B13R1.14 CCC(=O)NCc1ccc(cc1)F 527a_100000174882_100000210414 [0,2,0,0,0,1|1,0,0]=4 16061 B13R1.14 CCC(=O)NCc1ccc(cc1)I 11a_100016989417_100000210414 [0,2,0,0,0,1|1,0,0]=4 16062 B13R1.14 CCC(=O)NCc1ccc(cc1)I 1626a_100016989417_100000210414 [0,2,0,0,0,1|1,0,0]=4 16063 B13R1.14 CCC(=O)NCc1ccc(cc1)I 240690a_100016989417_100000210414 [0,2,0,0,0,1|1,0,0]=4 16064 B13R1.14 CCC(=O)NCc1ccc(cc1)I 527a_100016989417_100000210414 [0,2,0,0,0,1|1,0,0]=4 16065 B13R1.14 CCC(=O)NCc1ccc(cc1)O 240690a_100000185549_100000210414 [0,2,0,0,0,1|1,0,0]=4 16066 B13R1.14 CCC(=O)NCc1ccc(cc1)O 527a_100000185549_100000210414 [0,2,0,0,0,1|1,0,0]=4 16067 B13R1.14 CNC(=O)CCc1ccc(cc1)Br 11a_106832991635_100000217147 [0,2,0,0,0,1|1,0,0]=4 16068 B13R1.14 CNC(=O)CCc1ccc(cc1)Br 1626a_100102657272_100000217147 [0,2,0,0,0,1|1,0,0]=4 16069 B13R1.14 CNC(=O)CCc1ccc(cc1)Br 240690a_100102657272_100000217147 [0,2,0,0,0,1|1,0,0]=4 16070 B13R1.14 CNC(=O)CCc1ccc(cc1)Br 527a_100102657272_100000217147 [0,2,0,0,0,1|1,0,0]=4 16071 B13R1.14 CNC(=O)CCc1ccc(cc1)C 11a_106832991635_100000234883 [0,2,0,0,0,1|1,0,0]=4 16072 B13R1.14 CNC(=O)CCc1ccc(cc1)C 1626a_100102657272_100000234883 [0,2,0,0,0,1|1,0,0]=4 16073 B13R1.14 CNC(=O)CCc1ccc(cc1)C 240690a_100102657272_100000234883 [0,2,0,0,0,1|1,0,0]=4 16074 B13R1.14 CNC(=O)CCc1ccc(cc1)C 527a_100102657272_100000234883 [0,2,0,0,0,1|1,0,0]=4 16075 B13R1.14 CNC(=O)CCc1ccc(cc1)Cl 11a_106832991635_100000235379 [0,2,0,0,0,1|1,0,0]=4 16076 B13R1.14 CNC(=O)CCc1ccc(cc1)Cl 1626a_100102657272_100000235379 [0,2,0,0,0,1|1,0,0]=4 16077 B13R1.14 CNC(=O)CCc1ccc(cc1)Cl 240690a_100102657272_100000235379 [0,2,0,0,0,1|1,0,0]=4 16078 B13R1.14 CNC(=O)CCc1ccc(cc1)Cl 527a_100102657272_100000235379 [0,2,0,0,0,1|1,0,0]=4 16079 B13R1.14 CNC(=O)CCc1ccc(cc1)F 11a_106832991635_100000198493 [0,2,0,0,0,1|1,0,0]=4 16080 B13R1.14 CNC(=O)CCc1ccc(cc1)F 1626a_100102657272_100000198493 [0,2,0,0,0,1|1,0,0]=4 16081 B13R1.14 CNC(=O)CCc1ccc(cc1)F 240690a_100102657272_100000198493 [0,2,0,0,0,1|1,0,0]=4 16082 B13R1.14 CNC(=O)CCc1ccc(cc1)F 527a_100102657272_100000198493 [0,2,0,0,0,1|1,0,0]=4 16083 B13R1.14 CNC(=O)CCc1ccc(cc1)I 11a_106832991635_100011217499 [0,2,0,0,0,1|1,0,0]=4 16084 B13R1.14 CNC(=O)CCc1ccc(cc1)I 1626a_100102657272_100011217499 [0,2,0,0,0,1|1,0,0]=4 16085 B13R1.14 CNC(=O)CCc1ccc(cc1)I 240690a_100102657272_100011217499 [0,2,0,0,0,1|1,0,0]=4 16086 B13R1.14 CNC(=O)CCc1ccc(cc1)I 527a_100102657272_100011217499 [0,2,0,0,0,1|1,0,0]=4 16087 B13R1.14 CNC(=O)CCc1ccc(cc1)O 240690a_100102657272_100000742835 [0,2,0,0,0,1|1,0,0]=4 16088 B13R1.14 CNC(=O)CCc1ccc(cc1)O 271570a_203496583355_200010273138 [0,2,0,0,0,1|1,0,0]=4 16089 B13R1.14 CNC(=O)CNc1ccc(cc1)Br 2230a_100000210018_100000183359 [0,2,0,0,0,1|1,0,0]=4 16090 B13R1.14 CNC(=O)CNc1ccc(cc1)Br 34a_100000210018_100000183359 [0,2,0,0,0,1|1,0,0]=4 16091 B13R1.14 CNC(=O)CNc1ccc(cc1)C 34a_100000124888_100000183359 [0,2,0,0,0,1|1,0,0]=4 16092 B13R1.14 CNC(=O)CNc1ccc(cc1)Cl 2230a_100000210052_100000183359 [0,2,0,0,0,1|1,0,0]=4 16093 B13R1.14 CNC(=O)CNc1ccc(cc1)Cl 34a_100000210052_100000183359 [0,2,0,0,0,1|1,0,0]=4 16094 B13R1.14 CNC(=O)CNc1ccc(cc1)F 34a_100000185862_100000183359 [0,2,0,0,0,1|1,0,0]=4 16095 B13R1.14 CNC(=O)CNc1ccc(cc1)I 34a_100000185761_100000183359 [0,2,0,0,0,1|1,0,0]=4 16096 B13R1.14 CNC(=O)CNc1ccc(cc1)O 34a_100000185829_100000183359 [0,2,0,0,0,1|1,0,0]=4 16097 B13R1.14 CNC(=O)COc1ccc(cc1)Br 11a_106832991635_100000182358 [0,2,0,0,0,1|1,0,0]=4 16098 B13R1.14 CNC(=O)COc1ccc(cc1)Br 1626a_100102657272_100000182358 [0,2,0,0,0,1|1,0,0]=4 16099 B13R1.14 CNC(=O)COc1ccc(cc1)Br 240690a_100102657272_100000182358 [0,2,0,0,0,1|1,0,0]=4 16100 B13R1.14 CNC(=O)COc1ccc(cc1)Br 34a_100000185759_100000183359 [0,2,0,0,0,1|1,0,0]=4 16101 B13R1.14 CNC(=O)COc1ccc(cc1)Br 527a_100102657272_100000182358 [0,2,0,0,0,1|1,0,0]=4 16102 B13R1.14 CNC(=O)COc1ccc(cc1)Br 7a_100000185759_100000183359 [0,2,0,0,0,1|1,0,0]=4 16103 B13R1.14 CNC(=O)COc1ccc(cc1)C 11a_106832991635_100000182360 [0,2,0,0,0,1|1,0,0]=4 16104 B13R1.14 CNC(=O)COc1ccc(cc1)C 1626a_100102657272_100000182360 [0,2,0,0,0,1|1,0,0]=4 16105 B13R1.14 CNC(=O)COc1ccc(cc1)C 240690a_100102657272_100000182360 [0,2,0,0,0,1|1,0,0]=4 16106 B13R1.14 CNC(=O)COc1ccc(cc1)C 34a_100000210336_100000183359 [0,2,0,0,0,1|1,0,0]=4 16107 B13R1.14 CNC(=O)COc1ccc(cc1)C 527a_100102657272_100000182360 [0,2,0,0,0,1|1,0,0]=4 16108 B13R1.14 CNC(=O)COc1ccc(cc1)C 7a_100000210336_100000183359 [0,2,0,0,0,1|1,0,0]=4 16109 B13R1.14 CNC(=O)COc1ccc(cc1)Cl 11a_106832991635_100016990877 [0,2,0,0,0,1|1,0,0]=4 16110 B13R1.14 CNC(=O)COc1ccc(cc1)Cl 1626a_100102657272_100016990877 [0,2,0,0,0,1|1,0,0]=4 16111 B13R1.14 CNC(=O)COc1ccc(cc1)Cl 240690a_100102657272_100016990877 [0,2,0,0,0,1|1,0,0]=4 16112 B13R1.14 CNC(=O)COc1ccc(cc1)Cl 34a_100000210216_100000183359 [0,2,0,0,0,1|1,0,0]=4 16113 B13R1.14 CNC(=O)COc1ccc(cc1)Cl 527a_100102657272_100016990877 [0,2,0,0,0,1|1,0,0]=4 16114 B13R1.14 CNC(=O)COc1ccc(cc1)Cl 7a_100000210216_100000183359 [0,2,0,0,0,1|1,0,0]=4 16115 B13R1.14 CNC(=O)COc1ccc(cc1)F 11a_106832991635_100000184765 [0,2,0,0,0,1|1,0,0]=4 16116 B13R1.14 CNC(=O)COc1ccc(cc1)F 1626a_100102657272_100000184765 [0,2,0,0,0,1|1,0,0]=4 16117 B13R1.14 CNC(=O)COc1ccc(cc1)F 240690a_100102657272_100000184765 [0,2,0,0,0,1|1,0,0]=4 16118 B13R1.14 CNC(=O)COc1ccc(cc1)F 34a_100000210339_100000183359 [0,2,0,0,0,1|1,0,0]=4 16119 B13R1.14 CNC(=O)COc1ccc(cc1)F 527a_100102657272_100000184765 [0,2,0,0,0,1|1,0,0]=4 16120 B13R1.14 CNC(=O)COc1ccc(cc1)I 11a_106832991635_100000184369 [0,2,0,0,0,1|1,0,0]=4 16121 B13R1.14 CNC(=O)COc1ccc(cc1)I 1626a_100102657272_100000184369 [0,2,0,0,0,1|1,0,0]=4 16122 B13R1.14 CNC(=O)COc1ccc(cc1)I 240690a_100102657272_100000184369 [0,2,0,0,0,1|1,0,0]=4 16123 B13R1.14 CNC(=O)COc1ccc(cc1)I 34a_100000212066_100000183359 [0,2,0,0,0,1|1,0,0]=4 16124 B13R1.14 CNC(=O)COc1ccc(cc1)I 527a_100102657272_100000184369 [0,2,0,0,0,1|1,0,0]=4 16125 B13R1.14 CNC(=O)COc1ccc(cc1)I 7a_100000212066_100000183359 [0,2,0,0,0,1|1,0,0]=4 16126 B13R1.14 CNC(=O)COc1ccc(cc1)N 34a_100000185829_100000183359 [0,2,0,0,0,1|1,0,0]=4 16127 B13R1.14 CNC(=O)COc1ccc(cc1)O 240690a_100102657272_100000031633 [0,2,0,0,0,1|1,0,0]=4 16128 B13R1.14 CNC(=O)COc1ccc(cc1)O 271570a_203496583355_200000150405 [0,2,0,0,0,1|1,0,0]=4 16129 B13R1.14 CNC(=O)COc1ccc(cc1)O 527a_100102657272_100000031633 [0,2,0,0,0,1|1,0,0]=4 16130 B13R1.14 CNC(=O)CSc1ccc(cc1)Br 11a_106832991635_100000179496 [0,2,0,0,0,1|1,0,0]=4 16131 B13R1.14 CNC(=O)CSc1ccc(cc1)Br 1626a_100102657272_100000179496 [0,2,0,0,0,1|1,0,0]=4 16132 B13R1.14 CNC(=O)CSc1ccc(cc1)Br 240690a_100102657272_100000179496 [0,2,0,0,0,1|1,0,0]=4 16133 B13R1.14 CNC(=O)CSc1ccc(cc1)Br 527a_100102657272_100000179496 [0,2,0,0,0,1|1,0,0]=4 16134 B13R1.14 CNC(=O)CSc1ccc(cc1)Br 62a_100000183359_100000752885 [0,2,0,0,0,1|1,0,0]=4 16135 B13R1.14 CNC(=O)CSc1ccc(cc1)Br 62a_100000752885_100000183359 [0,2,0,0,0,1|1,0,0]=4 16136 B13R1.14 CNC(=O)CSc1ccc(cc1)C 11a_106832991635_100000179497 [0,2,0,0,0,1|1,0,0]=4 16137 B13R1.14 CNC(=O)CSc1ccc(cc1)C 1626a_100102657272_100000179497 [0,2,0,0,0,1|1,0,0]=4 16138 B13R1.14 CNC(=O)CSc1ccc(cc1)C 240690a_100102657272_100000179497 [0,2,0,0,0,1|1,0,0]=4 16139 B13R1.14 CNC(=O)CSc1ccc(cc1)C 527a_100102657272_100000179497 [0,2,0,0,0,1|1,0,0]=4 16140 B13R1.14 CNC(=O)CSc1ccc(cc1)C 62a_100000183359_100000186775 [0,2,0,0,0,1|1,0,0]=4 16141 B13R1.14 CNC(=O)CSc1ccc(cc1)C 62a_100000186775_100000183359 [0,2,0,0,0,1|1,0,0]=4 16142 B13R1.14 CNC(=O)CSc1ccc(cc1)Cl 11a_106832991635_100000178402 [0,2,0,0,0,1|1,0,0]=4 16143 B13R1.14 CNC(=O)CSc1ccc(cc1)Cl 1626a_100102657272_100000178402 [0,2,0,0,0,1|1,0,0]=4 16144 B13R1.14 CNC(=O)CSc1ccc(cc1)Cl 240690a_100102657272_100000178402 [0,2,0,0,0,1|1,0,0]=4 16145 B13R1.14 CNC(=O)CSc1ccc(cc1)Cl 527a_100102657272_100000178402 [0,2,0,0,0,1|1,0,0]=4 16146 B13R1.14 CNC(=O)CSc1ccc(cc1)Cl 62a_100000183359_100000755918 [0,2,0,0,0,1|1,0,0]=4 16147 B13R1.14 CNC(=O)CSc1ccc(cc1)Cl 62a_100000755918_100000183359 [0,2,0,0,0,1|1,0,0]=4 16148 B13R1.14 CNC(=O)CSc1ccc(cc1)F 11a_106832991635_100000691584 [0,2,0,0,0,1|1,0,0]=4 16149 B13R1.14 CNC(=O)CSc1ccc(cc1)F 1626a_100102657272_100000691584 [0,2,0,0,0,1|1,0,0]=4 16150 B13R1.14 CNC(=O)CSc1ccc(cc1)F 240690a_100102657272_100000691584 [0,2,0,0,0,1|1,0,0]=4 16151 B13R1.14 CNC(=O)CSc1ccc(cc1)F 527a_100102657272_100000691584 [0,2,0,0,0,1|1,0,0]=4 16152 B13R1.14 CNC(=O)CSc1ccc(cc1)F 62a_100000183359_100000211213 [0,2,0,0,0,1|1,0,0]=4 16153 B13R1.14 CNC(=O)CSc1ccc(cc1)F 62a_100000211213_100000183359 [0,2,0,0,0,1|1,0,0]=4 16154 B13R1.14 CNC(=O)CSc1ccc(cc1)N 62a_100000183359_100000185761 [0,2,0,0,0,1|1,0,0]=4 16155 B13R1.14 CNC(=O)CSc1ccc(cc1)N 62a_100000185761_100000183359 [0,2,0,0,0,1|1,0,0]=4 16156 B13R1.14 CNC(=O)CSc1ccc(cc1)O 62a_100000183359_100000185759 [0,2,0,0,0,1|1,0,0]=4 16157 B13R1.14 CNC(=O)NCc1ccc(cc1)Br 2708a_100000174875_106832991635 [0,2,0,0,0,1|1,0,0]=4 16158 B13R1.14 CNC(=O)NCc1ccc(cc1)Br 2708a_100102657272_100000174875 [0,2,0,0,0,1|1,0,0]=4 16159 B13R1.14 CNC(=O)NCc1ccc(cc1)Br 273464a_100000174875_100102657272 [0,2,0,0,0,1|1,0,0]=4 16160 B13R1.14 CNC(=O)NCc1ccc(cc1)Br 273464a_100102657272_100000174875 [0,2,0,0,0,1|1,0,0]=4 16161 B13R1.14 CNC(=O)NCc1ccc(cc1)Br 512a_100000174875_100102657272 [0,2,0,0,0,1|1,0,0]=4 16162 B13R1.14 CNC(=O)NCc1ccc(cc1)Br 512a_106832991638_100000174875 [0,2,0,0,0,1|1,0,0]=4 16163 B13R1.14 CNC(=O)NCc1ccc(cc1)C 2708a_100000174908_106832991635 [0,2,0,0,0,1|1,0,0]=4 16164 B13R1.14 CNC(=O)NCc1ccc(cc1)C 2708a_100102657272_100000174908 [0,2,0,0,0,1|1,0,0]=4 16165 B13R1.14 CNC(=O)NCc1ccc(cc1)C 273464a_100000174908_100102657272 [0,2,0,0,0,1|1,0,0]=4 16166 B13R1.14 CNC(=O)NCc1ccc(cc1)C 273464a_100102657272_100000174908 [0,2,0,0,0,1|1,0,0]=4 16167 B13R1.14 CNC(=O)NCc1ccc(cc1)C 512a_100000174908_100102657272 [0,2,0,0,0,1|1,0,0]=4 16168 B13R1.14 CNC(=O)NCc1ccc(cc1)C 512a_106832991638_100000174908 [0,2,0,0,0,1|1,0,0]=4 16169 B13R1.14 CNC(=O)NCc1ccc(cc1)Cl 2708a_100000174871_106832991635 [0,2,0,0,0,1|1,0,0]=4 16170 B13R1.14 CNC(=O)NCc1ccc(cc1)Cl 2708a_100102657272_100000174871 [0,2,0,0,0,1|1,0,0]=4 16171 B13R1.14 CNC(=O)NCc1ccc(cc1)Cl 273464a_100000174871_100102657272 [0,2,0,0,0,1|1,0,0]=4 16172 B13R1.14 CNC(=O)NCc1ccc(cc1)Cl 273464a_100102657272_100000174871 [0,2,0,0,0,1|1,0,0]=4 16173 B13R1.14 CNC(=O)NCc1ccc(cc1)Cl 512a_106832991638_100000174871 [0,2,0,0,0,1|1,0,0]=4 16174 B13R1.14 CNC(=O)NCc1ccc(cc1)F 2708a_100000174882_106832991635 [0,2,0,0,0,1|1,0,0]=4 16175 B13R1.14 CNC(=O)NCc1ccc(cc1)F 2708a_100102657272_100000174882 [0,2,0,0,0,1|1,0,0]=4 16176 B13R1.14 CNC(=O)NCc1ccc(cc1)F 273464a_100000174882_100102657272 [0,2,0,0,0,1|1,0,0]=4 16177 B13R1.14 CNC(=O)NCc1ccc(cc1)F 273464a_100102657272_100000174882 [0,2,0,0,0,1|1,0,0]=4 16178 B13R1.14 CNC(=O)NCc1ccc(cc1)F 512a_100000174882_100102657272 [0,2,0,0,0,1|1,0,0]=4 16179 B13R1.14 CNC(=O)NCc1ccc(cc1)F 512a_106832991638_100000174882 [0,2,0,0,0,1|1,0,0]=4 16180 B13R1.14 CNC(=O)NCc1ccc(cc1)I 2708a_100016989417_106832991635 [0,2,0,0,0,1|1,0,0]=4 16181 B13R1.14 CNC(=O)NCc1ccc(cc1)I 2708a_100102657272_100016989417 [0,2,0,0,0,1|1,0,0]=4 16182 B13R1.14 CNC(=O)NCc1ccc(cc1)I 273464a_100016989417_100102657272 [0,2,0,0,0,1|1,0,0]=4 16183 B13R1.14 CNC(=O)NCc1ccc(cc1)I 273464a_100102657272_100016989417 [0,2,0,0,0,1|1,0,0]=4 16184 B13R1.14 CNC(=O)NCc1ccc(cc1)I 512a_100016989417_100102657272 [0,2,0,0,0,1|1,0,0]=4 16185 B13R1.14 CNC(=O)NCc1ccc(cc1)I 512a_106832991638_100016989417 [0,2,0,0,0,1|1,0,0]=4 16186 B13R1.14 CNC(=O)NCc1ccc(cc1)O 2708a_100000185549_106832991635 [0,2,0,0,0,1|1,0,0]=4 16187 B13R1.14 CNC(=O)NCc1ccc(cc1)O 2708a_100102657272_100000185549 [0,2,0,0,0,1|1,0,0]=4 16188 B13R1.14 CNC(=O)NCc1ccc(cc1)O 273464a_100000185549_100102657272 [0,2,0,0,0,1|1,0,0]=4 16189 B13R1.14 CNC(=O)NCc1ccc(cc1)O 273464a_100102657272_100000185549 [0,2,0,0,0,1|1,0,0]=4 16190 B13R1.14 CNC(=O)NCc1ccc(cc1)O 512a_106832991638_100000185549 [0,2,0,0,0,1|1,0,0]=4 16191 B13R1.14 COC(=O)CCc1ccc(cc1)O 271570a_203496583355_100012357364 [0,2,0,0,0,1|1,0,0]=4 16192 B13R1.14 COC(=O)CNc1ccc(cc1)Br 2230a_100000210018_100000747449 [0,2,0,0,0,1|1,0,0]=4 16193 B13R1.14 COC(=O)CNc1ccc(cc1)Br 34a_100000210018_100000747449 [0,2,0,0,0,1|1,0,0]=4 16194 B13R1.14 COC(=O)CNc1ccc(cc1)C 34a_100000124888_100000747449 [0,2,0,0,0,1|1,0,0]=4 16195 B13R1.14 COC(=O)CNc1ccc(cc1)Cl 2230a_100000210052_100000747449 [0,2,0,0,0,1|1,0,0]=4 16196 B13R1.14 COC(=O)CNc1ccc(cc1)Cl 34a_100000210052_100000747449 [0,2,0,0,0,1|1,0,0]=4 16197 B13R1.14 COC(=O)CNc1ccc(cc1)F 34a_100000185862_100000747449 [0,2,0,0,0,1|1,0,0]=4 16198 B13R1.14 COC(=O)CNc1ccc(cc1)I 34a_100000185761_100000747449 [0,2,0,0,0,1|1,0,0]=4 16199 B13R1.14 COC(=O)CNc1ccc(cc1)O 34a_100000185829_100000747449 [0,2,0,0,0,1|1,0,0]=4 16200 B13R1.14 COC(=O)COc1ccc(cc1)Br 34a_100000185759_100000747449 [0,2,0,0,0,1|1,0,0]=4 16201 B13R1.14 COC(=O)COc1ccc(cc1)Br 7a_100000185759_100000747449 [0,2,0,0,0,1|1,0,0]=4 16202 B13R1.14 COC(=O)COc1ccc(cc1)C 34a_100000210336_100000747449 [0,2,0,0,0,1|1,0,0]=4 16203 B13R1.14 COC(=O)COc1ccc(cc1)C 7a_100000210336_100000747449 [0,2,0,0,0,1|1,0,0]=4 16204 B13R1.14 COC(=O)COc1ccc(cc1)Cl 34a_100000210216_100000747449 [0,2,0,0,0,1|1,0,0]=4 16205 B13R1.14 COC(=O)COc1ccc(cc1)Cl 7a_100000210216_100000747449 [0,2,0,0,0,1|1,0,0]=4 16206 B13R1.14 COC(=O)COc1ccc(cc1)F 34a_100000210339_100000747449 [0,2,0,0,0,1|1,0,0]=4 16207 B13R1.14 COC(=O)COc1ccc(cc1)I 34a_100000212066_100000747449 [0,2,0,0,0,1|1,0,0]=4 16208 B13R1.14 COC(=O)COc1ccc(cc1)I 7a_100000212066_100000747449 [0,2,0,0,0,1|1,0,0]=4 16209 B13R1.14 COC(=O)COc1ccc(cc1)N 34a_100000185829_100000747449 [0,2,0,0,0,1|1,0,0]=4 16210 B13R1.14 COC(=O)COc1ccc(cc1)O 271570a_203496583355_100000149925 [0,2,0,0,0,1|1,0,0]=4 16211 B13R1.14 COC(=O)CSc1ccc(cc1)Br 62a_100000747449_100000752885 [0,2,0,0,0,1|1,0,0]=4 16212 B13R1.14 COC(=O)CSc1ccc(cc1)Br 62a_100000752885_100000747449 [0,2,0,0,0,1|1,0,0]=4 16213 B13R1.14 COC(=O)CSc1ccc(cc1)C 62a_100000186775_100000747449 [0,2,0,0,0,1|1,0,0]=4 16214 B13R1.14 COC(=O)CSc1ccc(cc1)C 62a_100000747449_100000186775 [0,2,0,0,0,1|1,0,0]=4 16215 B13R1.14 COC(=O)CSc1ccc(cc1)Cl 62a_100000747449_100000755918 [0,2,0,0,0,1|1,0,0]=4 16216 B13R1.14 COC(=O)CSc1ccc(cc1)Cl 62a_100000755918_100000747449 [0,2,0,0,0,1|1,0,0]=4 16217 B13R1.14 COC(=O)CSc1ccc(cc1)F 62a_100000211213_100000747449 [0,2,0,0,0,1|1,0,0]=4 16218 B13R1.14 COC(=O)CSc1ccc(cc1)F 62a_100000747449_100000211213 [0,2,0,0,0,1|1,0,0]=4 16219 B13R1.14 COC(=O)CSc1ccc(cc1)N 62a_100000185761_100000747449 [0,2,0,0,0,1|1,0,0]=4 16220 B13R1.14 COC(=O)CSc1ccc(cc1)N 62a_100000747449_100000185761 [0,2,0,0,0,1|1,0,0]=4 16221 B13R1.14 COC(=O)CSc1ccc(cc1)O 62a_100000747449_100000185759 [0,2,0,0,0,1|1,0,0]=4 16222 B13R1.14 Cc1ccc(cc1)CCC(=O)CF 1458a_100000234883_100015361967 [0,2,0,0,0,1|1,0,0]=4 16223 B13R1.14 Cc1ccc(cc1)CCC(=O)CO 1458a_100000210174_100011713686 [0,2,0,0,0,1|1,0,0]=4 16224 B13R1.14 Cc1ccc(cc1)CNC(=O)CO 240690a_100000174908_100000210174 [0,2,0,0,0,1|1,0,0]=4 16225 B13R1.14 Cc1ccc(cc1)CNC(=O)CO 527a_100000174908_100000210174 [0,2,0,0,0,1|1,0,0]=4 16226 B13R1.14 Cc1ccc(cc1)OCC(=O)CF 1458a_100000182360_100015361967 [0,2,0,0,0,1|1,0,0]=4 16227 B13R1.14 Cc1ccc(cc1)SCC(=O)CF 1458a_100000179497_100015361967 [0,2,0,0,0,1|1,0,0]=4 16228 B13R1.14 O=C(CF)CCc1ccc(cc1)Br 1458a_100000217147_100015361967 [0,2,0,0,0,1|1,0,0]=4 16229 B13R1.14 O=C(CF)CCc1ccc(cc1)Cl 1458a_100000235379_100015361967 [0,2,0,0,0,1|1,0,0]=4 16230 B13R1.14 O=C(CF)CCc1ccc(cc1)F 1458a_100000198493_100015361967 [0,2,0,0,0,1|1,0,0]=4 16231 B13R1.14 O=C(CF)CCc1ccc(cc1)I 1458a_100011217499_100015361967 [0,2,0,0,0,1|1,0,0]=4 16232 B13R1.14 O=C(CF)CCc1ccc(cc1)O 1458a_100000742835_100015361967 [0,2,0,0,0,1|1,0,0]=4 16233 B13R1.14 O=C(CF)COc1ccc(cc1)Br 1458a_100000182358_100015361967 [0,2,0,0,0,1|1,0,0]=4 16234 B13R1.14 O=C(CF)COc1ccc(cc1)Cl 1458a_100016990877_100015361967 [0,2,0,0,0,1|1,0,0]=4 16235 B13R1.14 O=C(CF)COc1ccc(cc1)F 1458a_100000184765_100015361967 [0,2,0,0,0,1|1,0,0]=4 16236 B13R1.14 O=C(CF)COc1ccc(cc1)I 1458a_100000184369_100015361967 [0,2,0,0,0,1|1,0,0]=4 16237 B13R1.14 O=C(CF)COc1ccc(cc1)O 1458a_100000031633_100015361967 [0,2,0,0,0,1|1,0,0]=4 16238 B13R1.14 O=C(CF)CSc1ccc(cc1)Br 1458a_100000179496_100015361967 [0,2,0,0,0,1|1,0,0]=4 16239 B13R1.14 O=C(CF)CSc1ccc(cc1)Cl 1458a_100000178402_100015361967 [0,2,0,0,0,1|1,0,0]=4 16240 B13R1.14 O=C(CF)CSc1ccc(cc1)F 1458a_100000691584_100015361967 [0,2,0,0,0,1|1,0,0]=4 16241 B13R1.14 O=C(CO)CCc1ccc(cc1)Br 1458a_100000210174_100011740612 [0,2,0,0,0,1|1,0,0]=4 16242 B13R1.14 O=C(CO)CCc1ccc(cc1)Cl 1458a_100000210174_100011713675 [0,2,0,0,0,1|1,0,0]=4 16243 B13R1.14 O=C(CO)CCc1ccc(cc1)F 1458a_100000210174_100011217392 [0,2,0,0,0,1|1,0,0]=4 16244 B13R1.14 O=C(CO)CCc1ccc(cc1)O 1458a_100000210174_100009816426 [0,2,0,0,0,1|1,0,0]=4 16245 B13R1.14 O=C(CO)NCc1ccc(cc1)Br 240690a_100000174875_100000210174 [0,2,0,0,0,1|1,0,0]=4 16246 B13R1.14 O=C(CO)NCc1ccc(cc1)Br 527a_100000174875_100000210174 [0,2,0,0,0,1|1,0,0]=4 16247 B13R1.14 O=C(CO)NCc1ccc(cc1)Cl 240690a_100000174871_100000210174 [0,2,0,0,0,1|1,0,0]=4 16248 B13R1.14 O=C(CO)NCc1ccc(cc1)Cl 527a_100000174871_100000210174 [0,2,0,0,0,1|1,0,0]=4 16249 B13R1.14 O=C(CO)NCc1ccc(cc1)F 240690a_100000174882_100000210174 [0,2,0,0,0,1|1,0,0]=4 16250 B13R1.14 O=C(CO)NCc1ccc(cc1)F 527a_100000174882_100000210174 [0,2,0,0,0,1|1,0,0]=4 16251 B13R1.14 O=C(CO)NCc1ccc(cc1)I 240690a_100016989417_100000210174 [0,2,0,0,0,1|1,0,0]=4 16252 B13R1.14 O=C(CO)NCc1ccc(cc1)I 527a_100016989417_100000210174 [0,2,0,0,0,1|1,0,0]=4 16253 B13R1.14 O=C(CO)NCc1ccc(cc1)O 240690a_100000185549_100000210174 [0,2,0,0,0,1|1,0,0]=4 16254 B13R1.14 O=C(CO)NCc1ccc(cc1)O 527a_100000185549_100000210174 [0,2,0,0,0,1|1,0,0]=4 16255 B13R1.132 C=C(C)CC(=O)c1ccc(cc1)Br 1458a_100000185839_100000748629 [0,2,0,0,0,1|0,0,0]=3 16256 B13R1.132 C=C(C)CC(=O)c1ccc(cc1)C 1458a_100000188618_100000748629 [0,2,0,0,0,1|0,0,0]=3 16257 B13R1.132 C=C(C)CC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000748629 [0,2,0,0,0,1|0,0,0]=3 16258 B13R1.132 C=C(C)CC(=O)c1ccc(cc1)F 1458a_100000187176_100000748629 [0,2,0,0,0,1|0,0,0]=3 16259 B13R1.132 C=C(C)CC(=O)c1ccc(cc1)I 1458a_100000187904_100000748629 [0,2,0,0,0,1|0,0,0]=3 16260 B13R1.132 C=C(C)CC(=O)c1ccc(cc1)O 1458a_100000212099_100000748629 [0,2,0,0,0,1|0,0,0]=3 16261 B13R1.132 C=C(C)CN(C)c1ccc(cc1)Br 2230a_100000219623_100000748629 [0,2,0,0,0,1|0,0,0]=3 16262 B13R1.132 C=C(C)CN(C)c1ccc(cc1)Br 269982a_100000219623_100000748629 [0,2,0,0,0,1|0,0,0]=3 16263 B13R1.132 C=C(C)CN(C)c1ccc(cc1)Br 34a_100000219623_100000748629 [0,2,0,0,0,1|0,0,0]=3 16264 B13R1.132 C=C(C)CN(C)c1ccc(cc1)C 2230a_100000219977_100000748629 [0,2,0,0,0,1|0,0,0]=3 16265 B13R1.132 C=C(C)CN(C)c1ccc(cc1)C 269982a_100000219977_100000748629 [0,2,0,0,0,1|0,0,0]=3 16266 B13R1.132 C=C(C)CN(C)c1ccc(cc1)C 34a_100000219977_100000748629 [0,2,0,0,0,1|0,0,0]=3 16267 B13R1.132 C=C(C)CN(C)c1ccc(cc1)Cl 2230a_100020629279_100000748629 [0,2,0,0,0,1|0,0,0]=3 16268 B13R1.132 C=C(C)CN(C)c1ccc(cc1)Cl 269982a_100020629279_100000748629 [0,2,0,0,0,1|0,0,0]=3 16269 B13R1.132 C=C(C)CN(C)c1ccc(cc1)Cl 34a_100020629279_100000748629 [0,2,0,0,0,1|0,0,0]=3 16270 B13R1.132 C=C(C)CN(C)c1ccc(cc1)F 2230a_100000219829_100000748629 [0,2,0,0,0,1|0,0,0]=3 16271 B13R1.132 C=C(C)CN(C)c1ccc(cc1)F 269982a_100000219829_100000748629 [0,2,0,0,0,1|0,0,0]=3 16272 B13R1.132 C=C(C)CN(C)c1ccc(cc1)F 34a_100000219829_100000748629 [0,2,0,0,0,1|0,0,0]=3 16273 B13R1.132 C=C(C)CN(C)c1ccc(cc1)I 2230a_100000743151_100000748629 [0,2,0,0,0,1|0,0,0]=3 16274 B13R1.132 C=C(C)CN(C)c1ccc(cc1)I 269982a_100000743151_100000748629 [0,2,0,0,0,1|0,0,0]=3 16275 B13R1.132 C=C(C)CN(C)c1ccc(cc1)I 34a_100000743151_100000748629 [0,2,0,0,0,1|0,0,0]=3 16276 B13R1.132 C=C(C)CN(C)c1ccc(cc1)O 269982a_100000182112_100000748629 [0,2,0,0,0,1|0,0,0]=3 16277 B13R1.132 C=C(C)CN(C)c1ccc(cc1)O 34a_100000182112_100000748629 [0,2,0,0,0,1|0,0,0]=3 16278 B13R1.132 C=C(C)CN(C)c1ccc(cn1)Br 27a_100000225649_100000686858 [0,2,0,0,0,1|1,0,0]=4 16279 B13R1.132 C=C(F)CC(=O)c1ccc(cc1)Br 1458a_100000185839_100009893438 [0,2,0,0,0,1|1,0,0]=4 16280 B13R1.132 C=C(F)CC(=O)c1ccc(cc1)C 1458a_100000188618_100009893438 [0,2,0,0,0,1|1,0,0]=4 16281 B13R1.132 C=C(F)CC(=O)c1ccc(cc1)Cl 1458a_100000210187_100009893438 [0,2,0,0,0,1|1,0,0]=4 16282 B13R1.132 C=C(F)CC(=O)c1ccc(cc1)F 1458a_100000187176_100009893438 [0,2,0,0,0,1|1,0,0]=4 16283 B13R1.132 C=C(F)CC(=O)c1ccc(cc1)I 1458a_100000187904_100009893438 [0,2,0,0,0,1|1,0,0]=4 16284 B13R1.132 C=C(F)CC(=O)c1ccc(cc1)O 1458a_100000212099_100009893438 [0,2,0,0,0,1|1,0,0]=4 16285 B13R1.132 C=C(F)CN(C)c1ccc(cc1)Br 2230a_100000219623_100009893438 [0,2,0,0,0,1|1,0,0]=4 16286 B13R1.132 C=C(F)CN(C)c1ccc(cc1)Br 269982a_100000219623_100009893438 [0,2,0,0,0,1|1,0,0]=4 16287 B13R1.132 C=C(F)CN(C)c1ccc(cc1)Br 34a_100000219623_100009893438 [0,2,0,0,0,1|1,0,0]=4 16288 B13R1.132 C=C(F)CN(C)c1ccc(cc1)C 2230a_100000219977_100009893438 [0,2,0,0,0,1|1,0,0]=4 16289 B13R1.132 C=C(F)CN(C)c1ccc(cc1)C 269982a_100000219977_100009893438 [0,2,0,0,0,1|1,0,0]=4 16290 B13R1.132 C=C(F)CN(C)c1ccc(cc1)C 34a_100000219977_100009893438 [0,2,0,0,0,1|1,0,0]=4 16291 B13R1.132 C=C(F)CN(C)c1ccc(cc1)Cl 2230a_100020629279_100009893438 [0,2,0,0,0,1|1,0,0]=4 16292 B13R1.132 C=C(F)CN(C)c1ccc(cc1)Cl 269982a_100020629279_100009893438 [0,2,0,0,0,1|1,0,0]=4 16293 B13R1.132 C=C(F)CN(C)c1ccc(cc1)Cl 34a_100020629279_100009893438 [0,2,0,0,0,1|1,0,0]=4 16294 B13R1.132 C=C(F)CN(C)c1ccc(cc1)F 2230a_100000219829_100009893438 [0,2,0,0,0,1|1,0,0]=4 16295 B13R1.132 C=C(F)CN(C)c1ccc(cc1)F 269982a_100000219829_100009893438 [0,2,0,0,0,1|1,0,0]=4 16296 B13R1.132 C=C(F)CN(C)c1ccc(cc1)F 34a_100000219829_100009893438 [0,2,0,0,0,1|1,0,0]=4 16297 B13R1.132 C=C(F)CN(C)c1ccc(cc1)I 2230a_100000743151_100009893438 [0,2,0,0,0,1|1,0,0]=4 16298 B13R1.132 C=C(F)CN(C)c1ccc(cc1)I 269982a_100000743151_100009893438 [0,2,0,0,0,1|1,0,0]=4 16299 B13R1.132 C=C(F)CN(C)c1ccc(cc1)I 34a_100000743151_100009893438 [0,2,0,0,0,1|1,0,0]=4 16300 B13R1.132 C=C(F)CN(C)c1ccc(cc1)O 269982a_100000182112_100009893438 [0,2,0,0,0,1|1,0,0]=4 16301 B13R1.132 C=C(F)CN(C)c1ccc(cc1)O 34a_100000182112_100009893438 [0,2,0,0,0,1|1,0,0]=4 16302 B13R1.132 CC(=O)CC(=O)c1ccc(cc1)Br 1458a_100000070787_100000188085 [0,2,0,0,0,1|1,0,0]=4 16303 B13R1.132 CC(=O)CC(=O)c1ccc(cc1)C 1458a_100000070787_100000211441 [0,2,0,0,0,1|1,0,0]=4 16304 B13R1.132 CC(=O)CC(=O)c1ccc(cc1)Cl 1458a_100000070787_100000211071 [0,2,0,0,0,1|1,0,0]=4 16305 B13R1.132 CC(=O)CC(=O)c1ccc(cc1)F 1458a_100000070787_100000211279 [0,2,0,0,0,1|1,0,0]=4 16306 B13R1.132 CC(=O)CC(=O)c1ccc(cc1)I 1458a_100000070787_100011216261 [0,2,0,0,0,1|1,0,0]=4 16307 B13R1.132 CC(=O)CC(=O)c1ccc(cc1)O 1458a_100000070787_100009814261 [0,2,0,0,0,1|1,0,0]=4 16308 B13R1.132 CC(=O)CC(=O)c1ccc(cc1)O 271570a_203496583355_100000184285 [0,2,0,0,0,1|1,0,0]=4 16309 B13R1.132 CC(=O)CC(C)c1ccc(cc1)C 1458a_100011240733_200000210301 [0,2,0,0,0,1|1,0,0]=4 16310 B13R1.132 CC(=O)CC(O)c1ccc(cc1)Cl 1458a_100000070787_200011996143 [0,2,0,0,0,1|1,0,0]=4 16311 B13R1.132 CC(=O)C[C@H](O)c1ccc(cc1)F 1458a_100000070787_100000720402 [0,2,0,0,0,1|1,0,0]=4 16312 B13R1.132 CC(=O)NC(C)c1ccc(cc1)O 271570a_203496583355_100000153805 [0,2,0,0,0,1|1,0,0]=4 16313 B13R1.132 CC(=O)N[C@@H](C)c1ccc(cc1)F 11a_100025705893_100015343762 [0,2,0,0,0,1|1,0,0]=4 16314 B13R1.132 CC(=O)N[C@@H](C)c1ccc(cc1)F 1626a_100025705893_100015343762 [0,2,0,0,0,1|1,0,0]=4 16315 B13R1.132 CC(=O)N[C@@H](C)c1ccc(cc1)F 240690a_100025705893_100015343762 [0,2,0,0,0,1|1,0,0]=4 16316 B13R1.132 CC(=O)N[C@@H](C)c1ccc(cc1)F 527a_100025705893_100103153847 [0,2,0,0,0,1|1,0,0]=4 16317 B13R1.132 CC(=O)N[C@@H](C)c1ccc(cc1)I 11a_100000753911_100015343762 [0,2,0,0,0,1|1,0,0]=4 16318 B13R1.132 CC(=O)N[C@@H](C)c1ccc(cc1)I 1626a_100000753911_100015343762 [0,2,0,0,0,1|1,0,0]=4 16319 B13R1.132 CC(=O)N[C@@H](C)c1ccc(cc1)I 240690a_100000753911_100015343762 [0,2,0,0,0,1|1,0,0]=4 16320 B13R1.132 CC(=O)N[C@@H](C)c1ccc(cc1)I 527a_100000753911_100103153847 [0,2,0,0,0,1|1,0,0]=4 16321 B13R1.132 CC(=O)N[C@@H](C)c1ccc(cc1)O 240690a_100161106496_100015343762 [0,2,0,0,0,1|1,0,0]=4 16322 B13R1.132 CC(=O)N[C@H](C)c1ccc(cc1)Br 11a_100000720352_100015343762 [0,2,0,0,0,1|1,0,0]=4 16323 B13R1.132 CC(=O)N[C@H](C)c1ccc(cc1)Br 1626a_100000720352_100015343762 [0,2,0,0,0,1|1,0,0]=4 16324 B13R1.132 CC(=O)N[C@H](C)c1ccc(cc1)Br 240690a_100000720352_100015343762 [0,2,0,0,0,1|1,0,0]=4 16325 B13R1.132 CC(=O)N[C@H](C)c1ccc(cc1)Br 527a_100000720352_100103153847 [0,2,0,0,0,1|1,0,0]=4 16326 B13R1.132 CC(=O)N[C@H](C)c1ccc(cc1)C 11a_100016988085_100015343762 [0,2,0,0,0,1|1,0,0]=4 16327 B13R1.132 CC(=O)N[C@H](C)c1ccc(cc1)C 1626a_100016988085_100015343762 [0,2,0,0,0,1|1,0,0]=4 16328 B13R1.132 CC(=O)N[C@H](C)c1ccc(cc1)C 240690a_100016988085_100015343762 [0,2,0,0,0,1|1,0,0]=4 16329 B13R1.132 CC(=O)N[C@H](C)c1ccc(cc1)C 527a_100016988085_100103153847 [0,2,0,0,0,1|1,0,0]=4 16330 B13R1.132 CC(=O)N[C@H](C)c1ccc(cc1)Cl 11a_100015205461_100015343762 [0,2,0,0,0,1|1,0,0]=4 16331 B13R1.132 CC(=O)N[C@H](C)c1ccc(cc1)Cl 1626a_100015205461_100015343762 [0,2,0,0,0,1|1,0,0]=4 16332 B13R1.132 CC(=O)N[C@H](C)c1ccc(cc1)Cl 240690a_100015205461_100015343762 [0,2,0,0,0,1|1,0,0]=4 16333 B13R1.132 CC(=O)N[C@H](C)c1ccc(cc1)Cl 527a_100015205461_100103153847 [0,2,0,0,0,1|1,0,0]=4 16334 B13R1.132 Cc1ccc(cc1)C(C)CC(=O)[13CH3] 1458a_100011240733_200025704644 [0,2,0,0,0,1|1,0,0]=4 16335 B13R1.133 C=C(C)C(=O)Cc1ccc(cc1)Br 1458a_100000185857_100000189115 [0,2,0,0,0,1|0,0,0]=3 16336 B13R1.133 C=C(C)C(=O)Cc1ccc(cc1)C 1458a_100000185857_100000210814 [0,2,0,0,0,1|0,0,0]=3 16337 B13R1.133 C=C(C)C(=O)Cc1ccc(cc1)Cl 1458a_100000185857_100000694040 [0,2,0,0,0,1|0,0,0]=3 16338 B13R1.133 C=C(C)C(=O)Cc1ccc(cc1)F 1458a_100000185857_100000198546 [0,2,0,0,0,1|0,0,0]=3 16339 B13R1.133 C=C(C)C(=O)Cc1ccc(cc1)I 1458a_100000185857_100000189116 [0,2,0,0,0,1|0,0,0]=3 16340 B13R1.133 C=C(C)C(=O)Cc1ccc(cn1)Br 1458a_100000185857_100000702658 [0,2,0,0,0,1|1,0,0]=4 16341 B13R1.133 C=C(C)C(=O)Cc1ccc(cn1)C 1458a_100000185857_100000691093 [0,2,0,0,0,1|1,0,0]=4 16342 B13R1.133 C=C(C)C(=O)Cc1ccc(cn1)Cl 1458a_100000185857_100012066911 [0,2,0,0,0,1|1,0,0]=4 16343 B13R1.133 C=C(C)C(=O)Cc1ccc(cn1)F 1458a_100000185857_100000703193 [0,2,0,0,0,1|1,0,0]=4 16344 B13R1.133 C=C(C)C(=O)Cc1ccc(nc1)Br 1458a_100000185857_100009831999 [0,2,0,0,0,1|1,0,0]=4 16345 B13R1.133 C=C(C)C(=O)Cc1ccc(nc1)C 1458a_100000185857_100016987292 [0,2,0,0,0,1|1,0,0]=4 16346 B13R1.133 C=C(C)C(=O)Cc1ccc(nc1)Cl 1458a_100000185857_100000735431 [0,2,0,0,0,1|1,0,0]=4 16347 B13R1.133 C=C(C)C(=O)Cc1ccc(nc1)F 1458a_100000185857_100009820150 [0,2,0,0,0,1|1,0,0]=4 16348 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)Br 11a_100000210018_100000185857 [0,2,0,0,0,1|0,0,1]=4 16349 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)Br 1626a_100000210018_100000185857 [0,2,0,0,0,1|0,0,1]=4 16350 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)Br 22a_100000210018_100000185857 [0,2,0,0,0,1|0,0,1]=4 16351 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)C 11a_100000124888_100000185857 [0,2,0,0,0,1|0,0,1]=4 16352 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)C 1626a_100000124888_100000185857 [0,2,0,0,0,1|0,0,1]=4 16353 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)C 22a_100000124888_100000185857 [0,2,0,0,0,1|0,0,1]=4 16354 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000185857 [0,2,0,0,0,1|0,0,1]=4 16355 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000185857 [0,2,0,0,0,1|0,0,1]=4 16356 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000185857 [0,2,0,0,0,1|0,0,1]=4 16357 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)F 11a_100000185862_100000185857 [0,2,0,0,0,1|0,0,1]=4 16358 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)F 1626a_100000185862_100000185857 [0,2,0,0,0,1|0,0,1]=4 16359 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)F 22a_100000185862_100000185857 [0,2,0,0,0,1|0,0,1]=4 16360 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)I 11a_100000185761_100000185857 [0,2,0,0,0,1|0,0,1]=4 16361 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)I 1626a_100000185761_100000185857 [0,2,0,0,0,1|0,0,1]=4 16362 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)I 22a_100000185761_100000185857 [0,2,0,0,0,1|0,0,1]=4 16363 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)O 22a_100000185829_100000185857 [0,2,0,0,0,1|0,0,1]=4 16364 B13R1.133 CC(=O)C(C)Cc1ccc(cc1)Br 1458a_100000695199_200000210301 [0,2,0,0,0,1|1,0,0]=4 16365 B13R1.133 CC(=O)C(C)Cc1ccc(cc1)F 1458a_100000746122_200000210301 [0,2,0,0,0,1|1,0,0]=4 16366 B13R1.133 CC(=O)C(C)Nc1ccc(cc1)Br 2230a_100000210018_100009814033 [0,2,0,0,0,1|1,0,0]=4 16367 B13R1.133 CC(=O)C(C)Nc1ccc(cc1)Cl 2230a_100000210052_100009814033 [0,2,0,0,0,1|1,0,0]=4 16368 B13R1.133 CC(=O)C(C)Oc1ccc(cc1)Br 1458a_100000181392_200000210301 [0,2,0,0,0,1|1,0,0]=4 16369 B13R1.133 CC(=O)C(C)Oc1ccc(cc1)Br 7a_100000185759_100000179758 [0,2,0,0,0,1|1,0,0]=4 16370 B13R1.133 CC(=O)C(C)Oc1ccc(cc1)C 1458a_100000183867_200000210301 [0,2,0,0,0,1|1,0,0]=4 16371 B13R1.133 CC(=O)C(C)Oc1ccc(cc1)C 7a_100000210336_100000179758 [0,2,0,0,0,1|1,0,0]=4 16372 B13R1.133 CC(=O)C(C)Oc1ccc(cc1)Cl 1458a_100000184027_200000210301 [0,2,0,0,0,1|1,0,0]=4 16373 B13R1.133 CC(=O)C(C)Oc1ccc(cc1)Cl 7a_100000210216_100000179758 [0,2,0,0,0,1|1,0,0]=4 16374 B13R1.133 CC(=O)C(C)Oc1ccc(cc1)F 1458a_100000203723_200000210301 [0,2,0,0,0,1|1,0,0]=4 16375 B13R1.133 CC(=O)C(C)Oc1ccc(cc1)I 7a_100000212066_100000179758 [0,2,0,0,0,1|1,0,0]=4 16376 B13R1.133 CC(=O)C(C)Sc1ccc(cc1)Br 62a_100000752885_100009814033 [0,2,0,0,0,1|1,0,0]=4 16377 B13R1.133 CC(=O)C(C)Sc1ccc(cc1)Br 62a_100009814033_100000752885 [0,2,0,0,0,1|1,0,0]=4 16378 B13R1.133 CC(=O)C(C)Sc1ccc(cc1)C 1458a_100000181072_200000210301 [0,2,0,0,0,1|1,0,0]=4 16379 B13R1.133 CC(=O)C(C)Sc1ccc(cc1)C 62a_100000186775_100009814033 [0,2,0,0,0,1|1,0,0]=4 16380 B13R1.133 CC(=O)C(C)Sc1ccc(cc1)C 62a_100009814033_100000186775 [0,2,0,0,0,1|1,0,0]=4 16381 B13R1.133 CC(=O)C(C)Sc1ccc(cc1)Cl 1458a_100000178403_200000210301 [0,2,0,0,0,1|1,0,0]=4 16382 B13R1.133 CC(=O)C(C)Sc1ccc(cc1)Cl 62a_100000755918_100009814033 [0,2,0,0,0,1|1,0,0]=4 16383 B13R1.133 CC(=O)C(C)Sc1ccc(cc1)Cl 62a_100009814033_100000755918 [0,2,0,0,0,1|1,0,0]=4 16384 B13R1.133 CC(=O)C(C)Sc1ccc(cc1)F 1458a_100000181075_200000210301 [0,2,0,0,0,1|1,0,0]=4 16385 B13R1.133 CC(=O)C(C)Sc1ccc(cc1)F 62a_100000211213_100009814033 [0,2,0,0,0,1|1,0,0]=4 16386 B13R1.133 CC(=O)C(C)Sc1ccc(cc1)F 62a_100009814033_100000211213 [0,2,0,0,0,1|1,0,0]=4 16387 B13R1.133 CC(=O)C(C)Sc1ccc(cc1)N 62a_100000185761_100009814033 [0,2,0,0,0,1|1,0,0]=4 16388 B13R1.133 CC(=O)C(C)Sc1ccc(cc1)N 62a_100009814033_100000185761 [0,2,0,0,0,1|1,0,0]=4 16389 B13R1.133 CC(=O)C(C)Sc1ccc(cc1)O 62a_100009814033_100000185759 [0,2,0,0,0,1|1,0,0]=4 16390 B13R1.133 CC(=O)C(O)Cc1ccc(cc1)Cl 1458a_100012362158_200000210301 [0,2,0,0,0,1|1,0,0]=4 16391 B13R1.133 CC(=O)C(O)Cc1ccc(cc1)F 1458a_100012179405_200000210301 [0,2,0,0,0,1|1,0,0]=4 16392 B13R1.133 CC(=O)C(O)Cc1ccc(cc1)O 1458a_100015278814_200000210301 [0,2,0,0,0,1|1,0,0]=4 16393 B13R1.133 CC(=O)N(C)Cc1ccc(cc1)Br 11a_100000180866_100015343762 [0,2,0,0,0,1|1,0,0]=4 16394 B13R1.133 CC(=O)N(C)Cc1ccc(cc1)Br 1626a_100000180866_100015343762 [0,2,0,0,0,1|1,0,0]=4 16395 B13R1.133 CC(=O)N(C)Cc1ccc(cc1)Br 240690a_100000180866_100015343762 [0,2,0,0,0,1|1,0,0]=4 16396 B13R1.133 CC(=O)N(C)Cc1ccc(cc1)Br 527a_100000180866_100103153847 [0,2,0,0,0,1|1,0,0]=4 16397 B13R1.133 CC(=O)N(C)Cc1ccc(cc1)C 11a_100000744650_100015343762 [0,2,0,0,0,1|1,0,0]=4 16398 B13R1.133 CC(=O)N(C)Cc1ccc(cc1)C 1626a_100000744650_100015343762 [0,2,0,0,0,1|1,0,0]=4 16399 B13R1.133 CC(=O)N(C)Cc1ccc(cc1)C 240690a_100000744650_100015343762 [0,2,0,0,0,1|1,0,0]=4 16400 B13R1.133 CC(=O)N(C)Cc1ccc(cc1)C 527a_100000744650_100103153847 [0,2,0,0,0,1|1,0,0]=4 16401 B13R1.133 CC(=O)N(C)Cc1ccc(cc1)Cl 11a_100000184517_100015343762 [0,2,0,0,0,1|1,0,0]=4 16402 B13R1.133 CC(=O)N(C)Cc1ccc(cc1)Cl 1626a_100000184517_100015343762 [0,2,0,0,0,1|1,0,0]=4 16403 B13R1.133 CC(=O)N(C)Cc1ccc(cc1)Cl 240690a_100000184517_100015343762 [0,2,0,0,0,1|1,0,0]=4 16404 B13R1.133 CC(=O)N(C)Cc1ccc(cc1)Cl 527a_100000184517_100103153847 [0,2,0,0,0,1|1,0,0]=4 16405 B13R1.133 CC(=O)N(C)Cc1ccc(cc1)F 11a_100000184576_100015343762 [0,2,0,0,0,1|1,0,0]=4 16406 B13R1.133 CC(=O)N(C)Cc1ccc(cc1)F 1626a_100000184576_100015343762 [0,2,0,0,0,1|1,0,0]=4 16407 B13R1.133 CC(=O)N(C)Cc1ccc(cc1)F 240690a_100000184576_100015343762 [0,2,0,0,0,1|1,0,0]=4 16408 B13R1.133 CC(=O)N(C)Cc1ccc(cc1)F 527a_100000184576_100103153847 [0,2,0,0,0,1|1,0,0]=4 16409 B13R1.133 CC(=O)N(C)Cc1ccc(cc1)O 240690a_100000207500_100015343762 [0,2,0,0,0,1|1,0,0]=4 16410 B13R1.133 CC(=O)N(C)Cc1ccc(cc1)O 527a_100000207500_100103153847 [0,2,0,0,0,1|1,0,0]=4 16411 B13R1.133 CC(=O)[C@@H](C)Oc1ccc(cc1)O 1458a_100000005562_200000210301 [0,2,0,0,0,1|1,0,0]=4 16412 B13R1.133 CC(=O)[C@@H](O)Cc1ccc(cc1)Br 1458a_200015644258_200000210301 [0,2,0,0,0,1|1,0,0]=4 16413 B13R1.133 CC(Cc1ccc(cc1)Br)C(=O)[13CH3] 1458a_100000695199_200025704644 [0,2,0,0,0,1|1,0,0]=4 16414 B13R1.133 CC(Cc1ccc(cc1)F)C(=O)[13CH3] 1458a_100000746122_200025704644 [0,2,0,0,0,1|1,0,0]=4 16415 B13R1.133 CC(Oc1ccc(cc1)Br)C(=O)[13CH3] 1458a_100000181392_200025704644 [0,2,0,0,0,1|1,0,0]=4 16416 B13R1.133 CC(Oc1ccc(cc1)Cl)C(=O)[13CH3] 1458a_100000184027_200025704644 [0,2,0,0,0,1|1,0,0]=4 16417 B13R1.133 CC(Oc1ccc(cc1)F)C(=O)[13CH3] 1458a_100000203723_200025704644 [0,2,0,0,0,1|1,0,0]=4 16418 B13R1.133 CC(Sc1ccc(cc1)Cl)C(=O)[13CH3] 1458a_100000178403_200025704644 [0,2,0,0,0,1|1,0,0]=4 16419 B13R1.133 CC(Sc1ccc(cc1)F)C(=O)[13CH3] 1458a_100000181075_200025704644 [0,2,0,0,0,1|1,0,0]=4 16420 B13R1.133 C[C@@H](Oc1ccc(cc1)O)C(=O)[13CH3] 1458a_100000005562_200025704644 [0,2,0,0,0,1|1,0,0]=4 16421 B13R1.133 Cc1ccc(cc1)OC(C)C(=O)[13CH3] 1458a_100000183867_200025704644 [0,2,0,0,0,1|1,0,0]=4 16422 B13R1.133 Cc1ccc(cc1)SC(C)C(=O)[13CH3] 1458a_100000181072_200025704644 [0,2,0,0,0,1|1,0,0]=4 16423 B13R1.133 [13CH3]C(=O)C(O)Cc1ccc(cc1)Cl 1458a_100012362158_200025704644 [0,2,0,0,0,1|1,0,0]=4 16424 B13R1.133 [13CH3]C(=O)C(O)Cc1ccc(cc1)F 1458a_100012179405_200025704644 [0,2,0,0,0,1|1,0,0]=4 16425 B13R1.133 [13CH3]C(=O)C(O)Cc1ccc(cc1)O 1458a_100015278814_200025704644 [0,2,0,0,0,1|1,0,0]=4 16426 B13R1.133 [13CH3]C(=O)[C@@H](O)Cc1ccc(cc1)Br 1458a_200015644258_200025704644 [0,2,0,0,0,1|1,0,0]=4 16427 B13R1.164 C=C(C)CNc1ccc(cc1Br)Br 34a_100000211012_100000748629 [0,2,0,0,0,1|0,0,0]=3 16428 B13R1.164 C=C(C)CNc1ccc(cc1Br)C 34a_100000210942_100000748629 [0,2,0,0,0,1|0,0,0]=3 16429 B13R1.164 C=C(C)CNc1ccc(cc1Br)Cl 34a_100000752454_100000748629 [0,2,0,0,0,1|0,0,0]=3 16430 B13R1.164 C=C(C)CNc1ccc(cc1Br)F 34a_100000738039_100000748629 [0,2,0,0,0,1|0,0,0]=3 16431 B13R1.164 C=C(C)CNc1ccc(cc1Br)O 34a_100012001276_100000748629 [0,2,0,0,0,1|0,0,0]=3 16432 B13R1.164 C=C(C)CNc1ccc(cc1C)Br 34a_100000211769_100000748629 [0,2,0,0,0,1|0,0,0]=3 16433 B13R1.164 C=C(C)CNc1ccc(cc1C)Br 7a_100000211769_100000748629 [0,2,0,0,0,1|0,0,0]=3 16434 B13R1.164 C=C(C)CNc1ccc(cc1C)C 34a_100000736561_100000748629 [0,2,0,0,0,1|0,0,0]=3 16435 B13R1.164 C=C(C)CNc1ccc(cc1C)C 7a_100000736561_100000748629 [0,2,0,0,0,1|0,0,0]=3 16436 B13R1.164 C=C(C)CNc1ccc(cc1C)Cl 34a_100000210418_100000748629 [0,2,0,0,0,1|0,0,0]=3 16437 B13R1.164 C=C(C)CNc1ccc(cc1C)Cl 7a_100000210418_100000748629 [0,2,0,0,0,1|0,0,0]=3 16438 B13R1.164 C=C(C)CNc1ccc(cc1C)F 34a_100000211637_100000748629 [0,2,0,0,0,1|0,0,0]=3 16439 B13R1.164 C=C(C)CNc1ccc(cc1C)F 7a_100000211637_100000748629 [0,2,0,0,0,1|0,0,0]=3 16440 B13R1.164 C=C(C)CNc1ccc(cc1C)I 34a_100000184554_100000748629 [0,2,0,0,0,1|0,0,0]=3 16441 B13R1.164 C=C(C)CNc1ccc(cc1C)I 7a_100000184554_100000748629 [0,2,0,0,0,1|0,0,0]=3 16442 B13R1.164 C=C(C)CNc1ccc(cc1C)O 34a_100000756630_100000748629 [0,2,0,0,0,1|0,0,0]=3 16443 B13R1.164 C=C(C)CNc1ccc(cc1Cl)Br 34a_100000211467_100000748629 [0,2,0,0,0,1|0,0,0]=3 16444 B13R1.164 C=C(C)CNc1ccc(cc1Cl)C 34a_100000210522_100000748629 [0,2,0,0,0,1|0,0,0]=3 16445 B13R1.164 C=C(C)CNc1ccc(cc1Cl)Cl 34a_100000185861_100000748629 [0,2,0,0,0,1|0,0,0]=3 16446 B13R1.164 C=C(C)CNc1ccc(cc1Cl)F 34a_100000212003_100000748629 [0,2,0,0,0,1|0,0,0]=3 16447 B13R1.164 C=C(C)CNc1ccc(cc1Cl)I 34a_100011218065_100000748629 [0,2,0,0,0,1|0,0,0]=3 16448 B13R1.164 C=C(C)CNc1ccc(cc1Cl)O 34a_100011215599_100000748629 [0,2,0,0,0,1|0,0,0]=3 16449 B13R1.164 C=C(C)CNc1ccc(cc1F)Br 34a_100000210722_100000748629 [0,2,0,0,0,1|0,0,0]=3 16450 B13R1.164 C=C(C)CNc1ccc(cc1F)C 34a_100000211023_100000748629 [0,2,0,0,0,1|0,0,0]=3 16451 B13R1.164 C=C(C)CNc1ccc(cc1F)Cl 34a_100000211020_100000748629 [0,2,0,0,0,1|0,0,0]=3 16452 B13R1.164 C=C(C)CNc1ccc(cc1F)F 34a_100000210720_100000748629 [0,2,0,0,0,1|0,0,0]=3 16453 B13R1.164 C=C(C)CNc1ccc(cc1F)I 34a_100011215594_100000748629 [0,2,0,0,0,1|0,0,0]=3 16454 B13R1.164 C=C(C)CNc1ccc(cc1F)O 34a_100000759473_100000748629 [0,2,0,0,0,1|0,0,0]=3 16455 B13R1.164 C=C(C)CNc1ccc(cc1I)Br 34a_100000187925_100000748629 [0,2,0,0,0,1|0,0,0]=3 16456 B13R1.164 C=C(C)CNc1ccc(cc1I)C 34a_100011356834_100000748629 [0,2,0,0,0,1|0,0,0]=3 16457 B13R1.164 C=C(C)CNc1ccc(cc1I)Cl 34a_100000761889_100000748629 [0,2,0,0,0,1|0,0,0]=3 16458 B13R1.164 C=C(C)CNc1ccc(cc1I)F 34a_100000760547_100000748629 [0,2,0,0,0,1|0,0,0]=3 16459 B13R1.164 C=C(C)CNc1ccc(cc1I)O 34a_100010084370_100000748629 [0,2,0,0,0,1|0,0,0]=3 16460 B13R1.164 C=C(C)CNc1ccc(cc1O)Br 34a_100000739049_100000748629 [0,2,0,0,0,1|0,0,0]=3 16461 B13R1.164 C=C(C)CNc1ccc(cc1O)C 34a_100000211527_100000748629 [0,2,0,0,0,1|0,0,0]=3 16462 B13R1.164 C=C(C)CNc1ccc(cc1O)Cl 34a_100000185728_100000748629 [0,2,0,0,0,1|0,0,0]=3 16463 B13R1.164 C=C(C)CNc1ccc(cc1O)F 34a_100000753323_100000748629 [0,2,0,0,0,1|0,0,0]=3 16464 B13R1.164 C=C(C)CNc1ccc(cc1O)O 34a_100000106777_100000748629 [0,2,0,0,0,1|0,0,0]=3 16465 B13R1.164 C=C(C)COc1ccc(cc1Br)Br 34a_100000188717_100000748629 [0,2,0,0,0,1|0,0,0]=3 16466 B13R1.164 C=C(C)COc1ccc(cc1Br)Br 7a_100000188717_100000748629 [0,2,0,0,0,1|0,0,0]=3 16467 B13R1.164 C=C(C)COc1ccc(cc1Br)C 34a_100000210800_100000748629 [0,2,0,0,0,1|0,0,0]=3 16468 B13R1.164 C=C(C)COc1ccc(cc1Br)C 7a_100000210800_100000748629 [0,2,0,0,0,1|0,0,0]=3 16469 B13R1.164 C=C(C)COc1ccc(cc1Br)Cl 34a_100000211998_100000748629 [0,2,0,0,0,1|0,0,0]=3 16470 B13R1.164 C=C(C)COc1ccc(cc1Br)Cl 7a_100000211998_100000748629 [0,2,0,0,0,1|0,0,0]=3 16471 B13R1.164 C=C(C)COc1ccc(cc1Br)F 34a_100000211999_100000748629 [0,2,0,0,0,1|0,0,0]=3 16472 B13R1.164 C=C(C)COc1ccc(cc1Br)F 7a_100000211999_100000748629 [0,2,0,0,0,1|0,0,0]=3 16473 B13R1.164 C=C(C)COc1ccc(cc1Br)I 34a_100012361655_100000748629 [0,2,0,0,0,1|0,0,0]=3 16474 B13R1.164 C=C(C)COc1ccc(cc1Br)I 7a_100012361655_100000748629 [0,2,0,0,0,1|0,0,0]=3 16475 B13R1.164 C=C(C)COc1ccc(cc1Br)N 34a_100011534360_100000748629 [0,2,0,0,0,1|0,0,0]=3 16476 B13R1.164 C=C(C)COc1ccc(cc1Br)N 7a_100011534360_100000748629 [0,2,0,0,0,1|0,0,0]=3 16477 B13R1.164 C=C(C)COc1ccc(cc1C)Br 34a_100000186361_100000748629 [0,2,0,0,0,1|0,0,0]=3 16478 B13R1.164 C=C(C)COc1ccc(cc1C)Br 7a_100000186361_100000748629 [0,2,0,0,0,1|0,0,0]=3 16479 B13R1.164 C=C(C)COc1ccc(cc1C)C 34a_100000211776_100000748629 [0,2,0,0,0,1|0,0,0]=3 16480 B13R1.164 C=C(C)COc1ccc(cc1C)C 7a_100000211776_100000748629 [0,2,0,0,0,1|0,0,0]=3 16481 B13R1.164 C=C(C)COc1ccc(cc1C)Cl 34a_100000211091_100000748629 [0,2,0,0,0,1|0,0,0]=3 16482 B13R1.164 C=C(C)COc1ccc(cc1C)Cl 7a_100000211091_100000748629 [0,2,0,0,0,1|0,0,0]=3 16483 B13R1.164 C=C(C)COc1ccc(cc1C)F 34a_100000764316_100000748629 [0,2,0,0,0,1|0,0,0]=3 16484 B13R1.164 C=C(C)COc1ccc(cc1C)F 7a_100000764316_100000748629 [0,2,0,0,0,1|0,0,0]=3 16485 B13R1.164 C=C(C)COc1ccc(cc1C)I 34a_100011218673_100000748629 [0,2,0,0,0,1|0,0,0]=3 16486 B13R1.164 C=C(C)COc1ccc(cc1C)I 7a_100011218673_100000748629 [0,2,0,0,0,1|0,0,0]=3 16487 B13R1.164 C=C(C)COc1ccc(cc1C)N 34a_100011218179_100000748629 [0,2,0,0,0,1|0,0,0]=3 16488 B13R1.164 C=C(C)COc1ccc(cc1C)N 7a_100011218179_100000748629 [0,2,0,0,0,1|0,0,0]=3 16489 B13R1.164 C=C(C)COc1ccc(cc1Cl)Br 34a_100000186472_100000748629 [0,2,0,0,0,1|0,0,0]=3 16490 B13R1.164 C=C(C)COc1ccc(cc1Cl)Br 7a_100000186472_100000748629 [0,2,0,0,0,1|0,0,0]=3 16491 B13R1.164 C=C(C)COc1ccc(cc1Cl)C 34a_100000749699_100000748629 [0,2,0,0,0,1|0,0,0]=3 16492 B13R1.164 C=C(C)COc1ccc(cc1Cl)C 7a_100000749699_100000748629 [0,2,0,0,0,1|0,0,0]=3 16493 B13R1.164 C=C(C)COc1ccc(cc1Cl)Cl 34a_100015191787_100000748629 [0,2,0,0,0,1|0,0,0]=3 16494 B13R1.164 C=C(C)COc1ccc(cc1Cl)Cl 7a_100015191787_100000748629 [0,2,0,0,0,1|0,0,0]=3 16495 B13R1.164 C=C(C)COc1ccc(cc1Cl)F 34a_100000212004_100000748629 [0,2,0,0,0,1|0,0,0]=3 16496 B13R1.164 C=C(C)COc1ccc(cc1Cl)F 7a_100000212004_100000748629 [0,2,0,0,0,1|0,0,0]=3 16497 B13R1.164 C=C(C)COc1ccc(cc1Cl)I 34a_100012360047_100000748629 [0,2,0,0,0,1|0,0,0]=3 16498 B13R1.164 C=C(C)COc1ccc(cc1Cl)I 7a_100012360047_100000748629 [0,2,0,0,0,1|0,0,0]=3 16499 B13R1.164 C=C(C)COc1ccc(cc1Cl)N 34a_100000744943_100000748629 [0,2,0,0,0,1|0,0,0]=3 16500 B13R1.164 C=C(C)COc1ccc(cc1Cl)N 7a_100000744943_100000748629 [0,2,0,0,0,1|0,0,0]=3 16501 B13R1.164 C=C(C)COc1ccc(cc1F)Br 34a_100000185481_100000748629 [0,2,0,0,0,1|0,0,0]=3 16502 B13R1.164 C=C(C)COc1ccc(cc1F)Br 7a_100000185481_100000748629 [0,2,0,0,0,1|0,0,0]=3 16503 B13R1.164 C=C(C)COc1ccc(cc1F)C 34a_100011216688_100000748629 [0,2,0,0,0,1|0,0,0]=3 16504 B13R1.164 C=C(C)COc1ccc(cc1F)C 7a_100011216688_100000748629 [0,2,0,0,0,1|0,0,0]=3 16505 B13R1.164 C=C(C)COc1ccc(cc1F)Cl 34a_100000230166_100000748629 [0,2,0,0,0,1|0,0,0]=3 16506 B13R1.164 C=C(C)COc1ccc(cc1F)Cl 7a_100000230166_100000748629 [0,2,0,0,0,1|0,0,0]=3 16507 B13R1.164 C=C(C)COc1ccc(cc1F)F 34a_100000230127_100000748629 [0,2,0,0,0,1|0,0,0]=3 16508 B13R1.164 C=C(C)COc1ccc(cc1F)F 7a_100000230127_100000748629 [0,2,0,0,0,1|0,0,0]=3 16509 B13R1.164 C=C(C)COc1ccc(cc1F)I 34a_100011356965_100000748629 [0,2,0,0,0,1|0,0,0]=3 16510 B13R1.164 C=C(C)COc1ccc(cc1F)I 7a_100011356965_100000748629 [0,2,0,0,0,1|0,0,0]=3 16511 B13R1.164 C=C(C)COc1ccc(cc1F)N 34a_100011220035_100000748629 [0,2,0,0,0,1|0,0,0]=3 16512 B13R1.164 C=C(C)COc1ccc(cc1F)N 7a_100011220035_100000748629 [0,2,0,0,0,1|0,0,0]=3 16513 B13R1.164 C=C(C)COc1ccc(cc1I)Br 34a_100012355227_100000748629 [0,2,0,0,0,1|0,0,0]=3 16514 B13R1.164 C=C(C)COc1ccc(cc1I)Br 7a_100012355227_100000748629 [0,2,0,0,0,1|0,0,0]=3 16515 B13R1.164 C=C(C)COc1ccc(cc1I)C 34a_100000765521_100000748629 [0,2,0,0,0,1|0,0,0]=3 16516 B13R1.164 C=C(C)COc1ccc(cc1I)C 7a_100000765521_100000748629 [0,2,0,0,0,1|0,0,0]=3 16517 B13R1.164 C=C(C)COc1ccc(cc1I)Cl 34a_100011356953_100000748629 [0,2,0,0,0,1|0,0,0]=3 16518 B13R1.164 C=C(C)COc1ccc(cc1I)Cl 7a_100011356953_100000748629 [0,2,0,0,0,1|0,0,0]=3 16519 B13R1.164 C=C(C)COc1ccc(cc1I)F 34a_100012355409_100000748629 [0,2,0,0,0,1|0,0,0]=3 16520 B13R1.164 C=C(C)COc1ccc(cc1I)F 7a_100012355409_100000748629 [0,2,0,0,0,1|0,0,0]=3 16521 B13R1.164 C=C(C)COc1ccc(cc1I)I 7a_100010001573_100000748629 [0,2,0,0,0,1|0,0,0]=3 16522 B13R1.164 C=C(C)COc1ccc(cc1N)Br 34a_100000752626_100000748629 [0,2,0,0,0,1|0,0,0]=3 16523 B13R1.164 C=C(C)COc1ccc(cc1N)Br 7a_100000752626_100000748629 [0,2,0,0,0,1|0,0,0]=3 16524 B13R1.164 C=C(C)COc1ccc(cc1N)C 34a_100011215204_100000748629 [0,2,0,0,0,1|0,0,0]=3 16525 B13R1.164 C=C(C)COc1ccc(cc1N)C 7a_100011215204_100000748629 [0,2,0,0,0,1|0,0,0]=3 16526 B13R1.164 C=C(C)COc1ccc(cc1N)Cl 34a_100000210500_100000748629 [0,2,0,0,0,1|0,0,0]=3 16527 B13R1.164 C=C(C)COc1ccc(cc1N)Cl 7a_100000210500_100000748629 [0,2,0,0,0,1|0,0,0]=3 16528 B13R1.164 C=C(C)COc1ccc(cc1N)F 34a_100000759472_100000748629 [0,2,0,0,0,1|0,0,0]=3 16529 B13R1.164 C=C(C)COc1ccc(cc1N)F 7a_100000759472_100000748629 [0,2,0,0,0,1|0,0,0]=3 16530 B13R1.164 C=C(C)COc1ccc(cc1N)I 34a_100000753495_100000748629 [0,2,0,0,0,1|0,0,0]=3 16531 B13R1.164 C=C(C)COc1ccc(cc1N)I 7a_100000753495_100000748629 [0,2,0,0,0,1|0,0,0]=3 16532 B13R1.164 C=C(C)COc1ccc(cc1N)N 34a_100000725306_100000748629 [0,2,0,0,0,1|0,0,0]=3 16533 B13R1.164 C=C(C)COc1ccc(nc1Br)Br 34a_100009999766_100000748629 [0,2,0,0,0,1|1,0,0]=4 16534 B13R1.164 C=C(C)COc1ccc(nc1Br)Br 7a_100009999766_100000748629 [0,2,0,0,0,1|1,0,0]=4 16535 B13R1.164 C=C(C)COc1ccc(nc1Br)C 34a_100000702858_100000748629 [0,2,0,0,0,1|1,0,0]=4 16536 B13R1.164 C=C(C)COc1ccc(nc1Br)C 7a_100000702858_100000748629 [0,2,0,0,0,1|1,0,0]=4 16537 B13R1.164 C=C(C)COc1ccc(nc1Br)Cl 34a_100010219353_100000748629 [0,2,0,0,0,1|1,0,0]=4 16538 B13R1.164 C=C(C)COc1ccc(nc1Br)Cl 7a_100010219353_100000748629 [0,2,0,0,0,1|1,0,0]=4 16539 B13R1.164 C=C(C)COc1ccc(nc1Br)F 34a_100009887730_100000748629 [0,2,0,0,0,1|1,0,0]=4 16540 B13R1.164 C=C(C)COc1ccc(nc1Br)F 7a_100009887730_100000748629 [0,2,0,0,0,1|1,0,0]=4 16541 B13R1.164 C=C(C)COc1ccc(nc1Br)I 34a_100000725334_100000748629 [0,2,0,0,0,1|1,0,0]=4 16542 B13R1.164 C=C(C)COc1ccc(nc1Br)I 7a_100000725334_100000748629 [0,2,0,0,0,1|1,0,0]=4 16543 B13R1.164 C=C(C)COc1ccc(nc1C)Br 34a_100012002022_100000748629 [0,2,0,0,0,1|1,0,0]=4 16544 B13R1.164 C=C(C)COc1ccc(nc1C)Br 7a_100012002022_100000748629 [0,2,0,0,0,1|1,0,0]=4 16545 B13R1.164 C=C(C)COc1ccc(nc1C)C 34a_100011218912_100000748629 [0,2,0,0,0,1|1,0,0]=4 16546 B13R1.164 C=C(C)COc1ccc(nc1C)C 7a_100011218912_100000748629 [0,2,0,0,0,1|1,0,0]=4 16547 B13R1.164 C=C(C)COc1ccc(nc1C)Cl 34a_100012184626_100000748629 [0,2,0,0,0,1|1,0,0]=4 16548 B13R1.164 C=C(C)COc1ccc(nc1C)Cl 7a_100012184626_100000748629 [0,2,0,0,0,1|1,0,0]=4 16549 B13R1.164 C=C(C)COc1ccc(nc1C)F 34a_100009881036_100000748629 [0,2,0,0,0,1|1,0,0]=4 16550 B13R1.164 C=C(C)COc1ccc(nc1C)F 7a_100009881036_100000748629 [0,2,0,0,0,1|1,0,0]=4 16551 B13R1.164 C=C(C)COc1ccc(nc1C)I 34a_100010233687_100000748629 [0,2,0,0,0,1|1,0,0]=4 16552 B13R1.164 C=C(C)COc1ccc(nc1C)I 7a_100010233687_100000748629 [0,2,0,0,0,1|1,0,0]=4 16553 B13R1.164 C=C(C)COc1ccc(nc1Cl)Br 34a_100010246206_100000748629 [0,2,0,0,0,1|1,0,0]=4 16554 B13R1.164 C=C(C)COc1ccc(nc1Cl)Br 7a_100010246206_100000748629 [0,2,0,0,0,1|1,0,0]=4 16555 B13R1.164 C=C(C)COc1ccc(nc1Cl)C 34a_100000086286_100000748629 [0,2,0,0,0,1|1,0,0]=4 16556 B13R1.164 C=C(C)COc1ccc(nc1Cl)C 7a_100000086286_100000748629 [0,2,0,0,0,1|1,0,0]=4 16557 B13R1.164 C=C(C)COc1ccc(nc1Cl)Cl 34a_100000101165_100000748629 [0,2,0,0,0,1|1,0,0]=4 16558 B13R1.164 C=C(C)COc1ccc(nc1Cl)Cl 7a_100000101165_100000748629 [0,2,0,0,0,1|1,0,0]=4 16559 B13R1.164 C=C(C)COc1ccc(nc1Cl)I 34a_100000721234_100000748629 [0,2,0,0,0,1|1,0,0]=4 16560 B13R1.164 C=C(C)COc1ccc(nc1Cl)I 7a_100000721234_100000748629 [0,2,0,0,0,1|1,0,0]=4 16561 B13R1.164 C=C(C)COc1ccc(nc1F)Br 34a_100009819667_100000748629 [0,2,0,0,0,1|1,0,0]=4 16562 B13R1.164 C=C(C)COc1ccc(nc1F)Br 7a_100009819667_100000748629 [0,2,0,0,0,1|1,0,0]=4 16563 B13R1.164 C=C(C)COc1ccc(nc1F)C 34a_100000079963_100000748629 [0,2,0,0,0,1|1,0,0]=4 16564 B13R1.164 C=C(C)COc1ccc(nc1F)C 7a_100000079963_100000748629 [0,2,0,0,0,1|1,0,0]=4 16565 B13R1.164 C=C(C)COc1ccc(nc1F)Cl 34a_100009880201_100000748629 [0,2,0,0,0,1|1,0,0]=4 16566 B13R1.164 C=C(C)COc1ccc(nc1F)Cl 7a_100009880201_100000748629 [0,2,0,0,0,1|1,0,0]=4 16567 B13R1.164 C=C(C)COc1ccc(nc1F)F 34a_100000101184_100000748629 [0,2,0,0,0,1|1,0,0]=4 16568 B13R1.164 C=C(C)COc1ccc(nc1F)F 7a_100000101184_100000748629 [0,2,0,0,0,1|1,0,0]=4 16569 B13R1.164 C=C(C)COc1ccc(nc1I)Br 34a_100010253912_100000748629 [0,2,0,0,0,1|1,0,0]=4 16570 B13R1.164 C=C(C)COc1ccc(nc1I)Br 7a_100010253912_100000748629 [0,2,0,0,0,1|1,0,0]=4 16571 B13R1.164 C=C(C)COc1ccc(nc1I)C 34a_100000023897_100000748629 [0,2,0,0,0,1|1,0,0]=4 16572 B13R1.164 C=C(C)COc1ccc(nc1I)C 7a_100000023897_100000748629 [0,2,0,0,0,1|1,0,0]=4 16573 B13R1.164 C=C(C)COc1ccc(nc1I)Cl 34a_100000696390_100000748629 [0,2,0,0,0,1|1,0,0]=4 16574 B13R1.164 C=C(C)COc1ccc(nc1I)Cl 7a_100000696390_100000748629 [0,2,0,0,0,1|1,0,0]=4 16575 B13R1.164 C=C(C)COc1ccc(nc1I)F 34a_100010382442_100000748629 [0,2,0,0,0,1|1,0,0]=4 16576 B13R1.164 C=C(C)COc1ccc(nc1I)F 7a_100010382442_100000748629 [0,2,0,0,0,1|1,0,0]=4 16577 B13R1.164 C=C(C)COc1ccc(nc1N)Br 34a_100000685527_100000748629 [0,2,0,0,0,1|1,0,0]=4 16578 B13R1.164 C=C(C)COc1ccc(nc1N)Br 7a_100000685527_100000748629 [0,2,0,0,0,1|1,0,0]=4 16579 B13R1.164 C=C(C)COc1ccc(nc1N)C 34a_100000694039_100000748629 [0,2,0,0,0,1|1,0,0]=4 16580 B13R1.164 C=C(C)COc1ccc(nc1N)C 7a_100000694039_100000748629 [0,2,0,0,0,1|1,0,0]=4 16581 B13R1.164 C=C(C)COc1ccc(nc1N)Cl 34a_100000717809_100000748629 [0,2,0,0,0,1|1,0,0]=4 16582 B13R1.164 C=C(C)COc1ccc(nc1N)Cl 7a_100000717809_100000748629 [0,2,0,0,0,1|1,0,0]=4 16583 B13R1.164 C=C(C)COc1cnc(cc1Br)C 34a_100009843476_100000748629 [0,2,0,0,0,1|1,0,0]=4 16584 B13R1.164 C=C(C)COc1cnc(cc1Br)C 7a_100009843476_100000748629 [0,2,0,0,0,1|1,0,0]=4 16585 B13R1.164 C=C(C)COc1cnc(cc1C)C 34a_200000068632_100000748629 [0,2,0,0,0,1|1,0,0]=4 16586 B13R1.164 C=C(C)COc1cnc(cc1C)C 7a_200000068632_100000748629 [0,2,0,0,0,1|1,0,0]=4 16587 B13R1.164 C=C(C)COc1cnc(cc1C)Cl 34a_100000692680_100000748629 [0,2,0,0,0,1|1,0,0]=4 16588 B13R1.164 C=C(C)COc1cnc(cc1C)Cl 7a_100000692680_100000748629 [0,2,0,0,0,1|1,0,0]=4 16589 B13R1.164 C=C(C)COc1cnc(cc1C)F 34a_100009856773_100000748629 [0,2,0,0,0,1|1,0,0]=4 16590 B13R1.164 C=C(C)COc1cnc(cc1C)F 7a_100009856773_100000748629 [0,2,0,0,0,1|1,0,0]=4 16591 B13R1.164 C=C(C)COc1cnc(cc1Cl)Cl 34a_100009868576_100000748629 [0,2,0,0,0,1|1,0,0]=4 16592 B13R1.164 C=C(C)COc1cnc(cc1Cl)Cl 7a_100009868576_100000748629 [0,2,0,0,0,1|1,0,0]=4 16593 B13R1.164 C=C(C)COc1cnc(cc1F)F 34a_100009885687_100000748629 [0,2,0,0,0,1|1,0,0]=4 16594 B13R1.164 C=C(C)COc1cnc(cc1F)F 7a_100009885687_100000748629 [0,2,0,0,0,1|1,0,0]=4 16595 B13R1.164 C=C(C)COc1cnc(cc1I)Cl 34a_100000698892_100000748629 [0,2,0,0,0,1|1,0,0]=4 16596 B13R1.164 C=C(C)COc1cnc(cc1I)Cl 7a_100000698892_100000748629 [0,2,0,0,0,1|1,0,0]=4 16597 B13R1.164 C=C(C)COc1cnc(cc1N)Br 34a_100009819941_100000748629 [0,2,0,0,0,1|1,0,0]=4 16598 B13R1.164 C=C(C)COc1cnc(cc1N)Br 7a_100009819941_100000748629 [0,2,0,0,0,1|1,0,0]=4 16599 B13R1.164 C=C(C)COc1coc(cc1=O)C 34a_100000081520_100000748629 [0,2,0,0,0,1|1,0,0]=4 16600 B13R1.164 C=C(C)COc1ncc(cc1Br)Br 34a_100000701035_100000748629 [0,2,0,0,0,1|1,0,0]=4 16601 B13R1.164 C=C(C)COc1ncc(cc1Br)C 34a_100000719714_100000748629 [0,2,0,0,0,1|1,0,0]=4 16602 B13R1.164 C=C(C)COc1ncc(cc1C)Br 34a_100000685391_100000748629 [0,2,0,0,0,1|1,0,0]=4 16603 B13R1.164 C=C(C)COc1ncc(cc1Cl)Br 34a_100012339560_100000748629 [0,2,0,0,0,1|1,0,0]=4 16604 B13R1.164 C=C(C)COc1ncc(cc1Cl)F 34a_100009847679_100000748629 [0,2,0,0,0,1|1,0,0]=4 16605 B13R1.164 C=C(C)COc1ncc(cc1F)Cl 34a_100011998252_100000748629 [0,2,0,0,0,1|1,0,0]=4 16606 B13R1.164 C=C(C)COc1ncc(cc1F)F 34a_100012025737_100000748629 [0,2,0,0,0,1|1,0,0]=4 16607 B13R1.164 C=C(C)COc1ncc(cc1N)Br 34a_100000743729_100000748629 [0,2,0,0,0,1|1,0,0]=4 16608 B13R1.164 C=C(C)COc1ncc(cc1N)C 34a_100012000488_100000748629 [0,2,0,0,0,1|1,0,0]=4 16609 B13R1.164 C=C(C)COc1ncc(cc1N)Cl 34a_100011998249_100000748629 [0,2,0,0,0,1|1,0,0]=4 16610 B13R1.164 C=C(C)CSc1c[nH]c(=O)cc1F 62a_100000748629_100015631685 [0,2,0,0,0,1|1,0,0]=4 16611 B13R1.164 C=C(C)CSc1c[nH]c(=O)cc1F 62a_100015631685_100000211660 [0,2,0,0,0,1|1,0,0]=4 16612 B13R1.164 C=C(C)CSc1cc[n+](cc1C)[O-] 62a_100000748629_100000074940 [0,2,0,0,0,1|1,0,0]=4 16613 B13R1.164 C=C(C)CSc1ccc(=O)[nH]c1N 62a_100009884077_100000211660 [0,2,0,0,0,1|1,0,0]=4 16614 B13R1.164 C=C(C)CSc1ccc(c[n+]1[O-])C 62a_100000748629_100009819918 [0,2,0,0,0,1|1,0,0]=4 16615 B13R1.164 C=C(C)CSc1ccc(c[n+]1[O-])F 62a_100000748629_100009817261 [0,2,0,0,0,1|1,0,0]=4 16616 B13R1.164 C=C(C)CSc1ccc(c[n+]1[O-])F 62a_100009817261_100000211660 [0,2,0,0,0,1|1,0,0]=4 16617 B13R1.164 C=C(C)CSc1ccc(cc1Br)Br 62a_100000748629_100011484698 [0,2,0,0,0,1|0,0,0]=3 16618 B13R1.164 C=C(C)CSc1ccc(cc1Br)Br 62a_100011484698_100000211660 [0,2,0,0,0,1|0,0,0]=3 16619 B13R1.164 C=C(C)CSc1ccc(cc1Br)C 62a_100000748629_100009813563 [0,2,0,0,0,1|0,0,0]=3 16620 B13R1.164 C=C(C)CSc1ccc(cc1Br)C 62a_100009813563_100000211660 [0,2,0,0,0,1|0,0,0]=3 16621 B13R1.164 C=C(C)CSc1ccc(cc1Br)Cl 62a_100000748629_100011219703 [0,2,0,0,0,1|0,0,0]=3 16622 B13R1.164 C=C(C)CSc1ccc(cc1Br)Cl 62a_100011219703_100000211660 [0,2,0,0,0,1|0,0,0]=3 16623 B13R1.164 C=C(C)CSc1ccc(cc1Br)F 62a_100000748629_100011217111 [0,2,0,0,0,1|0,0,0]=3 16624 B13R1.164 C=C(C)CSc1ccc(cc1Br)F 62a_100011217111_100000211660 [0,2,0,0,0,1|0,0,0]=3 16625 B13R1.164 C=C(C)CSc1ccc(cc1Br)N 62a_100000748629_100000750458 [0,2,0,0,0,1|0,0,0]=3 16626 B13R1.164 C=C(C)CSc1ccc(cc1Br)N 62a_100000750458_100000211660 [0,2,0,0,0,1|0,0,0]=3 16627 B13R1.164 C=C(C)CSc1ccc(cc1Br)O 62a_100000701344_100000211660 [0,2,0,0,0,1|0,0,0]=3 16628 B13R1.164 C=C(C)CSc1ccc(cc1Br)O 62a_100000748629_100000701344 [0,2,0,0,0,1|0,0,0]=3 16629 B13R1.164 C=C(C)CSc1ccc(cc1C)Br 62a_100000701812_100000211660 [0,2,0,0,0,1|0,0,0]=3 16630 B13R1.164 C=C(C)CSc1ccc(cc1C)Br 62a_100000748629_100000701812 [0,2,0,0,0,1|0,0,0]=3 16631 B13R1.164 C=C(C)CSc1ccc(cc1C)C 62a_100000748629_100011217332 [0,2,0,0,0,1|0,0,0]=3 16632 B13R1.164 C=C(C)CSc1ccc(cc1C)C 62a_100011217332_100000211660 [0,2,0,0,0,1|0,0,0]=3 16633 B13R1.164 C=C(C)CSc1ccc(cc1C)Cl 62a_100000748629_100011219607 [0,2,0,0,0,1|0,0,0]=3 16634 B13R1.164 C=C(C)CSc1ccc(cc1C)Cl 62a_100011219607_100000211660 [0,2,0,0,0,1|0,0,0]=3 16635 B13R1.164 C=C(C)CSc1ccc(cc1C)F 62a_100000748629_100011205405 [0,2,0,0,0,1|0,0,0]=3 16636 B13R1.164 C=C(C)CSc1ccc(cc1C)F 62a_100011205405_100000211660 [0,2,0,0,0,1|0,0,0]=3 16637 B13R1.164 C=C(C)CSc1ccc(cc1C)N 62a_100000210723_100000211660 [0,2,0,0,0,1|0,0,0]=3 16638 B13R1.164 C=C(C)CSc1ccc(cc1C)N 62a_100000748629_100000210723 [0,2,0,0,0,1|0,0,0]=3 16639 B13R1.164 C=C(C)CSc1ccc(cc1C)O 62a_100000748629_100000690111 [0,2,0,0,0,1|0,0,0]=3 16640 B13R1.164 C=C(C)CSc1ccc(cc1Cl)Br 62a_100000748629_100011216062 [0,2,0,0,0,1|0,0,0]=3 16641 B13R1.164 C=C(C)CSc1ccc(cc1Cl)Br 62a_100011216062_100000211660 [0,2,0,0,0,1|0,0,0]=3 16642 B13R1.164 C=C(C)CSc1ccc(cc1Cl)C 62a_100000748629_100011263221 [0,2,0,0,0,1|0,0,0]=3 16643 B13R1.164 C=C(C)CSc1ccc(cc1Cl)C 62a_100011263221_100000211660 [0,2,0,0,0,1|0,0,0]=3 16644 B13R1.164 C=C(C)CSc1ccc(cc1Cl)Cl 62a_100000699841_100000211660 [0,2,0,0,0,1|0,0,0]=3 16645 B13R1.164 C=C(C)CSc1ccc(cc1Cl)Cl 62a_100000748629_100000699841 [0,2,0,0,0,1|0,0,0]=3 16646 B13R1.164 C=C(C)CSc1ccc(cc1Cl)F 62a_100000733362_100000211660 [0,2,0,0,0,1|0,0,0]=3 16647 B13R1.164 C=C(C)CSc1ccc(cc1Cl)F 62a_100000748629_100000733362 [0,2,0,0,0,1|0,0,0]=3 16648 B13R1.164 C=C(C)CSc1ccc(cc1Cl)N 62a_100000748629_100000761885 [0,2,0,0,0,1|0,0,0]=3 16649 B13R1.164 C=C(C)CSc1ccc(cc1Cl)N 62a_100000761885_100000211660 [0,2,0,0,0,1|0,0,0]=3 16650 B13R1.164 C=C(C)CSc1ccc(cc1Cl)O 62a_100000047559_100000211660 [0,2,0,0,0,1|0,0,0]=3 16651 B13R1.164 C=C(C)CSc1ccc(cc1Cl)O 62a_100000748629_100000047559 [0,2,0,0,0,1|0,0,0]=3 16652 B13R1.164 C=C(C)CSc1ccc(cc1F)Br 62a_100000748629_100009814013 [0,2,0,0,0,1|0,0,0]=3 16653 B13R1.164 C=C(C)CSc1ccc(cc1F)Br 62a_100009814013_100000211660 [0,2,0,0,0,1|0,0,0]=3 16654 B13R1.164 C=C(C)CSc1ccc(cc1F)C 62a_100000748629_100011216119 [0,2,0,0,0,1|0,0,0]=3 16655 B13R1.164 C=C(C)CSc1ccc(cc1F)C 62a_100011216119_100000211660 [0,2,0,0,0,1|0,0,0]=3 16656 B13R1.164 C=C(C)CSc1ccc(cc1F)Cl 62a_100000748629_100011216042 [0,2,0,0,0,1|0,0,0]=3 16657 B13R1.164 C=C(C)CSc1ccc(cc1F)Cl 62a_100011216042_100000211660 [0,2,0,0,0,1|0,0,0]=3 16658 B13R1.164 C=C(C)CSc1ccc(cc1F)F 62a_100000748629_100000750030 [0,2,0,0,0,1|0,0,0]=3 16659 B13R1.164 C=C(C)CSc1ccc(cc1F)F 62a_100000750030_100000211660 [0,2,0,0,0,1|0,0,0]=3 16660 B13R1.164 C=C(C)CSc1ccc(cc1F)N 62a_100000748629_100011356925 [0,2,0,0,0,1|0,0,0]=3 16661 B13R1.164 C=C(C)CSc1ccc(cc1F)N 62a_100011356925_100000211660 [0,2,0,0,0,1|0,0,0]=3 16662 B13R1.164 C=C(C)CSc1ccc(cc1F)O 62a_100000748629_100000755031 [0,2,0,0,0,1|0,0,0]=3 16663 B13R1.164 C=C(C)CSc1ccc(cc1F)O 62a_100000755031_100000211660 [0,2,0,0,0,1|0,0,0]=3 16664 B13R1.164 C=C(C)CSc1ccc(cc1N)Br 62a_100000743836_100000211660 [0,2,0,0,0,1|0,0,0]=3 16665 B13R1.164 C=C(C)CSc1ccc(cc1N)Br 62a_100000748629_100000743836 [0,2,0,0,0,1|0,0,0]=3 16666 B13R1.164 C=C(C)CSc1ccc(cc1N)C 62a_100000748629_100011216686 [0,2,0,0,0,1|0,0,0]=3 16667 B13R1.164 C=C(C)CSc1ccc(cc1N)C 62a_100011216686_100000211660 [0,2,0,0,0,1|0,0,0]=3 16668 B13R1.164 C=C(C)CSc1ccc(cc1N)Cl 62a_100000748629_100000761886 [0,2,0,0,0,1|0,0,0]=3 16669 B13R1.164 C=C(C)CSc1ccc(cc1N)Cl 62a_100000761886_100000211660 [0,2,0,0,0,1|0,0,0]=3 16670 B13R1.164 C=C(C)CSc1ccc(cc1N)F 62a_100000687223_100000211660 [0,2,0,0,0,1|0,0,0]=3 16671 B13R1.164 C=C(C)CSc1ccc(cc1N)F 62a_100000748629_100000687223 [0,2,0,0,0,1|0,0,0]=3 16672 B13R1.164 C=C(C)CSc1ccc(cc1N)N 62a_100000748629_200012175722 [0,2,0,0,0,1|0,0,0]=3 16673 B13R1.164 C=C(C)CSc1ccc(cc1N)N 62a_200012175722_100000211660 [0,2,0,0,0,1|0,0,0]=3 16674 B13R1.164 C=C(C)CSc1ccc(cc1N)O 62a_100000748629_100011999798 [0,2,0,0,0,1|0,0,0]=3 16675 B13R1.164 C=C(C)CSc1ccc(cc1N)O 62a_100011999798_100000211660 [0,2,0,0,0,1|0,0,0]=3 16676 B13R1.164 C=C(C)CSc1ccc(cc1O)Br 62a_100000748629_100012344904 [0,2,0,0,0,1|0,0,0]=3 16677 B13R1.164 C=C(C)CSc1ccc(cc1O)Br 62a_100012344904_100000211660 [0,2,0,0,0,1|0,0,0]=3 16678 B13R1.164 C=C(C)CSc1ccc(cc1O)C 62a_100000748629_100012002257 [0,2,0,0,0,1|0,0,0]=3 16679 B13R1.164 C=C(C)CSc1ccc(cc1O)C 62a_100012002257_100000211660 [0,2,0,0,0,1|0,0,0]=3 16680 B13R1.164 C=C(C)CSc1ccc(cc1O)Cl 62a_100000050036_100000211660 [0,2,0,0,0,1|0,0,0]=3 16681 B13R1.164 C=C(C)CSc1ccc(cc1O)Cl 62a_100000748629_100000050036 [0,2,0,0,0,1|0,0,0]=3 16682 B13R1.164 C=C(C)CSc1ccc(cc1O)F 62a_100000690578_100000211660 [0,2,0,0,0,1|0,0,0]=3 16683 B13R1.164 C=C(C)CSc1ccc(cc1O)F 62a_100000748629_100000690578 [0,2,0,0,0,1|0,0,0]=3 16684 B13R1.164 C=C(C)CSc1ccc(cc1O)O 62a_100000748629_100009813921 [0,2,0,0,0,1|0,0,0]=3 16685 B13R1.164 C=C(C)CSc1ccc(nc1Br)N 62a_100000748629_100010734177 [0,2,0,0,0,1|1,0,0]=4 16686 B13R1.164 C=C(C)CSc1ccc(nc1Br)N 62a_100010734177_100000211660 [0,2,0,0,0,1|1,0,0]=4 16687 B13R1.164 C=C(C)CSc1ccc(nc1C)C 62a_100000748629_100009813853 [0,2,0,0,0,1|1,0,0]=4 16688 B13R1.164 C=C(C)CSc1ccc(nc1C)C 62a_100009813853_100000211660 [0,2,0,0,0,1|1,0,0]=4 16689 B13R1.164 C=C(C)CSc1ccc(nc1C)Cl 62a_100000062408_100000211660 [0,2,0,0,0,1|1,0,0]=4 16690 B13R1.164 C=C(C)CSc1ccc(nc1C)Cl 62a_100000748629_100000062408 [0,2,0,0,0,1|1,0,0]=4 16691 B13R1.164 C=C(C)CSc1ccc(nc1C)F 62a_100000688911_100000211660 [0,2,0,0,0,1|1,0,0]=4 16692 B13R1.164 C=C(C)CSc1ccc(nc1C)F 62a_100000748629_100000688911 [0,2,0,0,0,1|1,0,0]=4 16693 B13R1.164 C=C(C)CSc1ccc(nc1C)N 62a_100000187202_100000211660 [0,2,0,0,0,1|1,0,0]=4 16694 B13R1.164 C=C(C)CSc1ccc(nc1C)N 62a_100000748629_100000187202 [0,2,0,0,0,1|1,0,0]=4 16695 B13R1.164 C=C(C)CSc1ccc(nc1C)O 62a_100000691680_100000211660 [0,2,0,0,0,1|1,0,0]=4 16696 B13R1.164 C=C(C)CSc1ccc(nc1C)O 62a_100000748629_100000691680 [0,2,0,0,0,1|1,0,0]=4 16697 B13R1.164 C=C(C)CSc1ccc(nc1Cl)Br 62a_100000748629_100010246183 [0,2,0,0,0,1|1,0,0]=4 16698 B13R1.164 C=C(C)CSc1ccc(nc1Cl)Br 62a_100010246183_100000211660 [0,2,0,0,0,1|1,0,0]=4 16699 B13R1.164 C=C(C)CSc1ccc(nc1Cl)Cl 62a_100000748629_100000043682 [0,2,0,0,0,1|1,0,0]=4 16700 B13R1.164 C=C(C)CSc1ccc(nc1Cl)N 62a_100000748629_100010270343 [0,2,0,0,0,1|1,0,0]=4 16701 B13R1.164 C=C(C)CSc1ccc(nc1Cl)N 62a_100010270343_100000211660 [0,2,0,0,0,1|1,0,0]=4 16702 B13R1.164 C=C(C)CSc1ccc(nc1F)C 62a_100000748629_100010006597 [0,2,0,0,0,1|1,0,0]=4 16703 B13R1.164 C=C(C)CSc1ccc(nc1F)C 62a_100010006597_100000211660 [0,2,0,0,0,1|1,0,0]=4 16704 B13R1.164 C=C(C)CSc1ccc(nc1F)Cl 62a_100000748629_100010168078 [0,2,0,0,0,1|1,0,0]=4 16705 B13R1.164 C=C(C)CSc1ccc(nc1F)Cl 62a_100010168078_100000211660 [0,2,0,0,0,1|1,0,0]=4 16706 B13R1.164 C=C(C)CSc1ccc(nc1F)F 62a_100000070099_100000211660 [0,2,0,0,0,1|1,0,0]=4 16707 B13R1.164 C=C(C)CSc1ccc(nc1F)F 62a_100000748629_100000070099 [0,2,0,0,0,1|1,0,0]=4 16708 B13R1.164 C=C(C)CSc1ccc(nc1F)N 62a_100000748629_100009882772 [0,2,0,0,0,1|1,0,0]=4 16709 B13R1.164 C=C(C)CSc1ccc(nc1F)N 62a_100009882772_100000211660 [0,2,0,0,0,1|1,0,0]=4 16710 B13R1.164 C=C(C)CSc1ccc(nc1F)O 62a_100000748629_100009879308 [0,2,0,0,0,1|1,0,0]=4 16711 B13R1.164 C=C(C)CSc1ccc(nc1F)O 62a_100009879308_100000211660 [0,2,0,0,0,1|1,0,0]=4 16712 B13R1.164 C=C(C)CSc1ccc(nc1N)C 62a_100000748629_100009816662 [0,2,0,0,0,1|1,0,0]=4 16713 B13R1.164 C=C(C)CSc1ccc(nc1N)C 62a_100009816662_100000211660 [0,2,0,0,0,1|1,0,0]=4 16714 B13R1.164 C=C(C)CSc1ccc(nc1N)Cl 62a_100000748629_100010171640 [0,2,0,0,0,1|1,0,0]=4 16715 B13R1.164 C=C(C)CSc1ccc(nc1N)Cl 62a_100010171640_100000211660 [0,2,0,0,0,1|1,0,0]=4 16716 B13R1.164 C=C(C)CSc1ccc(nc1N)F 62a_100000748629_100009854977 [0,2,0,0,0,1|1,0,0]=4 16717 B13R1.164 C=C(C)CSc1ccc(nc1N)F 62a_100009854977_100000211660 [0,2,0,0,0,1|1,0,0]=4 16718 B13R1.164 C=C(C)CSc1ccc(nc1N)N 62a_100011356871_100000211660 [0,2,0,0,0,1|1,0,0]=4 16719 B13R1.164 C=C(C)CSc1ccc(nc1O)C 62a_100000748629_100009817604 [0,2,0,0,0,1|1,0,0]=4 16720 B13R1.164 C=C(C)CSc1ccc(nc1O)C 62a_100009817604_100000211660 [0,2,0,0,0,1|1,0,0]=4 16721 B13R1.164 C=C(C)CSc1cnc(cc1Br)F 62a_100000748629_100015451857 [0,2,0,0,0,1|1,0,0]=4 16722 B13R1.164 C=C(C)CSc1cnc(cc1Br)F 62a_100015451857_100000211660 [0,2,0,0,0,1|1,0,0]=4 16723 B13R1.164 C=C(C)CSc1cnc(cc1Br)N 62a_100000748629_100010074611 [0,2,0,0,0,1|1,0,0]=4 16724 B13R1.164 C=C(C)CSc1cnc(cc1Br)N 62a_100010074611_100000211660 [0,2,0,0,0,1|1,0,0]=4 16725 B13R1.164 C=C(C)CSc1cnc(cc1C)Br 62a_100000748629_100009816104 [0,2,0,0,0,1|1,0,0]=4 16726 B13R1.164 C=C(C)CSc1cnc(cc1C)Br 62a_100009816104_100000211660 [0,2,0,0,0,1|1,0,0]=4 16727 B13R1.164 C=C(C)CSc1cnc(cc1C)C 62a_100000748629_100009819613 [0,2,0,0,0,1|1,0,0]=4 16728 B13R1.164 C=C(C)CSc1cnc(cc1C)C 62a_100009819613_100000211660 [0,2,0,0,0,1|1,0,0]=4 16729 B13R1.164 C=C(C)CSc1cnc(cc1C)Cl 62a_100000748629_100010172789 [0,2,0,0,0,1|1,0,0]=4 16730 B13R1.164 C=C(C)CSc1cnc(cc1C)Cl 62a_100010172789_100000211660 [0,2,0,0,0,1|1,0,0]=4 16731 B13R1.164 C=C(C)CSc1cnc(cc1C)F 62a_100000748629_100009820716 [0,2,0,0,0,1|1,0,0]=4 16732 B13R1.164 C=C(C)CSc1cnc(cc1C)F 62a_100009820716_100000211660 [0,2,0,0,0,1|1,0,0]=4 16733 B13R1.164 C=C(C)CSc1cnc(cc1C)N 62a_100000050067_100000211660 [0,2,0,0,0,1|1,0,0]=4 16734 B13R1.164 C=C(C)CSc1cnc(cc1C)N 62a_100000748629_100000050067 [0,2,0,0,0,1|1,0,0]=4 16735 B13R1.164 C=C(C)CSc1cnc(cc1C)O 62a_100000748629_100000766222 [0,2,0,0,0,1|1,0,0]=4 16736 B13R1.164 C=C(C)CSc1cnc(cc1C)O 62a_100000766222_100000211660 [0,2,0,0,0,1|1,0,0]=4 16737 B13R1.164 C=C(C)CSc1cnc(cc1Cl)Br 62a_100000748629_100010381092 [0,2,0,0,0,1|1,0,0]=4 16738 B13R1.164 C=C(C)CSc1cnc(cc1Cl)Br 62a_100010381092_100000211660 [0,2,0,0,0,1|1,0,0]=4 16739 B13R1.164 C=C(C)CSc1cnc(cc1Cl)Cl 62a_100000748629_100010200927 [0,2,0,0,0,1|1,0,0]=4 16740 B13R1.164 C=C(C)CSc1cnc(cc1Cl)Cl 62a_100010200927_100000211660 [0,2,0,0,0,1|1,0,0]=4 16741 B13R1.164 C=C(C)CSc1cnc(cc1Cl)N 62a_100000694920_100000211660 [0,2,0,0,0,1|1,0,0]=4 16742 B13R1.164 C=C(C)CSc1cnc(cc1Cl)N 62a_100000748629_100000694920 [0,2,0,0,0,1|1,0,0]=4 16743 B13R1.164 C=C(C)CSc1cnc(cc1F)Cl 62a_100000748629_100010128100 [0,2,0,0,0,1|1,0,0]=4 16744 B13R1.164 C=C(C)CSc1cnc(cc1F)Cl 62a_100010128100_100000211660 [0,2,0,0,0,1|1,0,0]=4 16745 B13R1.164 C=C(C)CSc1cnc(cc1F)N 62a_100000748629_100009844730 [0,2,0,0,0,1|1,0,0]=4 16746 B13R1.164 C=C(C)CSc1cnc(cc1F)N 62a_100009844730_100000211660 [0,2,0,0,0,1|1,0,0]=4 16747 B13R1.164 C=C(C)CSc1cnc(cc1N)C 62a_100000748629_100009817891 [0,2,0,0,0,1|1,0,0]=4 16748 B13R1.164 C=C(C)CSc1cnc(cc1N)C 62a_100009817891_100000211660 [0,2,0,0,0,1|1,0,0]=4 16749 B13R1.164 C=C(C)CSc1cnc(cc1N)Cl 62a_100000748629_100010209552 [0,2,0,0,0,1|1,0,0]=4 16750 B13R1.164 C=C(C)CSc1cnc(cc1N)Cl 62a_100010209552_100000211660 [0,2,0,0,0,1|1,0,0]=4 16751 B13R1.164 C=C(C)CSc1cnc(cc1N)N 62a_100000748629_200009857908 [0,2,0,0,0,1|1,0,0]=4 16752 B13R1.164 C=C(C)CSc1cnc(cc1N)N 62a_200009857908_100000211660 [0,2,0,0,0,1|1,0,0]=4 16753 B13R1.164 C=C(C)CSc1cnc(cc1O)C 62a_100000748629_100011016184 [0,2,0,0,0,1|1,0,0]=4 16754 B13R1.164 C=C(C)CSc1cnc(cc1O)C 62a_100011016184_100000211660 [0,2,0,0,0,1|1,0,0]=4 16755 B13R1.164 C=C(C)CSc1ncc(cc1Br)Cl 62a_100000748629_100012154958 [0,2,0,0,0,1|1,0,0]=4 16756 B13R1.164 C=C(C)CSc1ncc(cc1Br)Cl 62a_100012154958_100000211660 [0,2,0,0,0,1|1,0,0]=4 16757 B13R1.164 C=C(C)CSc1ncc(cc1C)Br 62a_100000748629_100012353652 [0,2,0,0,0,1|1,0,0]=4 16758 B13R1.164 C=C(C)CSc1ncc(cc1C)Br 62a_100012353652_100000211660 [0,2,0,0,0,1|1,0,0]=4 16759 B13R1.164 C=C(C)CSc1ncc(cc1C)C 62a_100000748629_100009864548 [0,2,0,0,0,1|1,0,0]=4 16760 B13R1.164 C=C(C)CSc1ncc(cc1C)C 62a_100009864548_100000211660 [0,2,0,0,0,1|1,0,0]=4 16761 B13R1.164 C=C(C)CSc1ncc(cc1C)F 62a_100000748629_100009817009 [0,2,0,0,0,1|1,0,0]=4 16762 B13R1.164 C=C(C)CSc1ncc(cc1C)F 62a_100009817009_100000211660 [0,2,0,0,0,1|1,0,0]=4 16763 B13R1.164 C=C(C)CSc1ncc(cc1C)N 62a_100000748629_100000761747 [0,2,0,0,0,1|1,0,0]=4 16764 B13R1.164 C=C(C)CSc1ncc(cc1C)N 62a_100000761747_100000211660 [0,2,0,0,0,1|1,0,0]=4 16765 B13R1.164 C=C(C)CSc1ncc(cc1C)O 62a_100000748629_100012000486 [0,2,0,0,0,1|1,0,0]=4 16766 B13R1.164 C=C(C)CSc1ncc(cc1C)O 62a_100012000486_100000211660 [0,2,0,0,0,1|1,0,0]=4 16767 B13R1.164 C=C(C)CSc1ncc(cc1F)Br 62a_100000748629_100012348576 [0,2,0,0,0,1|1,0,0]=4 16768 B13R1.164 C=C(C)CSc1ncc(cc1F)Br 62a_100012348576_100000211660 [0,2,0,0,0,1|1,0,0]=4 16769 B13R1.164 C=C(C)CSc1ncc(cc1F)C 62a_100000748629_100009819633 [0,2,0,0,0,1|1,0,0]=4 16770 B13R1.164 C=C(C)CSc1ncc(cc1F)C 62a_100009819633_100000211660 [0,2,0,0,0,1|1,0,0]=4 16771 B13R1.164 C=C(C)CSc1ncc(cc1F)Cl 62a_100000748629_100012348686 [0,2,0,0,0,1|1,0,0]=4 16772 B13R1.164 C=C(C)CSc1ncc(cc1F)Cl 62a_100012348686_100000211660 [0,2,0,0,0,1|1,0,0]=4 16773 B13R1.164 C=C(C)CSc1ncc(cc1F)F 62a_100000748629_100011219543 [0,2,0,0,0,1|1,0,0]=4 16774 B13R1.164 C=C(C)CSc1ncc(cc1F)F 62a_100011219543_100000211660 [0,2,0,0,0,1|1,0,0]=4 16775 B13R1.164 C=C(C)CSc1ncc(cc1F)N 62a_100000748629_100010280766 [0,2,0,0,0,1|1,0,0]=4 16776 B13R1.164 C=C(C)CSc1ncc(cc1F)N 62a_100010280766_100000211660 [0,2,0,0,0,1|1,0,0]=4 16777 B13R1.164 C=C(C)CSc1ncc(cc1F)O 62a_100000748629_100000063512 [0,2,0,0,0,1|1,0,0]=4 16778 B13R1.164 C=C(C)CSc1ncc(cc1N)Br 62a_100000748629_100010090555 [0,2,0,0,0,1|1,0,0]=4 16779 B13R1.164 C=C(C)CSc1ncc(cc1N)Br 62a_100010090555_100000211660 [0,2,0,0,0,1|1,0,0]=4 16780 B13R1.164 C=C(C)CSc1ncc(cc1N)C 62a_100000733613_100000211660 [0,2,0,0,0,1|1,0,0]=4 16781 B13R1.164 C=C(C)CSc1ncc(cc1N)C 62a_100000748629_100000733613 [0,2,0,0,0,1|1,0,0]=4 16782 B13R1.164 C=C(C)CSc1ncc(cc1N)F 62a_100000748629_100009817643 [0,2,0,0,0,1|1,0,0]=4 16783 B13R1.164 C=C(C)CSc1ncc(cc1N)F 62a_100009817643_100000211660 [0,2,0,0,0,1|1,0,0]=4 16784 B13R1.164 C=C(C)CSc1ncc(cc1N)N 62a_100000748629_200000093520 [0,2,0,0,0,1|1,0,0]=4 16785 B13R1.164 C=C(C)CSc1ncc(cc1N)N 62a_200000093520_100000211660 [0,2,0,0,0,1|1,0,0]=4 16786 B13R1.164 C=C(C)CSc1ncc(cc1O)Br 62a_100000748629_100010210634 [0,2,0,0,0,1|1,0,0]=4 16787 B13R1.164 C=C(C)CSc1ncc(cc1O)Br 62a_100010210634_100000211660 [0,2,0,0,0,1|1,0,0]=4 16788 B13R1.164 C=C(C)CSc1ncc(cc1O)C 62a_100000748629_100012000487 [0,2,0,0,0,1|1,0,0]=4 16789 B13R1.164 C=C(C)CSc1ncc(cc1O)Cl 62a_100000748629_100010233512 [0,2,0,0,0,1|1,0,0]=4 16790 B13R1.164 C=C(C)CSc1ncc(cc1O)Cl 62a_100010233512_100000211660 [0,2,0,0,0,1|1,0,0]=4 16791 B13R1.164 C=C(C)CSc1ncc(cc1O)F 62a_100000748629_100000079967 [0,2,0,0,0,1|1,0,0]=4 16792 B13R1.164 C=C(C)CSc1ncc(cc1O)F 62a_100009820119_100000211660 [0,2,0,0,0,1|1,0,0]=4 16793 B13R1.164 C=C(F)CNc1ccc(cc1Br)Br 34a_100000211012_100009893438 [0,2,0,0,0,1|1,0,0]=4 16794 B13R1.164 C=C(F)CNc1ccc(cc1Br)C 34a_100000210942_100009893438 [0,2,0,0,0,1|1,0,0]=4 16795 B13R1.164 C=C(F)CNc1ccc(cc1Br)Cl 34a_100000752454_100009893438 [0,2,0,0,0,1|1,0,0]=4 16796 B13R1.164 C=C(F)CNc1ccc(cc1Br)F 34a_100000738039_100009893438 [0,2,0,0,0,1|1,0,0]=4 16797 B13R1.164 C=C(F)CNc1ccc(cc1Br)O 34a_100012001276_100009893438 [0,2,0,0,0,1|1,0,0]=4 16798 B13R1.164 C=C(F)CNc1ccc(cc1C)Br 34a_100000211769_100009893438 [0,2,0,0,0,1|1,0,0]=4 16799 B13R1.164 C=C(F)CNc1ccc(cc1C)Br 7a_100000211769_100000042424 [0,2,0,0,0,1|1,0,0]=4 16800 B13R1.164 C=C(F)CNc1ccc(cc1C)C 34a_100000736561_100009893438 [0,2,0,0,0,1|1,0,0]=4 16801 B13R1.164 C=C(F)CNc1ccc(cc1C)C 7a_100000736561_100000042424 [0,2,0,0,0,1|1,0,0]=4 16802 B13R1.164 C=C(F)CNc1ccc(cc1C)Cl 34a_100000210418_100009893438 [0,2,0,0,0,1|1,0,0]=4 16803 B13R1.164 C=C(F)CNc1ccc(cc1C)Cl 7a_100000210418_100000042424 [0,2,0,0,0,1|1,0,0]=4 16804 B13R1.164 C=C(F)CNc1ccc(cc1C)F 34a_100000211637_100009893438 [0,2,0,0,0,1|1,0,0]=4 16805 B13R1.164 C=C(F)CNc1ccc(cc1C)F 7a_100000211637_100000042424 [0,2,0,0,0,1|1,0,0]=4 16806 B13R1.164 C=C(F)CNc1ccc(cc1C)I 34a_100000184554_100009893438 [0,2,0,0,0,1|1,0,0]=4 16807 B13R1.164 C=C(F)CNc1ccc(cc1C)I 7a_100000184554_100000042424 [0,2,0,0,0,1|1,0,0]=4 16808 B13R1.164 C=C(F)CNc1ccc(cc1C)O 34a_100000756630_100009893438 [0,2,0,0,0,1|1,0,0]=4 16809 B13R1.164 C=C(F)CNc1ccc(cc1Cl)Br 34a_100000211467_100009893438 [0,2,0,0,0,1|1,0,0]=4 16810 B13R1.164 C=C(F)CNc1ccc(cc1Cl)C 34a_100000210522_100009893438 [0,2,0,0,0,1|1,0,0]=4 16811 B13R1.164 C=C(F)CNc1ccc(cc1Cl)Cl 34a_100000185861_100009893438 [0,2,0,0,0,1|1,0,0]=4 16812 B13R1.164 C=C(F)CNc1ccc(cc1Cl)F 34a_100000212003_100009893438 [0,2,0,0,0,1|1,0,0]=4 16813 B13R1.164 C=C(F)CNc1ccc(cc1Cl)I 34a_100011218065_100009893438 [0,2,0,0,0,1|1,0,0]=4 16814 B13R1.164 C=C(F)CNc1ccc(cc1Cl)O 34a_100011215599_100009893438 [0,2,0,0,0,1|1,0,0]=4 16815 B13R1.164 C=C(F)CNc1ccc(cc1F)Br 34a_100000210722_100009893438 [0,2,0,0,0,1|1,0,0]=4 16816 B13R1.164 C=C(F)CNc1ccc(cc1F)C 34a_100000211023_100009893438 [0,2,0,0,0,1|1,0,0]=4 16817 B13R1.164 C=C(F)CNc1ccc(cc1F)Cl 34a_100000211020_100009893438 [0,2,0,0,0,1|1,0,0]=4 16818 B13R1.164 C=C(F)CNc1ccc(cc1F)F 34a_100000210720_100009893438 [0,2,0,0,0,1|1,0,0]=4 16819 B13R1.164 C=C(F)CNc1ccc(cc1F)I 34a_100011215594_100009893438 [0,2,0,0,0,1|1,0,0]=4 16820 B13R1.164 C=C(F)CNc1ccc(cc1F)O 34a_100000759473_100009893438 [0,2,0,0,0,1|1,0,0]=4 16821 B13R1.164 C=C(F)CNc1ccc(cc1I)Br 34a_100000187925_100009893438 [0,2,0,0,0,1|1,0,0]=4 16822 B13R1.164 C=C(F)CNc1ccc(cc1I)C 34a_100011356834_100009893438 [0,2,0,0,0,1|1,0,0]=4 16823 B13R1.164 C=C(F)CNc1ccc(cc1I)Cl 34a_100000761889_100009893438 [0,2,0,0,0,1|1,0,0]=4 16824 B13R1.164 C=C(F)CNc1ccc(cc1I)F 34a_100000760547_100009893438 [0,2,0,0,0,1|1,0,0]=4 16825 B13R1.164 C=C(F)CNc1ccc(cc1I)O 34a_100010084370_100009893438 [0,2,0,0,0,1|1,0,0]=4 16826 B13R1.164 C=C(F)CNc1ccc(cc1O)Br 34a_100000739049_100009893438 [0,2,0,0,0,1|1,0,0]=4 16827 B13R1.164 C=C(F)CNc1ccc(cc1O)C 34a_100000211527_100009893438 [0,2,0,0,0,1|1,0,0]=4 16828 B13R1.164 C=C(F)CNc1ccc(cc1O)Cl 34a_100000185728_100009893438 [0,2,0,0,0,1|1,0,0]=4 16829 B13R1.164 C=C(F)CNc1ccc(cc1O)F 34a_100000753323_100009893438 [0,2,0,0,0,1|1,0,0]=4 16830 B13R1.164 C=C(F)CNc1ccc(cc1O)O 34a_100000106777_100009893438 [0,2,0,0,0,1|1,0,0]=4 16831 B13R1.164 C=C(F)COc1ccc(cc1Br)Br 34a_100000188717_100009893438 [0,2,0,0,0,1|1,0,0]=4 16832 B13R1.164 C=C(F)COc1ccc(cc1Br)Br 7a_100000188717_100000042424 [0,2,0,0,0,1|1,0,0]=4 16833 B13R1.164 C=C(F)COc1ccc(cc1Br)C 34a_100000210800_100009893438 [0,2,0,0,0,1|1,0,0]=4 16834 B13R1.164 C=C(F)COc1ccc(cc1Br)C 7a_100000210800_100000042424 [0,2,0,0,0,1|1,0,0]=4 16835 B13R1.164 C=C(F)COc1ccc(cc1Br)Cl 34a_100000211998_100009893438 [0,2,0,0,0,1|1,0,0]=4 16836 B13R1.164 C=C(F)COc1ccc(cc1Br)Cl 7a_100000211998_100000042424 [0,2,0,0,0,1|1,0,0]=4 16837 B13R1.164 C=C(F)COc1ccc(cc1Br)F 34a_100000211999_100009893438 [0,2,0,0,0,1|1,0,0]=4 16838 B13R1.164 C=C(F)COc1ccc(cc1Br)F 7a_100000211999_100000042424 [0,2,0,0,0,1|1,0,0]=4 16839 B13R1.164 C=C(F)COc1ccc(cc1Br)I 34a_100012361655_100009893438 [0,2,0,0,0,1|1,0,0]=4 16840 B13R1.164 C=C(F)COc1ccc(cc1Br)I 7a_100012361655_100000042424 [0,2,0,0,0,1|1,0,0]=4 16841 B13R1.164 C=C(F)COc1ccc(cc1Br)N 34a_100011534360_100009893438 [0,2,0,0,0,1|1,0,0]=4 16842 B13R1.164 C=C(F)COc1ccc(cc1Br)N 7a_100011534360_100000042424 [0,2,0,0,0,1|1,0,0]=4 16843 B13R1.164 C=C(F)COc1ccc(cc1C)Br 34a_100000186361_100009893438 [0,2,0,0,0,1|1,0,0]=4 16844 B13R1.164 C=C(F)COc1ccc(cc1C)Br 7a_100000186361_100000042424 [0,2,0,0,0,1|1,0,0]=4 16845 B13R1.164 C=C(F)COc1ccc(cc1C)C 34a_100000211776_100009893438 [0,2,0,0,0,1|1,0,0]=4 16846 B13R1.164 C=C(F)COc1ccc(cc1C)C 7a_100000211776_100000042424 [0,2,0,0,0,1|1,0,0]=4 16847 B13R1.164 C=C(F)COc1ccc(cc1C)Cl 34a_100000211091_100009893438 [0,2,0,0,0,1|1,0,0]=4 16848 B13R1.164 C=C(F)COc1ccc(cc1C)Cl 7a_100000211091_100000042424 [0,2,0,0,0,1|1,0,0]=4 16849 B13R1.164 C=C(F)COc1ccc(cc1C)F 34a_100000764316_100009893438 [0,2,0,0,0,1|1,0,0]=4 16850 B13R1.164 C=C(F)COc1ccc(cc1C)F 7a_100000764316_100000042424 [0,2,0,0,0,1|1,0,0]=4 16851 B13R1.164 C=C(F)COc1ccc(cc1C)I 34a_100011218673_100009893438 [0,2,0,0,0,1|1,0,0]=4 16852 B13R1.164 C=C(F)COc1ccc(cc1C)I 7a_100011218673_100000042424 [0,2,0,0,0,1|1,0,0]=4 16853 B13R1.164 C=C(F)COc1ccc(cc1C)N 34a_100011218179_100009893438 [0,2,0,0,0,1|1,0,0]=4 16854 B13R1.164 C=C(F)COc1ccc(cc1C)N 7a_100011218179_100000042424 [0,2,0,0,0,1|1,0,0]=4 16855 B13R1.164 C=C(F)COc1ccc(cc1Cl)Br 34a_100000186472_100009893438 [0,2,0,0,0,1|1,0,0]=4 16856 B13R1.164 C=C(F)COc1ccc(cc1Cl)Br 7a_100000186472_100000042424 [0,2,0,0,0,1|1,0,0]=4 16857 B13R1.164 C=C(F)COc1ccc(cc1Cl)C 34a_100000749699_100009893438 [0,2,0,0,0,1|1,0,0]=4 16858 B13R1.164 C=C(F)COc1ccc(cc1Cl)C 7a_100000749699_100000042424 [0,2,0,0,0,1|1,0,0]=4 16859 B13R1.164 C=C(F)COc1ccc(cc1Cl)Cl 34a_100015191787_100009893438 [0,2,0,0,0,1|1,0,0]=4 16860 B13R1.164 C=C(F)COc1ccc(cc1Cl)Cl 7a_100015191787_100000042424 [0,2,0,0,0,1|1,0,0]=4 16861 B13R1.164 C=C(F)COc1ccc(cc1Cl)F 34a_100000212004_100009893438 [0,2,0,0,0,1|1,0,0]=4 16862 B13R1.164 C=C(F)COc1ccc(cc1Cl)F 7a_100000212004_100000042424 [0,2,0,0,0,1|1,0,0]=4 16863 B13R1.164 C=C(F)COc1ccc(cc1Cl)I 34a_100012360047_100009893438 [0,2,0,0,0,1|1,0,0]=4 16864 B13R1.164 C=C(F)COc1ccc(cc1Cl)I 7a_100012360047_100000042424 [0,2,0,0,0,1|1,0,0]=4 16865 B13R1.164 C=C(F)COc1ccc(cc1Cl)N 34a_100000744943_100009893438 [0,2,0,0,0,1|1,0,0]=4 16866 B13R1.164 C=C(F)COc1ccc(cc1Cl)N 7a_100000744943_100000042424 [0,2,0,0,0,1|1,0,0]=4 16867 B13R1.164 C=C(F)COc1ccc(cc1F)Br 34a_100000185481_100009893438 [0,2,0,0,0,1|1,0,0]=4 16868 B13R1.164 C=C(F)COc1ccc(cc1F)Br 7a_100000185481_100000042424 [0,2,0,0,0,1|1,0,0]=4 16869 B13R1.164 C=C(F)COc1ccc(cc1F)C 34a_100011216688_100009893438 [0,2,0,0,0,1|1,0,0]=4 16870 B13R1.164 C=C(F)COc1ccc(cc1F)C 7a_100011216688_100000042424 [0,2,0,0,0,1|1,0,0]=4 16871 B13R1.164 C=C(F)COc1ccc(cc1F)Cl 34a_100000230166_100009893438 [0,2,0,0,0,1|1,0,0]=4 16872 B13R1.164 C=C(F)COc1ccc(cc1F)Cl 7a_100000230166_100000042424 [0,2,0,0,0,1|1,0,0]=4 16873 B13R1.164 C=C(F)COc1ccc(cc1F)F 34a_100000230127_100009893438 [0,2,0,0,0,1|1,0,0]=4 16874 B13R1.164 C=C(F)COc1ccc(cc1F)F 7a_100000230127_100000042424 [0,2,0,0,0,1|1,0,0]=4 16875 B13R1.164 C=C(F)COc1ccc(cc1F)I 34a_100011356965_100009893438 [0,2,0,0,0,1|1,0,0]=4 16876 B13R1.164 C=C(F)COc1ccc(cc1F)I 7a_100011356965_100000042424 [0,2,0,0,0,1|1,0,0]=4 16877 B13R1.164 C=C(F)COc1ccc(cc1F)N 34a_100011220035_100009893438 [0,2,0,0,0,1|1,0,0]=4 16878 B13R1.164 C=C(F)COc1ccc(cc1F)N 7a_100011220035_100000042424 [0,2,0,0,0,1|1,0,0]=4 16879 B13R1.164 C=C(F)COc1ccc(cc1I)Br 34a_100012355227_100009893438 [0,2,0,0,0,1|1,0,0]=4 16880 B13R1.164 C=C(F)COc1ccc(cc1I)Br 7a_100012355227_100000042424 [0,2,0,0,0,1|1,0,0]=4 16881 B13R1.164 C=C(F)COc1ccc(cc1I)C 34a_100000765521_100009893438 [0,2,0,0,0,1|1,0,0]=4 16882 B13R1.164 C=C(F)COc1ccc(cc1I)C 7a_100000765521_100000042424 [0,2,0,0,0,1|1,0,0]=4 16883 B13R1.164 C=C(F)COc1ccc(cc1I)Cl 34a_100011356953_100009893438 [0,2,0,0,0,1|1,0,0]=4 16884 B13R1.164 C=C(F)COc1ccc(cc1I)Cl 7a_100011356953_100000042424 [0,2,0,0,0,1|1,0,0]=4 16885 B13R1.164 C=C(F)COc1ccc(cc1I)F 34a_100012355409_100009893438 [0,2,0,0,0,1|1,0,0]=4 16886 B13R1.164 C=C(F)COc1ccc(cc1I)F 7a_100012355409_100000042424 [0,2,0,0,0,1|1,0,0]=4 16887 B13R1.164 C=C(F)COc1ccc(cc1I)I 7a_100010001573_100000042424 [0,2,0,0,0,1|1,0,0]=4 16888 B13R1.164 C=C(F)COc1ccc(cc1N)Br 34a_100000752626_100009893438 [0,2,0,0,0,1|1,0,0]=4 16889 B13R1.164 C=C(F)COc1ccc(cc1N)Br 7a_100000752626_100000042424 [0,2,0,0,0,1|1,0,0]=4 16890 B13R1.164 C=C(F)COc1ccc(cc1N)C 34a_100011215204_100009893438 [0,2,0,0,0,1|1,0,0]=4 16891 B13R1.164 C=C(F)COc1ccc(cc1N)C 7a_100011215204_100000042424 [0,2,0,0,0,1|1,0,0]=4 16892 B13R1.164 C=C(F)COc1ccc(cc1N)Cl 34a_100000210500_100009893438 [0,2,0,0,0,1|1,0,0]=4 16893 B13R1.164 C=C(F)COc1ccc(cc1N)Cl 7a_100000210500_100000042424 [0,2,0,0,0,1|1,0,0]=4 16894 B13R1.164 C=C(F)COc1ccc(cc1N)F 34a_100000759472_100009893438 [0,2,0,0,0,1|1,0,0]=4 16895 B13R1.164 C=C(F)COc1ccc(cc1N)F 7a_100000759472_100000042424 [0,2,0,0,0,1|1,0,0]=4 16896 B13R1.164 C=C(F)COc1ccc(cc1N)I 34a_100000753495_100009893438 [0,2,0,0,0,1|1,0,0]=4 16897 B13R1.164 C=C(F)COc1ccc(cc1N)I 7a_100000753495_100000042424 [0,2,0,0,0,1|1,0,0]=4 16898 B13R1.164 C=C(F)COc1ccc(cc1N)N 34a_100000725306_100009893438 [0,2,0,0,0,1|1,0,0]=4 16899 B13R1.164 C=C(F)CSc1ccc(cc1Br)Br 62a_100000042424_100011484698 [0,2,0,0,0,1|1,0,0]=4 16900 B13R1.164 C=C(F)CSc1ccc(cc1Br)Br 62a_100011484698_100000042424 [0,2,0,0,0,1|1,0,0]=4 16901 B13R1.164 C=C(F)CSc1ccc(cc1Br)C 62a_100000042424_100009813563 [0,2,0,0,0,1|1,0,0]=4 16902 B13R1.164 C=C(F)CSc1ccc(cc1Br)C 62a_100009813563_100000042424 [0,2,0,0,0,1|1,0,0]=4 16903 B13R1.164 C=C(F)CSc1ccc(cc1Br)Cl 62a_100000042424_100011219703 [0,2,0,0,0,1|1,0,0]=4 16904 B13R1.164 C=C(F)CSc1ccc(cc1Br)Cl 62a_100011219703_100000042424 [0,2,0,0,0,1|1,0,0]=4 16905 B13R1.164 C=C(F)CSc1ccc(cc1Br)F 62a_100000042424_100011217111 [0,2,0,0,0,1|1,0,0]=4 16906 B13R1.164 C=C(F)CSc1ccc(cc1Br)F 62a_100011217111_100000042424 [0,2,0,0,0,1|1,0,0]=4 16907 B13R1.164 C=C(F)CSc1ccc(cc1Br)N 62a_100000042424_100000750458 [0,2,0,0,0,1|1,0,0]=4 16908 B13R1.164 C=C(F)CSc1ccc(cc1Br)N 62a_100000750458_100000042424 [0,2,0,0,0,1|1,0,0]=4 16909 B13R1.164 C=C(F)CSc1ccc(cc1Br)O 62a_100000042424_100000701344 [0,2,0,0,0,1|1,0,0]=4 16910 B13R1.164 C=C(F)CSc1ccc(cc1Br)O 62a_100000701344_100000042424 [0,2,0,0,0,1|1,0,0]=4 16911 B13R1.164 C=C(F)CSc1ccc(cc1C)Br 62a_100000042424_100000701812 [0,2,0,0,0,1|1,0,0]=4 16912 B13R1.164 C=C(F)CSc1ccc(cc1C)Br 62a_100000701812_100000042424 [0,2,0,0,0,1|1,0,0]=4 16913 B13R1.164 C=C(F)CSc1ccc(cc1C)C 62a_100000042424_100011217332 [0,2,0,0,0,1|1,0,0]=4 16914 B13R1.164 C=C(F)CSc1ccc(cc1C)C 62a_100011217332_100000042424 [0,2,0,0,0,1|1,0,0]=4 16915 B13R1.164 C=C(F)CSc1ccc(cc1C)Cl 62a_100000042424_100011219607 [0,2,0,0,0,1|1,0,0]=4 16916 B13R1.164 C=C(F)CSc1ccc(cc1C)Cl 62a_100011219607_100000042424 [0,2,0,0,0,1|1,0,0]=4 16917 B13R1.164 C=C(F)CSc1ccc(cc1C)F 62a_100000042424_100011205405 [0,2,0,0,0,1|1,0,0]=4 16918 B13R1.164 C=C(F)CSc1ccc(cc1C)F 62a_100011205405_100000042424 [0,2,0,0,0,1|1,0,0]=4 16919 B13R1.164 C=C(F)CSc1ccc(cc1C)N 62a_100000042424_100000210723 [0,2,0,0,0,1|1,0,0]=4 16920 B13R1.164 C=C(F)CSc1ccc(cc1C)N 62a_100000210723_100000042424 [0,2,0,0,0,1|1,0,0]=4 16921 B13R1.164 C=C(F)CSc1ccc(cc1C)O 62a_100000042424_100000690111 [0,2,0,0,0,1|1,0,0]=4 16922 B13R1.164 C=C(F)CSc1ccc(cc1Cl)Br 62a_100000042424_100011216062 [0,2,0,0,0,1|1,0,0]=4 16923 B13R1.164 C=C(F)CSc1ccc(cc1Cl)Br 62a_100011216062_100000042424 [0,2,0,0,0,1|1,0,0]=4 16924 B13R1.164 C=C(F)CSc1ccc(cc1Cl)C 62a_100000042424_100011263221 [0,2,0,0,0,1|1,0,0]=4 16925 B13R1.164 C=C(F)CSc1ccc(cc1Cl)C 62a_100011263221_100000042424 [0,2,0,0,0,1|1,0,0]=4 16926 B13R1.164 C=C(F)CSc1ccc(cc1Cl)Cl 62a_100000042424_100000699841 [0,2,0,0,0,1|1,0,0]=4 16927 B13R1.164 C=C(F)CSc1ccc(cc1Cl)Cl 62a_100000699841_100000042424 [0,2,0,0,0,1|1,0,0]=4 16928 B13R1.164 C=C(F)CSc1ccc(cc1Cl)F 62a_100000042424_100000733362 [0,2,0,0,0,1|1,0,0]=4 16929 B13R1.164 C=C(F)CSc1ccc(cc1Cl)F 62a_100000733362_100000042424 [0,2,0,0,0,1|1,0,0]=4 16930 B13R1.164 C=C(F)CSc1ccc(cc1Cl)N 62a_100000042424_100000761885 [0,2,0,0,0,1|1,0,0]=4 16931 B13R1.164 C=C(F)CSc1ccc(cc1Cl)N 62a_100000761885_100000042424 [0,2,0,0,0,1|1,0,0]=4 16932 B13R1.164 C=C(F)CSc1ccc(cc1Cl)O 62a_100000042424_100000047559 [0,2,0,0,0,1|1,0,0]=4 16933 B13R1.164 C=C(F)CSc1ccc(cc1Cl)O 62a_100000047559_100000042424 [0,2,0,0,0,1|1,0,0]=4 16934 B13R1.164 C=C(F)CSc1ccc(cc1F)Br 62a_100000042424_100009814013 [0,2,0,0,0,1|1,0,0]=4 16935 B13R1.164 C=C(F)CSc1ccc(cc1F)Br 62a_100009814013_100000042424 [0,2,0,0,0,1|1,0,0]=4 16936 B13R1.164 C=C(F)CSc1ccc(cc1F)C 62a_100000042424_100011216119 [0,2,0,0,0,1|1,0,0]=4 16937 B13R1.164 C=C(F)CSc1ccc(cc1F)C 62a_100011216119_100000042424 [0,2,0,0,0,1|1,0,0]=4 16938 B13R1.164 C=C(F)CSc1ccc(cc1F)Cl 62a_100000042424_100011216042 [0,2,0,0,0,1|1,0,0]=4 16939 B13R1.164 C=C(F)CSc1ccc(cc1F)Cl 62a_100011216042_100000042424 [0,2,0,0,0,1|1,0,0]=4 16940 B13R1.164 C=C(F)CSc1ccc(cc1F)F 62a_100000042424_100000750030 [0,2,0,0,0,1|1,0,0]=4 16941 B13R1.164 C=C(F)CSc1ccc(cc1F)F 62a_100000750030_100000042424 [0,2,0,0,0,1|1,0,0]=4 16942 B13R1.164 C=C(F)CSc1ccc(cc1F)N 62a_100000042424_100011356925 [0,2,0,0,0,1|1,0,0]=4 16943 B13R1.164 C=C(F)CSc1ccc(cc1F)N 62a_100011356925_100000042424 [0,2,0,0,0,1|1,0,0]=4 16944 B13R1.164 C=C(F)CSc1ccc(cc1F)O 62a_100000042424_100000755031 [0,2,0,0,0,1|1,0,0]=4 16945 B13R1.164 C=C(F)CSc1ccc(cc1F)O 62a_100000755031_100000042424 [0,2,0,0,0,1|1,0,0]=4 16946 B13R1.164 C=C(F)CSc1ccc(cc1N)Br 62a_100000042424_100000743836 [0,2,0,0,0,1|1,0,0]=4 16947 B13R1.164 C=C(F)CSc1ccc(cc1N)Br 62a_100000743836_100000042424 [0,2,0,0,0,1|1,0,0]=4 16948 B13R1.164 C=C(F)CSc1ccc(cc1N)C 62a_100000042424_100011216686 [0,2,0,0,0,1|1,0,0]=4 16949 B13R1.164 C=C(F)CSc1ccc(cc1N)C 62a_100011216686_100000042424 [0,2,0,0,0,1|1,0,0]=4 16950 B13R1.164 C=C(F)CSc1ccc(cc1N)Cl 62a_100000042424_100000761886 [0,2,0,0,0,1|1,0,0]=4 16951 B13R1.164 C=C(F)CSc1ccc(cc1N)Cl 62a_100000761886_100000042424 [0,2,0,0,0,1|1,0,0]=4 16952 B13R1.164 C=C(F)CSc1ccc(cc1N)F 62a_100000042424_100000687223 [0,2,0,0,0,1|1,0,0]=4 16953 B13R1.164 C=C(F)CSc1ccc(cc1N)F 62a_100000687223_100000042424 [0,2,0,0,0,1|1,0,0]=4 16954 B13R1.164 C=C(F)CSc1ccc(cc1N)N 62a_100000042424_200012175722 [0,2,0,0,0,1|1,0,0]=4 16955 B13R1.164 C=C(F)CSc1ccc(cc1N)N 62a_200012175722_100000042424 [0,2,0,0,0,1|1,0,0]=4 16956 B13R1.164 C=C(F)CSc1ccc(cc1N)O 62a_100000042424_100011999798 [0,2,0,0,0,1|1,0,0]=4 16957 B13R1.164 C=C(F)CSc1ccc(cc1N)O 62a_100011999798_100000042424 [0,2,0,0,0,1|1,0,0]=4 16958 B13R1.164 C=C(F)CSc1ccc(cc1O)Br 62a_100000042424_100012344904 [0,2,0,0,0,1|1,0,0]=4 16959 B13R1.164 C=C(F)CSc1ccc(cc1O)Br 62a_100012344904_100000042424 [0,2,0,0,0,1|1,0,0]=4 16960 B13R1.164 C=C(F)CSc1ccc(cc1O)C 62a_100000042424_100012002257 [0,2,0,0,0,1|1,0,0]=4 16961 B13R1.164 C=C(F)CSc1ccc(cc1O)C 62a_100012002257_100000042424 [0,2,0,0,0,1|1,0,0]=4 16962 B13R1.164 C=C(F)CSc1ccc(cc1O)Cl 62a_100000042424_100000050036 [0,2,0,0,0,1|1,0,0]=4 16963 B13R1.164 C=C(F)CSc1ccc(cc1O)Cl 62a_100000050036_100000042424 [0,2,0,0,0,1|1,0,0]=4 16964 B13R1.164 C=C(F)CSc1ccc(cc1O)F 62a_100000042424_100000690578 [0,2,0,0,0,1|1,0,0]=4 16965 B13R1.164 C=C(F)CSc1ccc(cc1O)F 62a_100000690578_100000042424 [0,2,0,0,0,1|1,0,0]=4 16966 B13R1.164 C=C(F)CSc1ccc(cc1O)O 62a_100000042424_100009813921 [0,2,0,0,0,1|1,0,0]=4 16967 B13R1.164 CC(=O)CCc1ccc(cc1Br)Cl 1458a_100000070787_200012945151 [0,2,0,0,0,1|1,0,0]=4 16968 B13R1.164 CC(=O)CCc1ccc(cc1Br)F 1458a_100011308366_200000210301 [0,2,0,0,0,1|1,0,0]=4 16969 B13R1.164 CC(=O)CCc1ccc(cc1C)C 1458a_100000239910_200000210301 [0,2,0,0,0,1|1,0,0]=4 16970 B13R1.164 CC(=O)CCc1ccc(cc1C)F 1458a_100011615716_200000210301 [0,2,0,0,0,1|1,0,0]=4 16971 B13R1.164 CC(=O)CCc1ccc(cc1Cl)Br 1458a_100012349522_200000210301 [0,2,0,0,0,1|1,0,0]=4 16972 B13R1.164 CC(=O)CCc1ccc(cc1Cl)Cl 1458a_100000070787_200012161198 [0,2,0,0,0,1|1,0,0]=4 16973 B13R1.164 CC(=O)CCc1ccc(cc1Cl)Cl 1458a_100000736762_200000210301 [0,2,0,0,0,1|1,0,0]=4 16974 B13R1.164 CC(=O)CCc1ccc(cc1Cl)F 1458a_100011308368_200000210301 [0,2,0,0,0,1|1,0,0]=4 16975 B13R1.164 CC(=O)CCc1ccc(cc1F)Br 1458a_100000747174_200000210301 [0,2,0,0,0,1|1,0,0]=4 16976 B13R1.164 CC(=O)CCc1ccc(cc1F)C 1458a_100000061718_200000210301 [0,2,0,0,0,1|1,0,0]=4 16977 B13R1.164 CC(=O)CCc1ccc(cc1F)Cl 1458a_100012351355_200000210301 [0,2,0,0,0,1|1,0,0]=4 16978 B13R1.164 CC(=O)CCc1ccc(cc1F)F 1458a_100000691965_200000210301 [0,2,0,0,0,1|1,0,0]=4 16979 B13R1.164 CC(=O)CCc1ccc(cc1O)O 1458a_100000041388_200000210301 [0,2,0,0,0,1|1,0,0]=4 16980 B13R1.164 CC(=O)COc1ccc(cc1Br)Br 1458a_200000181479_200000210301 [0,2,0,0,0,1|1,0,0]=4 16981 B13R1.164 CC(=O)COc1ccc(cc1Br)C 1458a_100000186371_200000210301 [0,2,0,0,0,1|1,0,0]=4 16982 B13R1.164 CC(=O)COc1ccc(cc1Br)Cl 1458a_100000184090_200000210301 [0,2,0,0,0,1|1,0,0]=4 16983 B13R1.164 CC(=O)COc1ccc(cc1Br)F 1458a_100000184067_200000210301 [0,2,0,0,0,1|1,0,0]=4 16984 B13R1.164 CC(=O)COc1ccc(cc1C)C 1458a_200000185146_200000210301 [0,2,0,0,0,1|1,0,0]=4 16985 B13R1.164 CC(=O)COc1ccc(cc1C)Cl 1458a_100000182498_200000210301 [0,2,0,0,0,1|1,0,0]=4 16986 B13R1.164 CC(=O)COc1ccc(cc1Cl)Br 1458a_100000185252_200000210301 [0,2,0,0,0,1|1,0,0]=4 16987 B13R1.164 CC(=O)COc1ccc(cc1Cl)C 1458a_200011725833_200000210301 [0,2,0,0,0,1|1,0,0]=4 16988 B13R1.164 CC(=O)COc1ccc(cc1Cl)Cl 1458a_100102647096_200000210301 [0,2,0,0,0,1|1,0,0]=4 16989 B13R1.164 CC(=O)COc1ccc(cc1Cl)F 1458a_100000191239_200000210301 [0,2,0,0,0,1|1,0,0]=4 16990 B13R1.164 CC(=O)COc1ccc(cc1F)Br 1458a_100000184069_200000210301 [0,2,0,0,0,1|1,0,0]=4 16991 B13R1.164 CC(=O)COc1ccc(cc1F)Cl 1458a_100012771990_200000210301 [0,2,0,0,0,1|1,0,0]=4 16992 B13R1.164 CC(=O)COc1ccc(cc1F)F 1458a_100000737261_200000210301 [0,2,0,0,0,1|1,0,0]=4 16993 B13R1.164 CC(=O)COc1ccc(cc1O)Cl 1458a_100010174420_200000210301 [0,2,0,0,0,1|1,0,0]=4 16994 B13R1.164 CC(=O)CSc1ccc(cc1C)Br 1458a_100000679851_200000210301 [0,2,0,0,0,1|1,0,0]=4 16995 B13R1.164 CC(=O)NCc1ccc(cc1Br)Cl 11a_100102692131_100015343762 [0,2,0,0,0,1|1,0,0]=4 16996 B13R1.164 CC(=O)NCc1ccc(cc1Br)Cl 1626a_100102692131_100015343762 [0,2,0,0,0,1|1,0,0]=4 16997 B13R1.164 CC(=O)NCc1ccc(cc1Br)Cl 240690a_100102692131_100015343762 [0,2,0,0,0,1|1,0,0]=4 16998 B13R1.164 CC(=O)NCc1ccc(cc1Br)Cl 527a_100102692131_100103153847 [0,2,0,0,0,1|1,0,0]=4 16999 B13R1.164 CC(=O)NCc1ccc(cc1Br)F 11a_100000708791_100015343762 [0,2,0,0,0,1|1,0,0]=4 17000 B13R1.164 CC(=O)NCc1ccc(cc1Br)F 1626a_100000708791_100015343762 [0,2,0,0,0,1|1,0,0]=4 17001 B13R1.164 CC(=O)NCc1ccc(cc1Br)F 240690a_100000708791_100015343762 [0,2,0,0,0,1|1,0,0]=4 17002 B13R1.164 CC(=O)NCc1ccc(cc1Br)F 527a_100000708791_100103153847 [0,2,0,0,0,1|1,0,0]=4 17003 B13R1.164 CC(=O)NCc1ccc(cc1C)Br 11a_100000753881_100015343762 [0,2,0,0,0,1|1,0,0]=4 17004 B13R1.164 CC(=O)NCc1ccc(cc1C)Br 1626a_100000753881_100015343762 [0,2,0,0,0,1|1,0,0]=4 17005 B13R1.164 CC(=O)NCc1ccc(cc1C)Br 240690a_100000753881_100015343762 [0,2,0,0,0,1|1,0,0]=4 17006 B13R1.164 CC(=O)NCc1ccc(cc1C)Br 527a_100000753881_100103153847 [0,2,0,0,0,1|1,0,0]=4 17007 B13R1.164 CC(=O)NCc1ccc(cc1C)C 11a_100000737523_100015343762 [0,2,0,0,0,1|1,0,0]=4 17008 B13R1.164 CC(=O)NCc1ccc(cc1C)C 1626a_100000737523_100015343762 [0,2,0,0,0,1|1,0,0]=4 17009 B13R1.164 CC(=O)NCc1ccc(cc1C)C 240690a_100000737523_100015343762 [0,2,0,0,0,1|1,0,0]=4 17010 B13R1.164 CC(=O)NCc1ccc(cc1C)C 527a_100000737523_100103153847 [0,2,0,0,0,1|1,0,0]=4 17011 B13R1.164 CC(=O)NCc1ccc(cc1C)Cl 11a_103436540063_100015343762 [0,2,0,0,0,1|1,0,0]=4 17012 B13R1.164 CC(=O)NCc1ccc(cc1C)Cl 1626a_103436540063_100015343762 [0,2,0,0,0,1|1,0,0]=4 17013 B13R1.164 CC(=O)NCc1ccc(cc1C)Cl 240690a_103436540063_100015343762 [0,2,0,0,0,1|1,0,0]=4 17014 B13R1.164 CC(=O)NCc1ccc(cc1C)Cl 527a_103436540063_100103153847 [0,2,0,0,0,1|1,0,0]=4 17015 B13R1.164 CC(=O)NCc1ccc(cc1C)F 11a_100137329023_100015343762 [0,2,0,0,0,1|1,0,0]=4 17016 B13R1.164 CC(=O)NCc1ccc(cc1C)F 1626a_100137329023_100015343762 [0,2,0,0,0,1|1,0,0]=4 17017 B13R1.164 CC(=O)NCc1ccc(cc1C)F 240690a_100137329023_100015343762 [0,2,0,0,0,1|1,0,0]=4 17018 B13R1.164 CC(=O)NCc1ccc(cc1C)F 527a_100137329023_100103153847 [0,2,0,0,0,1|1,0,0]=4 17019 B13R1.164 CC(=O)NCc1ccc(cc1Cl)Br 11a_100020628970_100015343762 [0,2,0,0,0,1|1,0,0]=4 17020 B13R1.164 CC(=O)NCc1ccc(cc1Cl)Br 1626a_100020628970_100015343762 [0,2,0,0,0,1|1,0,0]=4 17021 B13R1.164 CC(=O)NCc1ccc(cc1Cl)Br 240690a_100020628970_100015343762 [0,2,0,0,0,1|1,0,0]=4 17022 B13R1.164 CC(=O)NCc1ccc(cc1Cl)Br 527a_100020628970_100103153847 [0,2,0,0,0,1|1,0,0]=4 17023 B13R1.164 CC(=O)NCc1ccc(cc1Cl)C 11a_100011997539_100015343762 [0,2,0,0,0,1|1,0,0]=4 17024 B13R1.164 CC(=O)NCc1ccc(cc1Cl)C 1626a_100011997539_100015343762 [0,2,0,0,0,1|1,0,0]=4 17025 B13R1.164 CC(=O)NCc1ccc(cc1Cl)C 240690a_100011997539_100015343762 [0,2,0,0,0,1|1,0,0]=4 17026 B13R1.164 CC(=O)NCc1ccc(cc1Cl)C 527a_100011997539_100103153847 [0,2,0,0,0,1|1,0,0]=4 17027 B13R1.164 CC(=O)NCc1ccc(cc1Cl)Cl 11a_100000174880_100015343762 [0,2,0,0,0,1|1,0,0]=4 17028 B13R1.164 CC(=O)NCc1ccc(cc1Cl)Cl 1626a_100000174880_100015343762 [0,2,0,0,0,1|1,0,0]=4 17029 B13R1.164 CC(=O)NCc1ccc(cc1Cl)Cl 240690a_100000174880_100015343762 [0,2,0,0,0,1|1,0,0]=4 17030 B13R1.164 CC(=O)NCc1ccc(cc1Cl)Cl 527a_100000174880_100103153847 [0,2,0,0,0,1|1,0,0]=4 17031 B13R1.164 CC(=O)NCc1ccc(cc1Cl)F 11a_100000174946_100015343762 [0,2,0,0,0,1|1,0,0]=4 17032 B13R1.164 CC(=O)NCc1ccc(cc1Cl)F 1626a_100000174946_100015343762 [0,2,0,0,0,1|1,0,0]=4 17033 B13R1.164 CC(=O)NCc1ccc(cc1Cl)F 240690a_100000174946_100015343762 [0,2,0,0,0,1|1,0,0]=4 17034 B13R1.164 CC(=O)NCc1ccc(cc1Cl)F 527a_100000174946_100103153847 [0,2,0,0,0,1|1,0,0]=4 17035 B13R1.164 CC(=O)NCc1ccc(cc1Cl)O 240690a_200161156549_100015343762 [0,2,0,0,0,1|1,0,0]=4 17036 B13R1.164 CC(=O)NCc1ccc(cc1Cl)O 527a_200161156549_100103153847 [0,2,0,0,0,1|1,0,0]=4 17037 B13R1.164 CC(=O)NCc1ccc(cc1F)Br 11a_100000754580_100015343762 [0,2,0,0,0,1|1,0,0]=4 17038 B13R1.164 CC(=O)NCc1ccc(cc1F)Br 1626a_100000754580_100015343762 [0,2,0,0,0,1|1,0,0]=4 17039 B13R1.164 CC(=O)NCc1ccc(cc1F)Br 240690a_100000754580_100015343762 [0,2,0,0,0,1|1,0,0]=4 17040 B13R1.164 CC(=O)NCc1ccc(cc1F)Br 527a_100000754580_100103153847 [0,2,0,0,0,1|1,0,0]=4 17041 B13R1.164 CC(=O)NCc1ccc(cc1F)C 11a_100102887089_100015343762 [0,2,0,0,0,1|1,0,0]=4 17042 B13R1.164 CC(=O)NCc1ccc(cc1F)C 1626a_100102887089_100015343762 [0,2,0,0,0,1|1,0,0]=4 17043 B13R1.164 CC(=O)NCc1ccc(cc1F)C 240690a_100102887089_100015343762 [0,2,0,0,0,1|1,0,0]=4 17044 B13R1.164 CC(=O)NCc1ccc(cc1F)C 527a_100102887089_100103153847 [0,2,0,0,0,1|1,0,0]=4 17045 B13R1.164 CC(=O)NCc1ccc(cc1F)Cl 11a_100000708496_100015343762 [0,2,0,0,0,1|1,0,0]=4 17046 B13R1.164 CC(=O)NCc1ccc(cc1F)Cl 1626a_100000708496_100015343762 [0,2,0,0,0,1|1,0,0]=4 17047 B13R1.164 CC(=O)NCc1ccc(cc1F)Cl 240690a_100000708496_100015343762 [0,2,0,0,0,1|1,0,0]=4 17048 B13R1.164 CC(=O)NCc1ccc(cc1F)Cl 527a_100000708496_100103153847 [0,2,0,0,0,1|1,0,0]=4 17049 B13R1.164 CC(=O)NCc1ccc(cc1F)F 11a_100000737868_100015343762 [0,2,0,0,0,1|1,0,0]=4 17050 B13R1.164 CC(=O)NCc1ccc(cc1F)F 1626a_100000737868_100015343762 [0,2,0,0,0,1|1,0,0]=4 17051 B13R1.164 CC(=O)NCc1ccc(cc1F)F 240690a_100000737868_100015343762 [0,2,0,0,0,1|1,0,0]=4 17052 B13R1.164 CC(=O)NCc1ccc(cc1F)F 527a_100000737868_100103153847 [0,2,0,0,0,1|1,0,0]=4 17053 B13R1.164 Cc1cc(ccc1CCC(=O)[13CH3])F 1458a_100011615716_200025704644 [0,2,0,0,0,1|1,0,0]=4 17054 B13R1.164 Cc1cc(ccc1OCC(=O)[13CH3])Cl 1458a_100000182498_200025704644 [0,2,0,0,0,1|1,0,0]=4 17055 B13R1.164 Cc1cc(ccc1SCC(=O)[13CH3])Br 1458a_100000679851_200025704644 [0,2,0,0,0,1|1,0,0]=4 17056 B13R1.164 Cc1ccc(c(c1)Br)OCC(=O)[13CH3] 1458a_100000186371_200025704644 [0,2,0,0,0,1|1,0,0]=4 17057 B13R1.164 Cc1ccc(c(c1)C)CCC(=O)[13CH3] 1458a_100000239910_200025704644 [0,2,0,0,0,1|1,0,0]=4 17058 B13R1.164 Cc1ccc(c(c1)C)OCC(=O)[13CH3] 1458a_200000185146_200025704644 [0,2,0,0,0,1|1,0,0]=4 17059 B13R1.164 Cc1ccc(c(c1)Cl)OCC(=O)[13CH3] 1458a_200011725833_200025704644 [0,2,0,0,0,1|1,0,0]=4 17060 B13R1.164 Cc1ccc(c(c1)F)CCC(=O)[13CH3] 1458a_100000061718_200025704644 [0,2,0,0,0,1|1,0,0]=4 17061 B13R1.164 [13CH3]C(=O)CCc1ccc(cc1Br)F 1458a_100011308366_200025704644 [0,2,0,0,0,1|1,0,0]=4 17062 B13R1.164 [13CH3]C(=O)CCc1ccc(cc1Cl)Br 1458a_100012349522_200025704644 [0,2,0,0,0,1|1,0,0]=4 17063 B13R1.164 [13CH3]C(=O)CCc1ccc(cc1Cl)Cl 1458a_100000736762_200025704644 [0,2,0,0,0,1|1,0,0]=4 17064 B13R1.164 [13CH3]C(=O)CCc1ccc(cc1Cl)F 1458a_100011308368_200025704644 [0,2,0,0,0,1|1,0,0]=4 17065 B13R1.164 [13CH3]C(=O)CCc1ccc(cc1F)Br 1458a_100000747174_200025704644 [0,2,0,0,0,1|1,0,0]=4 17066 B13R1.164 [13CH3]C(=O)CCc1ccc(cc1F)Cl 1458a_100012351355_200025704644 [0,2,0,0,0,1|1,0,0]=4 17067 B13R1.164 [13CH3]C(=O)CCc1ccc(cc1F)F 1458a_100000691965_200025704644 [0,2,0,0,0,1|1,0,0]=4 17068 B13R1.164 [13CH3]C(=O)CCc1ccc(cc1O)O 1458a_100000041388_200025704644 [0,2,0,0,0,1|1,0,0]=4 17069 B13R1.164 [13CH3]C(=O)COc1ccc(cc1Br)Br 1458a_200000181479_200025704644 [0,2,0,0,0,1|1,0,0]=4 17070 B13R1.164 [13CH3]C(=O)COc1ccc(cc1Br)Cl 1458a_100000184090_200025704644 [0,2,0,0,0,1|1,0,0]=4 17071 B13R1.164 [13CH3]C(=O)COc1ccc(cc1Br)F 1458a_100000184067_200025704644 [0,2,0,0,0,1|1,0,0]=4 17072 B13R1.164 [13CH3]C(=O)COc1ccc(cc1Cl)Br 1458a_100000185252_200025704644 [0,2,0,0,0,1|1,0,0]=4 17073 B13R1.164 [13CH3]C(=O)COc1ccc(cc1Cl)Cl 1458a_100102647096_200025704644 [0,2,0,0,0,1|1,0,0]=4 17074 B13R1.164 [13CH3]C(=O)COc1ccc(cc1Cl)F 1458a_100000191239_200025704644 [0,2,0,0,0,1|1,0,0]=4 17075 B13R1.164 [13CH3]C(=O)COc1ccc(cc1F)Br 1458a_100000184069_200025704644 [0,2,0,0,0,1|1,0,0]=4 17076 B13R1.164 [13CH3]C(=O)COc1ccc(cc1F)Cl 1458a_100012771990_200025704644 [0,2,0,0,0,1|1,0,0]=4 17077 B13R1.164 [13CH3]C(=O)COc1ccc(cc1F)F 1458a_100000737261_200025704644 [0,2,0,0,0,1|1,0,0]=4 17078 B13R1.164 [13CH3]C(=O)COc1ccc(cc1O)Cl 1458a_100010174420_200025704644 [0,2,0,0,0,1|1,0,0]=4 17079 B13R1.511 C=C(C)CNc1cc(c(cn1)C)F 27a_100000765925_100009841206 [0,2,0,0,0,1|1,0,0]=4 17080 B13R1.511 C=C(C)CNc1ccc(c(c1)Br)Br 2230a_100011306057_100000748629 [0,2,0,0,0,1|0,0,0]=3 17081 B13R1.511 C=C(C)CNc1ccc(c(c1)Br)Br 34a_100011306057_100000748629 [0,2,0,0,0,1|0,0,0]=3 17082 B13R1.511 C=C(C)CNc1ccc(c(c1)Br)Br 7a_100011306057_100000748629 [0,2,0,0,0,1|0,0,0]=3 17083 B13R1.511 C=C(C)CNc1ccc(c(c1)Br)C 2230a_100000736455_100000748629 [0,2,0,0,0,1|0,0,0]=3 17084 B13R1.511 C=C(C)CNc1ccc(c(c1)Br)C 34a_100000736455_100000748629 [0,2,0,0,0,1|0,0,0]=3 17085 B13R1.511 C=C(C)CNc1ccc(c(c1)Br)C 7a_100000736455_100000748629 [0,2,0,0,0,1|0,0,0]=3 17086 B13R1.511 C=C(C)CNc1ccc(c(c1)Br)Cl 2230a_100000686031_100000748629 [0,2,0,0,0,1|0,0,0]=3 17087 B13R1.511 C=C(C)CNc1ccc(c(c1)Br)Cl 34a_100000686031_100000748629 [0,2,0,0,0,1|0,0,0]=3 17088 B13R1.511 C=C(C)CNc1ccc(c(c1)Br)F 2230a_100000760356_100000748629 [0,2,0,0,0,1|0,0,0]=3 17089 B13R1.511 C=C(C)CNc1ccc(c(c1)Br)F 34a_100000760356_100000748629 [0,2,0,0,0,1|0,0,0]=3 17090 B13R1.511 C=C(C)CNc1ccc(c(c1)Br)F 7a_100000760356_100000748629 [0,2,0,0,0,1|0,0,0]=3 17091 B13R1.511 C=C(C)CNc1ccc(c(c1)Br)I 34a_100000750458_100000748629 [0,2,0,0,0,1|0,0,0]=3 17092 B13R1.511 C=C(C)CNc1ccc(c(c1)Br)O 34a_100011534360_100000748629 [0,2,0,0,0,1|0,0,0]=3 17093 B13R1.511 C=C(C)CNc1ccc(c(c1)C)Br 2230a_100000210723_100000748629 [0,2,0,0,0,1|0,0,0]=3 17094 B13R1.511 C=C(C)CNc1ccc(c(c1)C)Br 34a_100000210723_100000748629 [0,2,0,0,0,1|0,0,0]=3 17095 B13R1.511 C=C(C)CNc1ccc(c(c1)C)Br 7a_100000210723_100000748629 [0,2,0,0,0,1|0,0,0]=3 17096 B13R1.511 C=C(C)CNc1ccc(c(c1)C)C 2230a_100000724040_100000748629 [0,2,0,0,0,1|0,0,0]=3 17097 B13R1.511 C=C(C)CNc1ccc(c(c1)C)C 34a_100000724040_100000748629 [0,2,0,0,0,1|0,0,0]=3 17098 B13R1.511 C=C(C)CNc1ccc(c(c1)C)C 7a_100000724040_100000748629 [0,2,0,0,0,1|0,0,0]=3 17099 B13R1.511 C=C(C)CNc1ccc(c(c1)C)Cl 2230a_100000187808_100000748629 [0,2,0,0,0,1|0,0,0]=3 17100 B13R1.511 C=C(C)CNc1ccc(c(c1)C)Cl 34a_100000187808_100000748629 [0,2,0,0,0,1|0,0,0]=3 17101 B13R1.511 C=C(C)CNc1ccc(c(c1)C)Cl 7a_100000187808_100000748629 [0,2,0,0,0,1|0,0,0]=3 17102 B13R1.511 C=C(C)CNc1ccc(c(c1)C)F 2230a_100000750164_100000748629 [0,2,0,0,0,1|0,0,0]=3 17103 B13R1.511 C=C(C)CNc1ccc(c(c1)C)F 34a_100000750164_100000748629 [0,2,0,0,0,1|0,0,0]=3 17104 B13R1.511 C=C(C)CNc1ccc(c(c1)C)F 7a_100000750164_100000748629 [0,2,0,0,0,1|0,0,0]=3 17105 B13R1.511 C=C(C)CNc1ccc(c(c1)C)I 34a_100000198070_100000748629 [0,2,0,0,0,1|0,0,0]=3 17106 B13R1.511 C=C(C)CNc1ccc(c(c1)C)I 7a_100000198070_100000748629 [0,2,0,0,0,1|0,0,0]=3 17107 B13R1.511 C=C(C)CNc1ccc(c(c1)C)O 34a_100011218179_100000748629 [0,2,0,0,0,1|0,0,0]=3 17108 B13R1.511 C=C(C)CNc1ccc(c(c1)C)O 7a_100011218179_100000748629 [0,2,0,0,0,1|0,0,0]=3 17109 B13R1.511 C=C(C)CNc1ccc(c(c1)Cl)Br 2230a_100000687081_100000748629 [0,2,0,0,0,1|0,0,0]=3 17110 B13R1.511 C=C(C)CNc1ccc(c(c1)Cl)Br 34a_100000687081_100000748629 [0,2,0,0,0,1|0,0,0]=3 17111 B13R1.511 C=C(C)CNc1ccc(c(c1)Cl)Br 7a_100000687081_100000748629 [0,2,0,0,0,1|0,0,0]=3 17112 B13R1.511 C=C(C)CNc1ccc(c(c1)Cl)C 2230a_100000188892_100000748629 [0,2,0,0,0,1|0,0,0]=3 17113 B13R1.511 C=C(C)CNc1ccc(c(c1)Cl)C 34a_100000188892_100000748629 [0,2,0,0,0,1|0,0,0]=3 17114 B13R1.511 C=C(C)CNc1ccc(c(c1)Cl)C 7a_100000188892_100000748629 [0,2,0,0,0,1|0,0,0]=3 17115 B13R1.511 C=C(C)CNc1ccc(c(c1)Cl)Cl 2230a_100000184108_100000748629 [0,2,0,0,0,1|0,0,0]=3 17116 B13R1.511 C=C(C)CNc1ccc(c(c1)Cl)Cl 34a_100000184108_100000748629 [0,2,0,0,0,1|0,0,0]=3 17117 B13R1.511 C=C(C)CNc1ccc(c(c1)Cl)F 2230a_100000211060_100000748629 [0,2,0,0,0,1|0,0,0]=3 17118 B13R1.511 C=C(C)CNc1ccc(c(c1)Cl)F 34a_100000211060_100000748629 [0,2,0,0,0,1|0,0,0]=3 17119 B13R1.511 C=C(C)CNc1ccc(c(c1)Cl)F 7a_100000211060_100000748629 [0,2,0,0,0,1|0,0,0]=3 17120 B13R1.511 C=C(C)CNc1ccc(c(c1)Cl)I 34a_100000761885_100000748629 [0,2,0,0,0,1|0,0,0]=3 17121 B13R1.511 C=C(C)CNc1ccc(c(c1)Cl)O 34a_100000744943_100000748629 [0,2,0,0,0,1|0,0,0]=3 17122 B13R1.511 C=C(C)CNc1ccc(c(c1)F)Br 2230a_100000759894_100000748629 [0,2,0,0,0,1|0,0,0]=3 17123 B13R1.511 C=C(C)CNc1ccc(c(c1)F)Br 34a_100000759894_100000748629 [0,2,0,0,0,1|0,0,0]=3 17124 B13R1.511 C=C(C)CNc1ccc(c(c1)F)Br 7a_100000759894_100000748629 [0,2,0,0,0,1|0,0,0]=3 17125 B13R1.511 C=C(C)CNc1ccc(c(c1)F)C 2230a_100000210958_100000748629 [0,2,0,0,0,1|0,0,0]=3 17126 B13R1.511 C=C(C)CNc1ccc(c(c1)F)C 34a_100000210958_100000748629 [0,2,0,0,0,1|0,0,0]=3 17127 B13R1.511 C=C(C)CNc1ccc(c(c1)F)C 7a_100000210958_100000748629 [0,2,0,0,0,1|0,0,0]=3 17128 B13R1.511 C=C(C)CNc1ccc(c(c1)F)Cl 2230a_100000739366_100000748629 [0,2,0,0,0,1|0,0,0]=3 17129 B13R1.511 C=C(C)CNc1ccc(c(c1)F)Cl 34a_100000739366_100000748629 [0,2,0,0,0,1|0,0,0]=3 17130 B13R1.511 C=C(C)CNc1ccc(c(c1)F)Cl 7a_100000739366_100000748629 [0,2,0,0,0,1|0,0,0]=3 17131 B13R1.511 C=C(C)CNc1ccc(c(c1)F)F 2230a_100000210724_100000748629 [0,2,0,0,0,1|0,0,0]=3 17132 B13R1.511 C=C(C)CNc1ccc(c(c1)F)F 34a_100000210724_100000748629 [0,2,0,0,0,1|0,0,0]=3 17133 B13R1.511 C=C(C)CNc1ccc(c(c1)F)F 7a_100000210724_100000748629 [0,2,0,0,0,1|0,0,0]=3 17134 B13R1.511 C=C(C)CNc1ccc(c(c1)F)I 34a_100011356925_100000748629 [0,2,0,0,0,1|0,0,0]=3 17135 B13R1.511 C=C(C)CNc1ccc(c(c1)F)I 7a_100011356925_100000748629 [0,2,0,0,0,1|0,0,0]=3 17136 B13R1.511 C=C(C)CNc1ccc(c(c1)F)O 34a_100011220035_100000748629 [0,2,0,0,0,1|0,0,0]=3 17137 B13R1.511 C=C(C)CNc1ccc(c(c1)F)O 7a_100011220035_100000748629 [0,2,0,0,0,1|0,0,0]=3 17138 B13R1.511 C=C(C)CNc1ccc(c(c1)I)Br 34a_100000750459_100000748629 [0,2,0,0,0,1|0,0,0]=3 17139 B13R1.511 C=C(C)CNc1ccc(c(c1)I)C 34a_100000184131_100000748629 [0,2,0,0,0,1|0,0,0]=3 17140 B13R1.511 C=C(C)CNc1ccc(c(c1)I)C 7a_100000184131_100000748629 [0,2,0,0,0,1|0,0,0]=3 17141 B13R1.511 C=C(C)CNc1ccc(c(c1)I)Cl 34a_100012360549_100000748629 [0,2,0,0,0,1|0,0,0]=3 17142 B13R1.511 C=C(C)CNc1ccc(c(c1)I)F 34a_114828291077_100000748629 [0,2,0,0,0,1|0,0,0]=3 17143 B13R1.511 C=C(C)CNc1ccc(c(c1)I)F 7a_114828291077_100000748629 [0,2,0,0,0,1|0,0,0]=3 17144 B13R1.511 C=C(C)CNc1ccc(c(c1)O)C 34a_100000759471_100000748629 [0,2,0,0,0,1|0,0,0]=3 17145 B13R1.511 C=C(C)CNc1ccc(c(c1)O)C 7a_100000759471_100000748629 [0,2,0,0,0,1|0,0,0]=3 17146 B13R1.511 C=C(C)CNc1ccc(c(c1)O)Cl 34a_100011934209_100000748629 [0,2,0,0,0,1|0,0,0]=3 17147 B13R1.511 C=C(C)CNc1ccc(c(c1)O)F 34a_100012017398_100000748629 [0,2,0,0,0,1|0,0,0]=3 17148 B13R1.511 C=C(C)CNc1ccc(c(c1)O)F 7a_100012017398_100000748629 [0,2,0,0,0,1|0,0,0]=3 17149 B13R1.511 C=C(C)CNc1ccc(c(c1)O)O 34a_100102946323_100000748629 [0,2,0,0,0,1|0,0,0]=3 17150 B13R1.511 C=C(C)CNc1ccc(c(n1)F)Br 27a_100000765925_100010134343 [0,2,0,0,0,1|1,0,0]=4 17151 B13R1.511 C=C(C)CNc1ccn(c(=O)c1)C 27a_100000765925_100009820031 [0,2,0,0,0,1|1,0,0]=4 17152 B13R1.511 C=C(C)COc1cc(c(cn1)Br)C 34a_100000766222_100000748629 [0,2,0,0,0,1|1,0,0]=4 17153 B13R1.511 C=C(C)COc1cc(c(cn1)Br)Cl 34a_100010369989_100000748629 [0,2,0,0,0,1|1,0,0]=4 17154 B13R1.511 C=C(C)COc1cc(c(cn1)C)Br 34a_100009831917_100000748629 [0,2,0,0,0,1|1,0,0]=4 17155 B13R1.511 C=C(C)COc1cc(c(cn1)Cl)C 34a_200000085746_100000748629 [0,2,0,0,0,1|1,0,0]=4 17156 B13R1.511 C=C(C)COc1cc(c(cn1)Cl)Cl 34a_200000099200_100000748629 [0,2,0,0,0,1|1,0,0]=4 17157 B13R1.511 C=C(C)COc1ccc(c(c1)Br)C 34a_100011380479_100000748629 [0,2,0,0,0,1|0,0,0]=3 17158 B13R1.511 C=C(C)COc1ccc(c(c1)Br)C 7a_100011380479_100000748629 [0,2,0,0,0,1|0,0,0]=3 17159 B13R1.511 C=C(C)COc1ccc(c(c1)Br)Cl 34a_100011933957_100000748629 [0,2,0,0,0,1|0,0,0]=3 17160 B13R1.511 C=C(C)COc1ccc(c(c1)Br)Cl 7a_100011933957_100000748629 [0,2,0,0,0,1|0,0,0]=3 17161 B13R1.511 C=C(C)COc1ccc(c(c1)Br)F 34a_100000693481_100000748629 [0,2,0,0,0,1|0,0,0]=3 17162 B13R1.511 C=C(C)COc1ccc(c(c1)Br)F 7a_100000693481_100000748629 [0,2,0,0,0,1|0,0,0]=3 17163 B13R1.511 C=C(C)COc1ccc(c(c1)Br)I 34a_100000701344_100000748629 [0,2,0,0,0,1|0,0,0]=3 17164 B13R1.511 C=C(C)COc1ccc(c(c1)Br)I 7a_100000701344_100000748629 [0,2,0,0,0,1|0,0,0]=3 17165 B13R1.511 C=C(C)COc1ccc(c(c1)Br)N 34a_100012001276_100000748629 [0,2,0,0,0,1|0,0,0]=3 17166 B13R1.511 C=C(C)COc1ccc(c(c1)Br)N 7a_100012001276_100000748629 [0,2,0,0,0,1|0,0,0]=3 17167 B13R1.511 C=C(C)COc1ccc(c(c1)C)Br 34a_100000690111_100000748629 [0,2,0,0,0,1|0,0,0]=3 17168 B13R1.511 C=C(C)COc1ccc(c(c1)C)Br 7a_100000690111_100000748629 [0,2,0,0,0,1|0,0,0]=3 17169 B13R1.511 C=C(C)COc1ccc(c(c1)C)C 34a_100000210932_100000748629 [0,2,0,0,0,1|0,0,0]=3 17170 B13R1.511 C=C(C)COc1ccc(c(c1)C)C 7a_100000210932_100000748629 [0,2,0,0,0,1|0,0,0]=3 17171 B13R1.511 C=C(C)COc1ccc(c(c1)C)Cl 34a_100000211092_100000748629 [0,2,0,0,0,1|0,0,0]=3 17172 B13R1.511 C=C(C)COc1ccc(c(c1)C)Cl 7a_100000211092_100000748629 [0,2,0,0,0,1|0,0,0]=3 17173 B13R1.511 C=C(C)COc1ccc(c(c1)C)F 34a_100000751312_100000748629 [0,2,0,0,0,1|0,0,0]=3 17174 B13R1.511 C=C(C)COc1ccc(c(c1)C)F 7a_100000751312_100000748629 [0,2,0,0,0,1|0,0,0]=3 17175 B13R1.511 C=C(C)COc1ccc(c(c1)C)I 34a_100000729255_100000748629 [0,2,0,0,0,1|0,0,0]=3 17176 B13R1.511 C=C(C)COc1ccc(c(c1)C)I 7a_100000729255_100000748629 [0,2,0,0,0,1|0,0,0]=3 17177 B13R1.511 C=C(C)COc1ccc(c(c1)C)N 34a_100000756630_100000748629 [0,2,0,0,0,1|0,0,0]=3 17178 B13R1.511 C=C(C)COc1ccc(c(c1)C)N 7a_100000756630_100000748629 [0,2,0,0,0,1|0,0,0]=3 17179 B13R1.511 C=C(C)COc1ccc(c(c1)Cl)Br 34a_100011215161_100000748629 [0,2,0,0,0,1|0,0,0]=3 17180 B13R1.511 C=C(C)COc1ccc(c(c1)Cl)Br 7a_100011215161_100000748629 [0,2,0,0,0,1|0,0,0]=3 17181 B13R1.511 C=C(C)COc1ccc(c(c1)Cl)C 34a_100011265682_100000748629 [0,2,0,0,0,1|0,0,0]=3 17182 B13R1.511 C=C(C)COc1ccc(c(c1)Cl)C 7a_100011265682_100000748629 [0,2,0,0,0,1|0,0,0]=3 17183 B13R1.511 C=C(C)COc1ccc(c(c1)Cl)Cl 34a_100000211054_100000748629 [0,2,0,0,0,1|0,0,0]=3 17184 B13R1.511 C=C(C)COc1ccc(c(c1)Cl)Cl 7a_100000211054_100000748629 [0,2,0,0,0,1|0,0,0]=3 17185 B13R1.511 C=C(C)COc1ccc(c(c1)Cl)F 34a_100000211030_100000748629 [0,2,0,0,0,1|0,0,0]=3 17186 B13R1.511 C=C(C)COc1ccc(c(c1)Cl)F 7a_100000211030_100000748629 [0,2,0,0,0,1|0,0,0]=3 17187 B13R1.511 C=C(C)COc1ccc(c(c1)Cl)I 34a_100000047559_100000748629 [0,2,0,0,0,1|0,0,0]=3 17188 B13R1.511 C=C(C)COc1ccc(c(c1)Cl)I 7a_100000047559_100000748629 [0,2,0,0,0,1|0,0,0]=3 17189 B13R1.511 C=C(C)COc1ccc(c(c1)Cl)N 34a_100011215599_100000748629 [0,2,0,0,0,1|0,0,0]=3 17190 B13R1.511 C=C(C)COc1ccc(c(c1)Cl)N 7a_100011215599_100000748629 [0,2,0,0,0,1|0,0,0]=3 17191 B13R1.511 C=C(C)COc1ccc(c(c1)F)Br 34a_100000755031_100000748629 [0,2,0,0,0,1|0,0,0]=3 17192 B13R1.511 C=C(C)COc1ccc(c(c1)F)Br 7a_100000755031_100000748629 [0,2,0,0,0,1|0,0,0]=3 17193 B13R1.511 C=C(C)COc1ccc(c(c1)F)C 34a_100000722560_100000748629 [0,2,0,0,0,1|0,0,0]=3 17194 B13R1.511 C=C(C)COc1ccc(c(c1)F)C 7a_100000722560_100000748629 [0,2,0,0,0,1|0,0,0]=3 17195 B13R1.511 C=C(C)COc1ccc(c(c1)F)Cl 34a_100000691581_100000748629 [0,2,0,0,0,1|0,0,0]=3 17196 B13R1.511 C=C(C)COc1ccc(c(c1)F)Cl 7a_100000691581_100000748629 [0,2,0,0,0,1|0,0,0]=3 17197 B13R1.511 C=C(C)COc1ccc(c(c1)F)F 34a_100000181275_100000748629 [0,2,0,0,0,1|0,0,0]=3 17198 B13R1.511 C=C(C)COc1ccc(c(c1)F)F 7a_100000181275_100000748629 [0,2,0,0,0,1|0,0,0]=3 17199 B13R1.511 C=C(C)COc1ccc(c(c1)F)I 34a_100009990212_100000748629 [0,2,0,0,0,1|0,0,0]=3 17200 B13R1.511 C=C(C)COc1ccc(c(c1)F)I 7a_100009990212_100000748629 [0,2,0,0,0,1|0,0,0]=3 17201 B13R1.511 C=C(C)COc1ccc(c(c1)F)N 34a_100000759473_100000748629 [0,2,0,0,0,1|0,0,0]=3 17202 B13R1.511 C=C(C)COc1ccc(c(c1)F)N 7a_100000759473_100000748629 [0,2,0,0,0,1|0,0,0]=3 17203 B13R1.511 C=C(C)COc1ccc(c(c1)I)Br 34a_100012339312_100000748629 [0,2,0,0,0,1|0,0,0]=3 17204 B13R1.511 C=C(C)COc1ccc(c(c1)I)Br 7a_100012339312_100000748629 [0,2,0,0,0,1|0,0,0]=3 17205 B13R1.511 C=C(C)COc1ccc(c(c1)I)Cl 34a_100000049588_100000748629 [0,2,0,0,0,1|0,0,0]=3 17206 B13R1.511 C=C(C)COc1ccc(c(c1)I)Cl 7a_100000049588_100000748629 [0,2,0,0,0,1|0,0,0]=3 17207 B13R1.511 C=C(C)COc1ccc(c(c1)I)N 34a_100010084370_100000748629 [0,2,0,0,0,1|0,0,0]=3 17208 B13R1.511 C=C(C)COc1ccc(c(c1)I)N 7a_100010084370_100000748629 [0,2,0,0,0,1|0,0,0]=3 17209 B13R1.511 C=C(C)COc1ccc(c(c1)N)Br 34a_100011999798_100000748629 [0,2,0,0,0,1|0,0,0]=3 17210 B13R1.511 C=C(C)COc1ccc(c(c1)N)Br 7a_100011999798_100000748629 [0,2,0,0,0,1|0,0,0]=3 17211 B13R1.511 C=C(C)COc1ccc(c(c1)N)C 34a_100011216113_100000748629 [0,2,0,0,0,1|0,0,0]=3 17212 B13R1.511 C=C(C)COc1ccc(c(c1)N)C 7a_100011216113_100000748629 [0,2,0,0,0,1|0,0,0]=3 17213 B13R1.511 C=C(C)COc1ccc(c(c1)N)Cl 34a_100011934297_100000748629 [0,2,0,0,0,1|0,0,0]=3 17214 B13R1.511 C=C(C)COc1ccc(c(c1)N)F 34a_100012017239_100000748629 [0,2,0,0,0,1|0,0,0]=3 17215 B13R1.511 C=C(C)COc1ccc(c(c1)N)F 7a_100012017239_100000748629 [0,2,0,0,0,1|0,0,0]=3 17216 B13R1.511 C=C(C)COc1ccc(c(c1)N)N 34a_100025771000_100000748629 [0,2,0,0,0,1|0,0,0]=3 17217 B13R1.511 C=C(C)COc1ccc(c(n1)C)Br 34a_100000691680_100000748629 [0,2,0,0,0,1|1,0,0]=4 17218 B13R1.511 C=C(C)COc1ccc(c(n1)C)Cl 34a_200009863735_100000748629 [0,2,0,0,0,1|1,0,0]=4 17219 B13R1.511 C=C(C)COc1ccc(c(n1)F)Br 34a_100009879308_100000748629 [0,2,0,0,0,1|1,0,0]=4 17220 B13R1.511 C=C(C)COc1cnc(c(c1)Br)C 34a_100009819603_100000748629 [0,2,0,0,0,1|1,0,0]=4 17221 B13R1.511 C=C(C)COc1cnc(c(c1)Br)C 7a_100009819603_100000748629 [0,2,0,0,0,1|1,0,0]=4 17222 B13R1.511 C=C(C)COc1cnc(c(c1)Br)Cl 34a_100012356455_100000748629 [0,2,0,0,0,1|1,0,0]=4 17223 B13R1.511 C=C(C)COc1cnc(c(c1)Br)Cl 7a_100012356455_100000748629 [0,2,0,0,0,1|1,0,0]=4 17224 B13R1.511 C=C(C)COc1cnc(c(c1)Br)F 34a_100009817267_100000748629 [0,2,0,0,0,1|1,0,0]=4 17225 B13R1.511 C=C(C)COc1cnc(c(c1)Br)F 7a_100009817267_100000748629 [0,2,0,0,0,1|1,0,0]=4 17226 B13R1.511 C=C(C)COc1cnc(c(c1)C)Br 34a_100012000486_100000748629 [0,2,0,0,0,1|1,0,0]=4 17227 B13R1.511 C=C(C)COc1cnc(c(c1)C)Br 7a_100012000486_100000748629 [0,2,0,0,0,1|1,0,0]=4 17228 B13R1.511 C=C(C)COc1cnc(c(c1)C)C 34a_100009854398_100000748629 [0,2,0,0,0,1|1,0,0]=4 17229 B13R1.511 C=C(C)COc1cnc(c(c1)C)C 7a_100009854398_100000748629 [0,2,0,0,0,1|1,0,0]=4 17230 B13R1.511 C=C(C)COc1cnc(c(c1)C)Cl 34a_100012002680_100000748629 [0,2,0,0,0,1|1,0,0]=4 17231 B13R1.511 C=C(C)COc1cnc(c(c1)C)Cl 7a_100012002680_100000748629 [0,2,0,0,0,1|1,0,0]=4 17232 B13R1.511 C=C(C)COc1cnc(c(c1)C)F 34a_100000094615_100000748629 [0,2,0,0,0,1|1,0,0]=4 17233 B13R1.511 C=C(C)COc1cnc(c(c1)C)F 7a_100000094615_100000748629 [0,2,0,0,0,1|1,0,0]=4 17234 B13R1.511 C=C(C)COc1cnc(c(c1)Cl)Br 34a_100010209684_100000748629 [0,2,0,0,0,1|1,0,0]=4 17235 B13R1.511 C=C(C)COc1cnc(c(c1)Cl)Br 7a_100010209684_100000748629 [0,2,0,0,0,1|1,0,0]=4 17236 B13R1.511 C=C(C)COc1cnc(c(c1)Cl)Cl 34a_100000094354_100000748629 [0,2,0,0,0,1|1,0,0]=4 17237 B13R1.511 C=C(C)COc1cnc(c(c1)Cl)Cl 7a_100000094354_100000748629 [0,2,0,0,0,1|1,0,0]=4 17238 B13R1.511 C=C(C)COc1cnc(c(c1)Cl)F 34a_100000087088_100000748629 [0,2,0,0,0,1|1,0,0]=4 17239 B13R1.511 C=C(C)COc1cnc(c(c1)Cl)F 7a_100000087088_100000748629 [0,2,0,0,0,1|1,0,0]=4 17240 B13R1.511 C=C(C)COc1cnc(c(c1)F)Cl 34a_100000063512_100000748629 [0,2,0,0,0,1|1,0,0]=4 17241 B13R1.511 C=C(C)COc1cnc(c(c1)F)Cl 7a_100000063512_100000748629 [0,2,0,0,0,1|1,0,0]=4 17242 B13R1.511 C=C(C)CSc1c[nH]c(=O)c(c1)Br 62a_100000748629_100010125443 [0,2,0,0,0,1|1,0,0]=4 17243 B13R1.511 C=C(C)CSc1c[nH]c(=O)c(c1)Br 62a_100010125443_100000211660 [0,2,0,0,0,1|1,0,0]=4 17244 B13R1.511 C=C(C)CSc1c[nH]c(=O)c(c1)F 62a_100000723523_100000211660 [0,2,0,0,0,1|1,0,0]=4 17245 B13R1.511 C=C(C)CSc1c[nH]c(=O)c(c1)F 62a_100000748629_100000723523 [0,2,0,0,0,1|1,0,0]=4 17246 B13R1.511 C=C(C)CSc1c[nH]c(=O)c(c1)O 62a_100000748629_100009814561 [0,2,0,0,0,1|1,0,0]=4 17247 B13R1.511 C=C(C)CSc1cc(c(cn1)Br)C 62a_100000748629_100012356354 [0,2,0,0,0,1|1,0,0]=4 17248 B13R1.511 C=C(C)CSc1cc(c(cn1)Br)C 62a_100012356354_100000211660 [0,2,0,0,0,1|1,0,0]=4 17249 B13R1.511 C=C(C)CSc1cc(c(cn1)C)C 62a_100000748629_100009850809 [0,2,0,0,0,1|1,0,0]=4 17250 B13R1.511 C=C(C)CSc1cc(c(cn1)C)C 62a_100009850809_100000211660 [0,2,0,0,0,1|1,0,0]=4 17251 B13R1.511 C=C(C)CSc1cc(c(cn1)C)F 62a_100000748629_100009841206 [0,2,0,0,0,1|1,0,0]=4 17252 B13R1.511 C=C(C)CSc1cc(c(cn1)C)F 62a_100009841206_100000211660 [0,2,0,0,0,1|1,0,0]=4 17253 B13R1.511 C=C(C)CSc1cc(c(cn1)C)N 62a_100000126663_100000211660 [0,2,0,0,0,1|1,0,0]=4 17254 B13R1.511 C=C(C)CSc1cc(c(cn1)C)N 62a_100000748629_100000126663 [0,2,0,0,0,1|1,0,0]=4 17255 B13R1.511 C=C(C)CSc1cc(c(cn1)C)O 62a_100000704368_100000211660 [0,2,0,0,0,1|1,0,0]=4 17256 B13R1.511 C=C(C)CSc1cc(c(cn1)C)O 62a_100000748629_100000704368 [0,2,0,0,0,1|1,0,0]=4 17257 B13R1.511 C=C(C)CSc1cc(c(cn1)F)C 62a_100000748629_100009818257 [0,2,0,0,0,1|1,0,0]=4 17258 B13R1.511 C=C(C)CSc1cc(c(cn1)F)C 62a_100009818257_100000211660 [0,2,0,0,0,1|1,0,0]=4 17259 B13R1.511 C=C(C)CSc1cc(c(cn1)F)N 62a_100000126464_100000211660 [0,2,0,0,0,1|1,0,0]=4 17260 B13R1.511 C=C(C)CSc1cc(c(cn1)F)N 62a_100000748629_100000126464 [0,2,0,0,0,1|1,0,0]=4 17261 B13R1.511 C=C(C)CSc1cc(c(cn1)F)O 62a_100000748629_100009854642 [0,2,0,0,0,1|1,0,0]=4 17262 B13R1.511 C=C(C)CSc1cc(c(cn1)F)O 62a_100009854642_100000211660 [0,2,0,0,0,1|1,0,0]=4 17263 B13R1.511 C=C(C)CSc1cc(c(cn1)N)C 62a_100000067204_100000211660 [0,2,0,0,0,1|1,0,0]=4 17264 B13R1.511 C=C(C)CSc1cc(c(cn1)N)C 62a_100000748629_100000067204 [0,2,0,0,0,1|1,0,0]=4 17265 B13R1.511 C=C(C)CSc1cc(c(cn1)N)N 62a_100000067514_100000211660 [0,2,0,0,0,1|1,0,0]=4 17266 B13R1.511 C=C(C)CSc1cc(c(cn1)N)N 62a_100000748629_100000067514 [0,2,0,0,0,1|1,0,0]=4 17267 B13R1.511 C=C(C)CSc1cc(c(cn1)O)C 62a_100000748629_100000692680 [0,2,0,0,0,1|1,0,0]=4 17268 B13R1.511 C=C(C)CSc1cc(c(cn1)O)N 62a_100000748629_100009819941 [0,2,0,0,0,1|1,0,0]=4 17269 B13R1.511 C=C(C)CSc1cc(c(cn1)O)N 62a_100009819941_100000211660 [0,2,0,0,0,1|1,0,0]=4 17270 B13R1.511 C=C(C)CSc1ccc(=O)n(c1)C 62a_100000748629_100011245003 [0,2,0,0,0,1|1,0,0]=4 17271 B13R1.511 C=C(C)CSc1ccc(=O)n(c1)C 62a_100011245003_100000211660 [0,2,0,0,0,1|1,0,0]=4 17272 B13R1.511 C=C(C)CSc1ccc([n+](c1)[O-])C 62a_100000748629_100000703231 [0,2,0,0,0,1|1,0,0]=4 17273 B13R1.511 C=C(C)CSc1ccc(c(c1)Br)Br 62a_100000748629_100012356285 [0,2,0,0,0,1|0,0,0]=3 17274 B13R1.511 C=C(C)CSc1ccc(c(c1)Br)Br 62a_100012356285_100000211660 [0,2,0,0,0,1|0,0,0]=3 17275 B13R1.511 C=C(C)CSc1ccc(c(c1)Br)C 62a_100000748629_100011847877 [0,2,0,0,0,1|0,0,0]=3 17276 B13R1.511 C=C(C)CSc1ccc(c(c1)Br)C 62a_100011847877_100000211660 [0,2,0,0,0,1|0,0,0]=3 17277 B13R1.511 C=C(C)CSc1ccc(c(c1)Br)Cl 62a_100000748629_100012353702 [0,2,0,0,0,1|0,0,0]=3 17278 B13R1.511 C=C(C)CSc1ccc(c(c1)Br)Cl 62a_100012353702_100000211660 [0,2,0,0,0,1|0,0,0]=3 17279 B13R1.511 C=C(C)CSc1ccc(c(c1)Br)F 62a_100000748629_100012047266 [0,2,0,0,0,1|0,0,0]=3 17280 B13R1.511 C=C(C)CSc1ccc(c(c1)Br)F 62a_100012047266_100000211660 [0,2,0,0,0,1|0,0,0]=3 17281 B13R1.511 C=C(C)CSc1ccc(c(c1)Br)N 62a_100000748629_100000750455 [0,2,0,0,0,1|0,0,0]=3 17282 B13R1.511 C=C(C)CSc1ccc(c(c1)Br)N 62a_100000750455_100000211660 [0,2,0,0,0,1|0,0,0]=3 17283 B13R1.511 C=C(C)CSc1ccc(c(c1)Br)O 62a_100000748629_100012361655 [0,2,0,0,0,1|0,0,0]=3 17284 B13R1.511 C=C(C)CSc1ccc(c(c1)Br)O 62a_100012361655_100000211660 [0,2,0,0,0,1|0,0,0]=3 17285 B13R1.511 C=C(C)CSc1ccc(c(c1)C)Br 62a_100000748629_100009813585 [0,2,0,0,0,1|0,0,0]=3 17286 B13R1.511 C=C(C)CSc1ccc(c(c1)C)Br 62a_100009813585_100000211660 [0,2,0,0,0,1|0,0,0]=3 17287 B13R1.511 C=C(C)CSc1ccc(c(c1)C)C 62a_100000748629_100011215607 [0,2,0,0,0,1|0,0,0]=3 17288 B13R1.511 C=C(C)CSc1ccc(c(c1)C)C 62a_100011215607_100000211660 [0,2,0,0,0,1|0,0,0]=3 17289 B13R1.511 C=C(C)CSc1ccc(c(c1)C)Cl 62a_100000049509_100000211660 [0,2,0,0,0,1|0,0,0]=3 17290 B13R1.511 C=C(C)CSc1ccc(c(c1)C)Cl 62a_100000748629_100000049509 [0,2,0,0,0,1|0,0,0]=3 17291 B13R1.511 C=C(C)CSc1ccc(c(c1)C)F 62a_100000748629_100011218330 [0,2,0,0,0,1|0,0,0]=3 17292 B13R1.511 C=C(C)CSc1ccc(c(c1)C)F 62a_100011218330_100000211660 [0,2,0,0,0,1|0,0,0]=3 17293 B13R1.511 C=C(C)CSc1ccc(c(c1)C)N 62a_100000211769_100000211660 [0,2,0,0,0,1|0,0,0]=3 17294 B13R1.511 C=C(C)CSc1ccc(c(c1)C)N 62a_100000748629_100000211769 [0,2,0,0,0,1|0,0,0]=3 17295 B13R1.511 C=C(C)CSc1ccc(c(c1)C)O 62a_100000748629_100000186361 [0,2,0,0,0,1|0,0,0]=3 17296 B13R1.511 C=C(C)CSc1ccc(c(c1)Cl)Br 62a_100000748629_100012047281 [0,2,0,0,0,1|0,0,0]=3 17297 B13R1.511 C=C(C)CSc1ccc(c(c1)Cl)Br 62a_100012047281_100000211660 [0,2,0,0,0,1|0,0,0]=3 17298 B13R1.511 C=C(C)CSc1ccc(c(c1)Cl)C 62a_100000748629_100011216363 [0,2,0,0,0,1|0,0,0]=3 17299 B13R1.511 C=C(C)CSc1ccc(c(c1)Cl)C 62a_100011216363_100000211660 [0,2,0,0,0,1|0,0,0]=3 17300 B13R1.511 C=C(C)CSc1ccc(c(c1)Cl)Cl 62a_100000748629_100011214914 [0,2,0,0,0,1|0,0,0]=3 17301 B13R1.511 C=C(C)CSc1ccc(c(c1)Cl)Cl 62a_100011214914_100000211660 [0,2,0,0,0,1|0,0,0]=3 17302 B13R1.511 C=C(C)CSc1ccc(c(c1)Cl)F 62a_100000748629_100011215976 [0,2,0,0,0,1|0,0,0]=3 17303 B13R1.511 C=C(C)CSc1ccc(c(c1)Cl)F 62a_100011215976_100000211660 [0,2,0,0,0,1|0,0,0]=3 17304 B13R1.511 C=C(C)CSc1ccc(c(c1)Cl)N 62a_100000748629_100011218065 [0,2,0,0,0,1|0,0,0]=3 17305 B13R1.511 C=C(C)CSc1ccc(c(c1)Cl)N 62a_100011218065_100000211660 [0,2,0,0,0,1|0,0,0]=3 17306 B13R1.511 C=C(C)CSc1ccc(c(c1)Cl)O 62a_100000748629_100012360047 [0,2,0,0,0,1|0,0,0]=3 17307 B13R1.511 C=C(C)CSc1ccc(c(c1)Cl)O 62a_100012360047_100000211660 [0,2,0,0,0,1|0,0,0]=3 17308 B13R1.511 C=C(C)CSc1ccc(c(c1)F)Br 62a_100000685389_100000211660 [0,2,0,0,0,1|0,0,0]=3 17309 B13R1.511 C=C(C)CSc1ccc(c(c1)F)Br 62a_100000748629_100000685389 [0,2,0,0,0,1|0,0,0]=3 17310 B13R1.511 C=C(C)CSc1ccc(c(c1)F)C 62a_100000720648_100000211660 [0,2,0,0,0,1|0,0,0]=3 17311 B13R1.511 C=C(C)CSc1ccc(c(c1)F)C 62a_100000748629_100000720648 [0,2,0,0,0,1|0,0,0]=3 17312 B13R1.511 C=C(C)CSc1ccc(c(c1)F)Cl 62a_100000748629_100011216805 [0,2,0,0,0,1|0,0,0]=3 17313 B13R1.511 C=C(C)CSc1ccc(c(c1)F)Cl 62a_100011216805_100000211660 [0,2,0,0,0,1|0,0,0]=3 17314 B13R1.511 C=C(C)CSc1ccc(c(c1)F)F 62a_100000703953_100000211660 [0,2,0,0,0,1|0,0,0]=3 17315 B13R1.511 C=C(C)CSc1ccc(c(c1)F)F 62a_100000748629_100000703953 [0,2,0,0,0,1|0,0,0]=3 17316 B13R1.511 C=C(C)CSc1ccc(c(c1)F)N 62a_100000748629_100011215594 [0,2,0,0,0,1|0,0,0]=3 17317 B13R1.511 C=C(C)CSc1ccc(c(c1)F)N 62a_100011215594_100000211660 [0,2,0,0,0,1|0,0,0]=3 17318 B13R1.511 C=C(C)CSc1ccc(c(c1)F)O 62a_100000185481_100000211660 [0,2,0,0,0,1|0,0,0]=3 17319 B13R1.511 C=C(C)CSc1ccc(c(c1)F)O 62a_100000748629_100000185481 [0,2,0,0,0,1|0,0,0]=3 17320 B13R1.511 C=C(C)CSc1ccc(c(c1)N)Br 62a_100000748629_100000750456 [0,2,0,0,0,1|0,0,0]=3 17321 B13R1.511 C=C(C)CSc1ccc(c(c1)N)Br 62a_100000750456_100000211660 [0,2,0,0,0,1|0,0,0]=3 17322 B13R1.511 C=C(C)CSc1ccc(c(c1)N)C 62a_100000748629_100000761890 [0,2,0,0,0,1|0,0,0]=3 17323 B13R1.511 C=C(C)CSc1ccc(c(c1)N)C 62a_100000761890_100000211660 [0,2,0,0,0,1|0,0,0]=3 17324 B13R1.511 C=C(C)CSc1ccc(c(c1)N)Cl 62a_100000748629_200000761891 [0,2,0,0,0,1|0,0,0]=3 17325 B13R1.511 C=C(C)CSc1ccc(c(c1)N)Cl 62a_200000761891_100000211660 [0,2,0,0,0,1|0,0,0]=3 17326 B13R1.511 C=C(C)CSc1ccc(c(c1)N)F 62a_100000740924_100000211660 [0,2,0,0,0,1|0,0,0]=3 17327 B13R1.511 C=C(C)CSc1ccc(c(c1)N)F 62a_100000748629_100000740924 [0,2,0,0,0,1|0,0,0]=3 17328 B13R1.511 C=C(C)CSc1ccc(c(c1)N)N 62a_100000741789_100000211660 [0,2,0,0,0,1|0,0,0]=3 17329 B13R1.511 C=C(C)CSc1ccc(c(c1)N)N 62a_100000748629_100011534411 [0,2,0,0,0,1|0,0,0]=3 17330 B13R1.511 C=C(C)CSc1ccc(c(c1)N)O 62a_100000748629_100000752626 [0,2,0,0,0,1|0,0,0]=3 17331 B13R1.511 C=C(C)CSc1ccc(c(c1)N)O 62a_100000752626_100000211660 [0,2,0,0,0,1|0,0,0]=3 17332 B13R1.511 C=C(C)CSc1ccc(c(c1)O)Br 62a_100000748629_100012356990 [0,2,0,0,0,1|0,0,0]=3 17333 B13R1.511 C=C(C)CSc1ccc(c(c1)O)Br 62a_100012356990_100000211660 [0,2,0,0,0,1|0,0,0]=3 17334 B13R1.511 C=C(C)CSc1ccc(c(c1)O)C 62a_100000685420_100000211660 [0,2,0,0,0,1|0,0,0]=3 17335 B13R1.511 C=C(C)CSc1ccc(c(c1)O)C 62a_100000748629_100000685420 [0,2,0,0,0,1|0,0,0]=3 17336 B13R1.511 C=C(C)CSc1ccc(c(c1)O)Cl 62a_100000748629_100011356854 [0,2,0,0,0,1|0,0,0]=3 17337 B13R1.511 C=C(C)CSc1ccc(c(c1)O)Cl 62a_100011356854_100000211660 [0,2,0,0,0,1|0,0,0]=3 17338 B13R1.511 C=C(C)CSc1ccc(c(c1)O)F 62a_100000686035_100000211660 [0,2,0,0,0,1|0,0,0]=3 17339 B13R1.511 C=C(C)CSc1ccc(c(c1)O)F 62a_100000748629_100000686035 [0,2,0,0,0,1|0,0,0]=3 17340 B13R1.511 C=C(C)CSc1ccc(c(c1)O)N 62a_100000739049_100000211660 [0,2,0,0,0,1|0,0,0]=3 17341 B13R1.511 C=C(C)CSc1ccc(c(c1)O)N 62a_100000748629_100000739049 [0,2,0,0,0,1|0,0,0]=3 17342 B13R1.511 C=C(C)CSc1ccc(c(c1)O)O 62a_100000748629_100009813601 [0,2,0,0,0,1|0,0,0]=3 17343 B13R1.511 C=C(C)CSc1ccc(c(n1)Br)O 62a_100000725334_100000211660 [0,2,0,0,0,1|1,0,0]=4 17344 B13R1.511 C=C(C)CSc1ccc(c(n1)Br)O 62a_100000748629_100000725334 [0,2,0,0,0,1|1,0,0]=4 17345 B13R1.511 C=C(C)CSc1ccc(c(n1)C)Br 62a_100000748629_100012360386 [0,2,0,0,0,1|1,0,0]=4 17346 B13R1.511 C=C(C)CSc1ccc(c(n1)C)Br 62a_100012360386_100000211660 [0,2,0,0,0,1|1,0,0]=4 17347 B13R1.511 C=C(C)CSc1ccc(c(n1)C)C 62a_100000103781_100000211660 [0,2,0,0,0,1|1,0,0]=4 17348 B13R1.511 C=C(C)CSc1ccc(c(n1)C)C 62a_100000748629_100000103781 [0,2,0,0,0,1|1,0,0]=4 17349 B13R1.511 C=C(C)CSc1ccc(c(n1)C)F 62a_100000748629_100009814307 [0,2,0,0,0,1|1,0,0]=4 17350 B13R1.511 C=C(C)CSc1ccc(c(n1)C)F 62a_100009814307_100000211660 [0,2,0,0,0,1|1,0,0]=4 17351 B13R1.511 C=C(C)CSc1ccc(c(n1)C)N 62a_100000720120_100000211660 [0,2,0,0,0,1|1,0,0]=4 17352 B13R1.511 C=C(C)CSc1ccc(c(n1)C)N 62a_100000748629_100000720120 [0,2,0,0,0,1|1,0,0]=4 17353 B13R1.511 C=C(C)CSc1ccc(c(n1)C)O 62a_100000748629_100010233687 [0,2,0,0,0,1|1,0,0]=4 17354 B13R1.511 C=C(C)CSc1ccc(c(n1)C)O 62a_100010233687_100000211660 [0,2,0,0,0,1|1,0,0]=4 17355 B13R1.511 C=C(C)CSc1ccc(c(n1)Cl)N 62a_100000748629_200010233646 [0,2,0,0,0,1|1,0,0]=4 17356 B13R1.511 C=C(C)CSc1ccc(c(n1)Cl)N 62a_200010233646_100000211660 [0,2,0,0,0,1|1,0,0]=4 17357 B13R1.511 C=C(C)CSc1ccc(c(n1)Cl)O 62a_100000748629_100000721234 [0,2,0,0,0,1|1,0,0]=4 17358 B13R1.511 C=C(C)CSc1ccc(c(n1)F)Br 62a_100000748629_100010134343 [0,2,0,0,0,1|1,0,0]=4 17359 B13R1.511 C=C(C)CSc1ccc(c(n1)F)Br 62a_100010134343_100000211660 [0,2,0,0,0,1|1,0,0]=4 17360 B13R1.511 C=C(C)CSc1ccc(c(n1)F)N 62a_100000748629_100009856439 [0,2,0,0,0,1|1,0,0]=4 17361 B13R1.511 C=C(C)CSc1ccc(c(n1)F)N 62a_100009856439_100000211660 [0,2,0,0,0,1|1,0,0]=4 17362 B13R1.511 C=C(C)CSc1ccc(c(n1)F)O 62a_100000748629_100009819667 [0,2,0,0,0,1|1,0,0]=4 17363 B13R1.511 C=C(C)CSc1ccc(c(n1)F)O 62a_100009819667_100000211660 [0,2,0,0,0,1|1,0,0]=4 17364 B13R1.511 C=C(C)CSc1ccc(c(n1)N)C 62a_100000748629_100009857032 [0,2,0,0,0,1|1,0,0]=4 17365 B13R1.511 C=C(C)CSc1ccc(c(n1)N)C 62a_100009857032_100000211660 [0,2,0,0,0,1|1,0,0]=4 17366 B13R1.511 C=C(C)CSc1ccc(c(n1)N)F 62a_100000748629_100016091773 [0,2,0,0,0,1|1,0,0]=4 17367 B13R1.511 C=C(C)CSc1ccc(c(n1)N)F 62a_100016091773_100000211660 [0,2,0,0,0,1|1,0,0]=4 17368 B13R1.511 C=C(C)CSc1ccc(c(n1)N)N 62a_100000747239_100000211660 [0,2,0,0,0,1|1,0,0]=4 17369 B13R1.511 C=C(C)CSc1ccc(c(n1)N)O 62a_100000685527_100000211660 [0,2,0,0,0,1|1,0,0]=4 17370 B13R1.511 C=C(C)CSc1ccc(c(n1)N)O 62a_100000748629_100000685527 [0,2,0,0,0,1|1,0,0]=4 17371 B13R1.511 C=C(C)CSc1ccc(c(n1)O)F 62a_100000748629_100010729010 [0,2,0,0,0,1|1,0,0]=4 17372 B13R1.511 C=C(C)CSc1ccc(c(n1)O)N 62a_100000718904_100000211660 [0,2,0,0,0,1|1,0,0]=4 17373 B13R1.511 C=C(C)CSc1ccn(c(=O)c1)C 62a_100000748629_100009820031 [0,2,0,0,0,1|1,0,0]=4 17374 B13R1.511 C=C(C)CSc1ccn(c(=O)c1)C 62a_100009820031_100000211660 [0,2,0,0,0,1|1,0,0]=4 17375 B13R1.511 C=C(C)CSc1cnc(c(c1)Br)Cl 62a_100000748629_100010172733 [0,2,0,0,0,1|1,0,0]=4 17376 B13R1.511 C=C(C)CSc1cnc(c(c1)Br)Cl 62a_100010172733_100000211660 [0,2,0,0,0,1|1,0,0]=4 17377 B13R1.511 C=C(C)CSc1cnc(c(c1)Br)N 62a_100000748629_100012353989 [0,2,0,0,0,1|1,0,0]=4 17378 B13R1.511 C=C(C)CSc1cnc(c(c1)Br)N 62a_100012353989_100000211660 [0,2,0,0,0,1|1,0,0]=4 17379 B13R1.511 C=C(C)CSc1cnc(c(c1)C)Br 62a_100000748629_100009816107 [0,2,0,0,0,1|1,0,0]=4 17380 B13R1.511 C=C(C)CSc1cnc(c(c1)C)Br 62a_100009816107_100000211660 [0,2,0,0,0,1|1,0,0]=4 17381 B13R1.511 C=C(C)CSc1cnc(c(c1)C)C 62a_100000697892_100000211660 [0,2,0,0,0,1|1,0,0]=4 17382 B13R1.511 C=C(C)CSc1cnc(c(c1)C)C 62a_100000748629_100000697892 [0,2,0,0,0,1|1,0,0]=4 17383 B13R1.511 C=C(C)CSc1cnc(c(c1)C)Cl 62a_100000748629_100009922867 [0,2,0,0,0,1|1,0,0]=4 17384 B13R1.511 C=C(C)CSc1cnc(c(c1)C)Cl 62a_100009922867_100000211660 [0,2,0,0,0,1|1,0,0]=4 17385 B13R1.511 C=C(C)CSc1cnc(c(c1)C)F 62a_100000709442_100000211660 [0,2,0,0,0,1|1,0,0]=4 17386 B13R1.511 C=C(C)CSc1cnc(c(c1)C)F 62a_100000748629_100000709442 [0,2,0,0,0,1|1,0,0]=4 17387 B13R1.511 C=C(C)CSc1cnc(c(c1)C)N 62a_100000684428_100000211660 [0,2,0,0,0,1|1,0,0]=4 17388 B13R1.511 C=C(C)CSc1cnc(c(c1)C)N 62a_100000748629_100000684428 [0,2,0,0,0,1|1,0,0]=4 17389 B13R1.511 C=C(C)CSc1cnc(c(c1)C)O 62a_100000685391_100000211660 [0,2,0,0,0,1|1,0,0]=4 17390 B13R1.511 C=C(C)CSc1cnc(c(c1)C)O 62a_100000748629_100000685391 [0,2,0,0,0,1|1,0,0]=4 17391 B13R1.511 C=C(C)CSc1cnc(c(c1)Cl)N 62a_100000748629_100012356299 [0,2,0,0,0,1|1,0,0]=4 17392 B13R1.511 C=C(C)CSc1cnc(c(c1)Cl)N 62a_100012356299_100000211660 [0,2,0,0,0,1|1,0,0]=4 17393 B13R1.511 C=C(C)CSc1cnc(c(c1)Cl)O 62a_100000748629_100010238531 [0,2,0,0,0,1|1,0,0]=4 17394 B13R1.511 C=C(C)CSc1cnc(c(c1)Cl)O 62a_100010238531_100000211660 [0,2,0,0,0,1|1,0,0]=4 17395 B13R1.511 C=C(C)CSc1cnc(c(c1)F)C 62a_100000748629_100009845756 [0,2,0,0,0,1|1,0,0]=4 17396 B13R1.511 C=C(C)CSc1cnc(c(c1)F)C 62a_100009845756_100000211660 [0,2,0,0,0,1|1,0,0]=4 17397 B13R1.511 C=C(C)CSc1cnc(c(c1)F)F 62a_100000748629_100009817721 [0,2,0,0,0,1|1,0,0]=4 17398 B13R1.511 C=C(C)CSc1cnc(c(c1)F)F 62a_100009817721_100000211660 [0,2,0,0,0,1|1,0,0]=4 17399 B13R1.511 C=C(C)CSc1cnc(c(c1)F)N 62a_100000693161_100000211660 [0,2,0,0,0,1|1,0,0]=4 17400 B13R1.511 C=C(C)CSc1cnc(c(c1)F)N 62a_100000748629_100000693161 [0,2,0,0,0,1|1,0,0]=4 17401 B13R1.511 C=C(C)CSc1cnc(c(c1)N)C 62a_100000748629_100011999542 [0,2,0,0,0,1|1,0,0]=4 17402 B13R1.511 C=C(C)CSc1cnc(c(c1)N)C 62a_100011999542_100000211660 [0,2,0,0,0,1|1,0,0]=4 17403 B13R1.511 C=C(C)CSc1cnc(c(c1)N)Cl 62a_100000748629_100009828400 [0,2,0,0,0,1|1,0,0]=4 17404 B13R1.511 C=C(C)CSc1cnc(c(c1)N)Cl 62a_100009828400_100000211660 [0,2,0,0,0,1|1,0,0]=4 17405 B13R1.511 C=C(C)CSc1cnc(c(c1)N)F 62a_100000748629_100009816798 [0,2,0,0,0,1|1,0,0]=4 17406 B13R1.511 C=C(C)CSc1cnc(c(c1)N)F 62a_100009816798_100000211660 [0,2,0,0,0,1|1,0,0]=4 17407 B13R1.511 C=C(C)CSc1cnc(c(c1)N)N 62a_100000184470_100000211660 [0,2,0,0,0,1|1,0,0]=4 17408 B13R1.511 C=C(C)CSc1cnc(c(c1)N)N 62a_100000748629_100000184470 [0,2,0,0,0,1|1,0,0]=4 17409 B13R1.511 C=C(C)CSc1cnc(c(c1)N)O 62a_100000743729_100000211660 [0,2,0,0,0,1|1,0,0]=4 17410 B13R1.511 C=C(C)CSc1cnc(c(c1)N)O 62a_100000748629_100000743729 [0,2,0,0,0,1|1,0,0]=4 17411 B13R1.511 C=C(C)CSc1cnc(c(c1)O)C 62a_100000748629_100009864810 [0,2,0,0,0,1|1,0,0]=4 17412 B13R1.511 C=C(C)CSc1cnc(c(c1)O)C 62a_100009864810_100000211660 [0,2,0,0,0,1|1,0,0]=4 17413 B13R1.511 C=C(C)CSc1cnc(c(c1)O)F 62a_100000748629_100009819871 [0,2,0,0,0,1|1,0,0]=4 17414 B13R1.511 C=C(C)CSc1cnc(c(c1)O)F 62a_100009819871_100000211660 [0,2,0,0,0,1|1,0,0]=4 17415 B13R1.511 C=C(C)CSc1cnc(c(c1)O)N 62a_100000748629_100009819042 [0,2,0,0,0,1|1,0,0]=4 17416 B13R1.511 C=C(C)CSc1cnc(c(c1)O)N 62a_100009819042_100000211660 [0,2,0,0,0,1|1,0,0]=4 17417 B13R1.511 C=C(F)CNc1ccc(c(c1)Br)Br 2230a_100011306057_100009893438 [0,2,0,0,0,1|1,0,0]=4 17418 B13R1.511 C=C(F)CNc1ccc(c(c1)Br)Br 34a_100011306057_100009893438 [0,2,0,0,0,1|1,0,0]=4 17419 B13R1.511 C=C(F)CNc1ccc(c(c1)Br)Br 7a_100011306057_100000042424 [0,2,0,0,0,1|1,0,0]=4 17420 B13R1.511 C=C(F)CNc1ccc(c(c1)Br)C 2230a_100000736455_100009893438 [0,2,0,0,0,1|1,0,0]=4 17421 B13R1.511 C=C(F)CNc1ccc(c(c1)Br)C 34a_100000736455_100009893438 [0,2,0,0,0,1|1,0,0]=4 17422 B13R1.511 C=C(F)CNc1ccc(c(c1)Br)C 7a_100000736455_100000042424 [0,2,0,0,0,1|1,0,0]=4 17423 B13R1.511 C=C(F)CNc1ccc(c(c1)Br)Cl 2230a_100000686031_100009893438 [0,2,0,0,0,1|1,0,0]=4 17424 B13R1.511 C=C(F)CNc1ccc(c(c1)Br)Cl 34a_100000686031_100009893438 [0,2,0,0,0,1|1,0,0]=4 17425 B13R1.511 C=C(F)CNc1ccc(c(c1)Br)F 2230a_100000760356_100009893438 [0,2,0,0,0,1|1,0,0]=4 17426 B13R1.511 C=C(F)CNc1ccc(c(c1)Br)F 34a_100000760356_100009893438 [0,2,0,0,0,1|1,0,0]=4 17427 B13R1.511 C=C(F)CNc1ccc(c(c1)Br)F 7a_100000760356_100000042424 [0,2,0,0,0,1|1,0,0]=4 17428 B13R1.511 C=C(F)CNc1ccc(c(c1)Br)I 34a_100000750458_100009893438 [0,2,0,0,0,1|1,0,0]=4 17429 B13R1.511 C=C(F)CNc1ccc(c(c1)Br)O 34a_100011534360_100009893438 [0,2,0,0,0,1|1,0,0]=4 17430 B13R1.511 C=C(F)CNc1ccc(c(c1)C)Br 2230a_100000210723_100009893438 [0,2,0,0,0,1|1,0,0]=4 17431 B13R1.511 C=C(F)CNc1ccc(c(c1)C)Br 34a_100000210723_100009893438 [0,2,0,0,0,1|1,0,0]=4 17432 B13R1.511 C=C(F)CNc1ccc(c(c1)C)Br 7a_100000210723_100000042424 [0,2,0,0,0,1|1,0,0]=4 17433 B13R1.511 C=C(F)CNc1ccc(c(c1)C)C 2230a_100000724040_100009893438 [0,2,0,0,0,1|1,0,0]=4 17434 B13R1.511 C=C(F)CNc1ccc(c(c1)C)C 34a_100000724040_100009893438 [0,2,0,0,0,1|1,0,0]=4 17435 B13R1.511 C=C(F)CNc1ccc(c(c1)C)C 7a_100000724040_100000042424 [0,2,0,0,0,1|1,0,0]=4 17436 B13R1.511 C=C(F)CNc1ccc(c(c1)C)Cl 2230a_100000187808_100009893438 [0,2,0,0,0,1|1,0,0]=4 17437 B13R1.511 C=C(F)CNc1ccc(c(c1)C)Cl 34a_100000187808_100009893438 [0,2,0,0,0,1|1,0,0]=4 17438 B13R1.511 C=C(F)CNc1ccc(c(c1)C)Cl 7a_100000187808_100000042424 [0,2,0,0,0,1|1,0,0]=4 17439 B13R1.511 C=C(F)CNc1ccc(c(c1)C)F 2230a_100000750164_100009893438 [0,2,0,0,0,1|1,0,0]=4 17440 B13R1.511 C=C(F)CNc1ccc(c(c1)C)F 34a_100000750164_100009893438 [0,2,0,0,0,1|1,0,0]=4 17441 B13R1.511 C=C(F)CNc1ccc(c(c1)C)F 7a_100000750164_100000042424 [0,2,0,0,0,1|1,0,0]=4 17442 B13R1.511 C=C(F)CNc1ccc(c(c1)C)I 34a_100000198070_100009893438 [0,2,0,0,0,1|1,0,0]=4 17443 B13R1.511 C=C(F)CNc1ccc(c(c1)C)I 7a_100000198070_100000042424 [0,2,0,0,0,1|1,0,0]=4 17444 B13R1.511 C=C(F)CNc1ccc(c(c1)C)O 34a_100011218179_100009893438 [0,2,0,0,0,1|1,0,0]=4 17445 B13R1.511 C=C(F)CNc1ccc(c(c1)C)O 7a_100011218179_100000042424 [0,2,0,0,0,1|1,0,0]=4 17446 B13R1.511 C=C(F)CNc1ccc(c(c1)Cl)Br 2230a_100000687081_100009893438 [0,2,0,0,0,1|1,0,0]=4 17447 B13R1.511 C=C(F)CNc1ccc(c(c1)Cl)Br 34a_100000687081_100009893438 [0,2,0,0,0,1|1,0,0]=4 17448 B13R1.511 C=C(F)CNc1ccc(c(c1)Cl)Br 7a_100000687081_100000042424 [0,2,0,0,0,1|1,0,0]=4 17449 B13R1.511 C=C(F)CNc1ccc(c(c1)Cl)C 2230a_100000188892_100009893438 [0,2,0,0,0,1|1,0,0]=4 17450 B13R1.511 C=C(F)CNc1ccc(c(c1)Cl)C 34a_100000188892_100009893438 [0,2,0,0,0,1|1,0,0]=4 17451 B13R1.511 C=C(F)CNc1ccc(c(c1)Cl)C 7a_100000188892_100000042424 [0,2,0,0,0,1|1,0,0]=4 17452 B13R1.511 C=C(F)CNc1ccc(c(c1)Cl)Cl 2230a_100000184108_100009893438 [0,2,0,0,0,1|1,0,0]=4 17453 B13R1.511 C=C(F)CNc1ccc(c(c1)Cl)Cl 34a_100000184108_100009893438 [0,2,0,0,0,1|1,0,0]=4 17454 B13R1.511 C=C(F)CNc1ccc(c(c1)Cl)F 2230a_100000211060_100009893438 [0,2,0,0,0,1|1,0,0]=4 17455 B13R1.511 C=C(F)CNc1ccc(c(c1)Cl)F 34a_100000211060_100009893438 [0,2,0,0,0,1|1,0,0]=4 17456 B13R1.511 C=C(F)CNc1ccc(c(c1)Cl)F 7a_100000211060_100000042424 [0,2,0,0,0,1|1,0,0]=4 17457 B13R1.511 C=C(F)CNc1ccc(c(c1)Cl)I 34a_100000761885_100009893438 [0,2,0,0,0,1|1,0,0]=4 17458 B13R1.511 C=C(F)CNc1ccc(c(c1)Cl)O 34a_100000744943_100009893438 [0,2,0,0,0,1|1,0,0]=4 17459 B13R1.511 C=C(F)CNc1ccc(c(c1)F)Br 2230a_100000759894_100009893438 [0,2,0,0,0,1|1,0,0]=4 17460 B13R1.511 C=C(F)CNc1ccc(c(c1)F)Br 34a_100000759894_100009893438 [0,2,0,0,0,1|1,0,0]=4 17461 B13R1.511 C=C(F)CNc1ccc(c(c1)F)Br 7a_100000759894_100000042424 [0,2,0,0,0,1|1,0,0]=4 17462 B13R1.511 C=C(F)CNc1ccc(c(c1)F)C 2230a_100000210958_100009893438 [0,2,0,0,0,1|1,0,0]=4 17463 B13R1.511 C=C(F)CNc1ccc(c(c1)F)C 34a_100000210958_100009893438 [0,2,0,0,0,1|1,0,0]=4 17464 B13R1.511 C=C(F)CNc1ccc(c(c1)F)C 7a_100000210958_100000042424 [0,2,0,0,0,1|1,0,0]=4 17465 B13R1.511 C=C(F)CNc1ccc(c(c1)F)Cl 2230a_100000739366_100009893438 [0,2,0,0,0,1|1,0,0]=4 17466 B13R1.511 C=C(F)CNc1ccc(c(c1)F)Cl 34a_100000739366_100009893438 [0,2,0,0,0,1|1,0,0]=4 17467 B13R1.511 C=C(F)CNc1ccc(c(c1)F)Cl 7a_100000739366_100000042424 [0,2,0,0,0,1|1,0,0]=4 17468 B13R1.511 C=C(F)CNc1ccc(c(c1)F)F 2230a_100000210724_100009893438 [0,2,0,0,0,1|1,0,0]=4 17469 B13R1.511 C=C(F)CNc1ccc(c(c1)F)F 34a_100000210724_100009893438 [0,2,0,0,0,1|1,0,0]=4 17470 B13R1.511 C=C(F)CNc1ccc(c(c1)F)F 7a_100000210724_100000042424 [0,2,0,0,0,1|1,0,0]=4 17471 B13R1.511 C=C(F)CNc1ccc(c(c1)F)I 34a_100011356925_100009893438 [0,2,0,0,0,1|1,0,0]=4 17472 B13R1.511 C=C(F)CNc1ccc(c(c1)F)I 7a_100011356925_100000042424 [0,2,0,0,0,1|1,0,0]=4 17473 B13R1.511 C=C(F)CNc1ccc(c(c1)F)O 34a_100011220035_100009893438 [0,2,0,0,0,1|1,0,0]=4 17474 B13R1.511 C=C(F)CNc1ccc(c(c1)F)O 7a_100011220035_100000042424 [0,2,0,0,0,1|1,0,0]=4 17475 B13R1.511 C=C(F)CNc1ccc(c(c1)I)Br 34a_100000750459_100009893438 [0,2,0,0,0,1|1,0,0]=4 17476 B13R1.511 C=C(F)CNc1ccc(c(c1)I)C 34a_100000184131_100009893438 [0,2,0,0,0,1|1,0,0]=4 17477 B13R1.511 C=C(F)CNc1ccc(c(c1)I)C 7a_100000184131_100000042424 [0,2,0,0,0,1|1,0,0]=4 17478 B13R1.511 C=C(F)CNc1ccc(c(c1)I)Cl 34a_100012360549_100009893438 [0,2,0,0,0,1|1,0,0]=4 17479 B13R1.511 C=C(F)CNc1ccc(c(c1)I)F 34a_114828291077_100009893438 [0,2,0,0,0,1|1,0,0]=4 17480 B13R1.511 C=C(F)CNc1ccc(c(c1)I)F 7a_114828291077_100000042424 [0,2,0,0,0,1|1,0,0]=4 17481 B13R1.511 C=C(F)CNc1ccc(c(c1)O)C 34a_100000759471_100009893438 [0,2,0,0,0,1|1,0,0]=4 17482 B13R1.511 C=C(F)CNc1ccc(c(c1)O)C 7a_100000759471_100000042424 [0,2,0,0,0,1|1,0,0]=4 17483 B13R1.511 C=C(F)CNc1ccc(c(c1)O)Cl 34a_100011934209_100009893438 [0,2,0,0,0,1|1,0,0]=4 17484 B13R1.511 C=C(F)CNc1ccc(c(c1)O)F 34a_100012017398_100009893438 [0,2,0,0,0,1|1,0,0]=4 17485 B13R1.511 C=C(F)CNc1ccc(c(c1)O)F 7a_100012017398_100000042424 [0,2,0,0,0,1|1,0,0]=4 17486 B13R1.511 C=C(F)CNc1ccc(c(c1)O)O 34a_100102946323_100009893438 [0,2,0,0,0,1|1,0,0]=4 17487 B13R1.511 C=C(F)COc1ccc(c(c1)Br)C 34a_100011380479_100009893438 [0,2,0,0,0,1|1,0,0]=4 17488 B13R1.511 C=C(F)COc1ccc(c(c1)Br)C 7a_100011380479_100000042424 [0,2,0,0,0,1|1,0,0]=4 17489 B13R1.511 C=C(F)COc1ccc(c(c1)Br)Cl 34a_100011933957_100009893438 [0,2,0,0,0,1|1,0,0]=4 17490 B13R1.511 C=C(F)COc1ccc(c(c1)Br)Cl 7a_100011933957_100000042424 [0,2,0,0,0,1|1,0,0]=4 17491 B13R1.511 C=C(F)COc1ccc(c(c1)Br)F 34a_100000693481_100009893438 [0,2,0,0,0,1|1,0,0]=4 17492 B13R1.511 C=C(F)COc1ccc(c(c1)Br)F 7a_100000693481_100000042424 [0,2,0,0,0,1|1,0,0]=4 17493 B13R1.511 C=C(F)COc1ccc(c(c1)Br)I 34a_100000701344_100009893438 [0,2,0,0,0,1|1,0,0]=4 17494 B13R1.511 C=C(F)COc1ccc(c(c1)Br)I 7a_100000701344_100000042424 [0,2,0,0,0,1|1,0,0]=4 17495 B13R1.511 C=C(F)COc1ccc(c(c1)Br)N 34a_100012001276_100009893438 [0,2,0,0,0,1|1,0,0]=4 17496 B13R1.511 C=C(F)COc1ccc(c(c1)Br)N 7a_100012001276_100000042424 [0,2,0,0,0,1|1,0,0]=4 17497 B13R1.511 C=C(F)COc1ccc(c(c1)C)Br 34a_100000690111_100009893438 [0,2,0,0,0,1|1,0,0]=4 17498 B13R1.511 C=C(F)COc1ccc(c(c1)C)Br 7a_100000690111_100000042424 [0,2,0,0,0,1|1,0,0]=4 17499 B13R1.511 C=C(F)COc1ccc(c(c1)C)C 34a_100000210932_100009893438 [0,2,0,0,0,1|1,0,0]=4 17500 B13R1.511 C=C(F)COc1ccc(c(c1)C)C 7a_100000210932_100000042424 [0,2,0,0,0,1|1,0,0]=4 17501 B13R1.511 C=C(F)COc1ccc(c(c1)C)Cl 34a_100000211092_100009893438 [0,2,0,0,0,1|1,0,0]=4 17502 B13R1.511 C=C(F)COc1ccc(c(c1)C)Cl 7a_100000211092_100000042424 [0,2,0,0,0,1|1,0,0]=4 17503 B13R1.511 C=C(F)COc1ccc(c(c1)C)F 34a_100000751312_100009893438 [0,2,0,0,0,1|1,0,0]=4 17504 B13R1.511 C=C(F)COc1ccc(c(c1)C)F 7a_100000751312_100000042424 [0,2,0,0,0,1|1,0,0]=4 17505 B13R1.511 C=C(F)COc1ccc(c(c1)C)I 34a_100000729255_100009893438 [0,2,0,0,0,1|1,0,0]=4 17506 B13R1.511 C=C(F)COc1ccc(c(c1)C)I 7a_100000729255_100000042424 [0,2,0,0,0,1|1,0,0]=4 17507 B13R1.511 C=C(F)COc1ccc(c(c1)C)N 34a_100000756630_100009893438 [0,2,0,0,0,1|1,0,0]=4 17508 B13R1.511 C=C(F)COc1ccc(c(c1)C)N 7a_100000756630_100000042424 [0,2,0,0,0,1|1,0,0]=4 17509 B13R1.511 C=C(F)COc1ccc(c(c1)Cl)Br 34a_100011215161_100009893438 [0,2,0,0,0,1|1,0,0]=4 17510 B13R1.511 C=C(F)COc1ccc(c(c1)Cl)Br 7a_100011215161_100000042424 [0,2,0,0,0,1|1,0,0]=4 17511 B13R1.511 C=C(F)COc1ccc(c(c1)Cl)C 34a_100011265682_100009893438 [0,2,0,0,0,1|1,0,0]=4 17512 B13R1.511 C=C(F)COc1ccc(c(c1)Cl)C 7a_100011265682_100000042424 [0,2,0,0,0,1|1,0,0]=4 17513 B13R1.511 C=C(F)COc1ccc(c(c1)Cl)Cl 34a_100000211054_100009893438 [0,2,0,0,0,1|1,0,0]=4 17514 B13R1.511 C=C(F)COc1ccc(c(c1)Cl)Cl 7a_100000211054_100000042424 [0,2,0,0,0,1|1,0,0]=4 17515 B13R1.511 C=C(F)COc1ccc(c(c1)Cl)F 34a_100000211030_100009893438 [0,2,0,0,0,1|1,0,0]=4 17516 B13R1.511 C=C(F)COc1ccc(c(c1)Cl)F 7a_100000211030_100000042424 [0,2,0,0,0,1|1,0,0]=4 17517 B13R1.511 C=C(F)COc1ccc(c(c1)Cl)I 34a_100000047559_100009893438 [0,2,0,0,0,1|1,0,0]=4 17518 B13R1.511 C=C(F)COc1ccc(c(c1)Cl)I 7a_100000047559_100000042424 [0,2,0,0,0,1|1,0,0]=4 17519 B13R1.511 C=C(F)COc1ccc(c(c1)Cl)N 34a_100011215599_100009893438 [0,2,0,0,0,1|1,0,0]=4 17520 B13R1.511 C=C(F)COc1ccc(c(c1)Cl)N 7a_100011215599_100000042424 [0,2,0,0,0,1|1,0,0]=4 17521 B13R1.511 C=C(F)COc1ccc(c(c1)F)Br 34a_100000755031_100009893438 [0,2,0,0,0,1|1,0,0]=4 17522 B13R1.511 C=C(F)COc1ccc(c(c1)F)Br 7a_100000755031_100000042424 [0,2,0,0,0,1|1,0,0]=4 17523 B13R1.511 C=C(F)COc1ccc(c(c1)F)C 34a_100000722560_100009893438 [0,2,0,0,0,1|1,0,0]=4 17524 B13R1.511 C=C(F)COc1ccc(c(c1)F)C 7a_100000722560_100000042424 [0,2,0,0,0,1|1,0,0]=4 17525 B13R1.511 C=C(F)COc1ccc(c(c1)F)Cl 34a_100000691581_100009893438 [0,2,0,0,0,1|1,0,0]=4 17526 B13R1.511 C=C(F)COc1ccc(c(c1)F)Cl 7a_100000691581_100000042424 [0,2,0,0,0,1|1,0,0]=4 17527 B13R1.511 C=C(F)COc1ccc(c(c1)F)F 34a_100000181275_100009893438 [0,2,0,0,0,1|1,0,0]=4 17528 B13R1.511 C=C(F)COc1ccc(c(c1)F)F 7a_100000181275_100000042424 [0,2,0,0,0,1|1,0,0]=4 17529 B13R1.511 C=C(F)COc1ccc(c(c1)F)I 34a_100009990212_100009893438 [0,2,0,0,0,1|1,0,0]=4 17530 B13R1.511 C=C(F)COc1ccc(c(c1)F)I 7a_100009990212_100000042424 [0,2,0,0,0,1|1,0,0]=4 17531 B13R1.511 C=C(F)COc1ccc(c(c1)F)N 34a_100000759473_100009893438 [0,2,0,0,0,1|1,0,0]=4 17532 B13R1.511 C=C(F)COc1ccc(c(c1)F)N 7a_100000759473_100000042424 [0,2,0,0,0,1|1,0,0]=4 17533 B13R1.511 C=C(F)COc1ccc(c(c1)I)Br 34a_100012339312_100009893438 [0,2,0,0,0,1|1,0,0]=4 17534 B13R1.511 C=C(F)COc1ccc(c(c1)I)Br 7a_100012339312_100000042424 [0,2,0,0,0,1|1,0,0]=4 17535 B13R1.511 C=C(F)COc1ccc(c(c1)I)Cl 34a_100000049588_100009893438 [0,2,0,0,0,1|1,0,0]=4 17536 B13R1.511 C=C(F)COc1ccc(c(c1)I)Cl 7a_100000049588_100000042424 [0,2,0,0,0,1|1,0,0]=4 17537 B13R1.511 C=C(F)COc1ccc(c(c1)I)N 34a_100010084370_100009893438 [0,2,0,0,0,1|1,0,0]=4 17538 B13R1.511 C=C(F)COc1ccc(c(c1)I)N 7a_100010084370_100000042424 [0,2,0,0,0,1|1,0,0]=4 17539 B13R1.511 C=C(F)COc1ccc(c(c1)N)Br 34a_100011999798_100009893438 [0,2,0,0,0,1|1,0,0]=4 17540 B13R1.511 C=C(F)COc1ccc(c(c1)N)Br 7a_100011999798_100000042424 [0,2,0,0,0,1|1,0,0]=4 17541 B13R1.511 C=C(F)COc1ccc(c(c1)N)C 34a_100011216113_100009893438 [0,2,0,0,0,1|1,0,0]=4 17542 B13R1.511 C=C(F)COc1ccc(c(c1)N)C 7a_100011216113_100000042424 [0,2,0,0,0,1|1,0,0]=4 17543 B13R1.511 C=C(F)COc1ccc(c(c1)N)Cl 34a_100011934297_100009893438 [0,2,0,0,0,1|1,0,0]=4 17544 B13R1.511 C=C(F)COc1ccc(c(c1)N)F 34a_100012017239_100009893438 [0,2,0,0,0,1|1,0,0]=4 17545 B13R1.511 C=C(F)COc1ccc(c(c1)N)F 7a_100012017239_100000042424 [0,2,0,0,0,1|1,0,0]=4 17546 B13R1.511 C=C(F)COc1ccc(c(c1)N)N 34a_100025771000_100009893438 [0,2,0,0,0,1|1,0,0]=4 17547 B13R1.511 C=C(F)CSc1ccc(c(c1)Br)Br 62a_100000042424_100012356285 [0,2,0,0,0,1|1,0,0]=4 17548 B13R1.511 C=C(F)CSc1ccc(c(c1)Br)Br 62a_100012356285_100000042424 [0,2,0,0,0,1|1,0,0]=4 17549 B13R1.511 C=C(F)CSc1ccc(c(c1)Br)C 62a_100000042424_100011847877 [0,2,0,0,0,1|1,0,0]=4 17550 B13R1.511 C=C(F)CSc1ccc(c(c1)Br)C 62a_100011847877_100000042424 [0,2,0,0,0,1|1,0,0]=4 17551 B13R1.511 C=C(F)CSc1ccc(c(c1)Br)Cl 62a_100000042424_100012353702 [0,2,0,0,0,1|1,0,0]=4 17552 B13R1.511 C=C(F)CSc1ccc(c(c1)Br)Cl 62a_100012353702_100000042424 [0,2,0,0,0,1|1,0,0]=4 17553 B13R1.511 C=C(F)CSc1ccc(c(c1)Br)F 62a_100000042424_100012047266 [0,2,0,0,0,1|1,0,0]=4 17554 B13R1.511 C=C(F)CSc1ccc(c(c1)Br)F 62a_100012047266_100000042424 [0,2,0,0,0,1|1,0,0]=4 17555 B13R1.511 C=C(F)CSc1ccc(c(c1)Br)N 62a_100000042424_100000750455 [0,2,0,0,0,1|1,0,0]=4 17556 B13R1.511 C=C(F)CSc1ccc(c(c1)Br)N 62a_100000750455_100000042424 [0,2,0,0,0,1|1,0,0]=4 17557 B13R1.511 C=C(F)CSc1ccc(c(c1)Br)O 62a_100000042424_100012361655 [0,2,0,0,0,1|1,0,0]=4 17558 B13R1.511 C=C(F)CSc1ccc(c(c1)Br)O 62a_100012361655_100000042424 [0,2,0,0,0,1|1,0,0]=4 17559 B13R1.511 C=C(F)CSc1ccc(c(c1)C)Br 62a_100000042424_100009813585 [0,2,0,0,0,1|1,0,0]=4 17560 B13R1.511 C=C(F)CSc1ccc(c(c1)C)Br 62a_100009813585_100000042424 [0,2,0,0,0,1|1,0,0]=4 17561 B13R1.511 C=C(F)CSc1ccc(c(c1)C)C 62a_100000042424_100011215607 [0,2,0,0,0,1|1,0,0]=4 17562 B13R1.511 C=C(F)CSc1ccc(c(c1)C)C 62a_100011215607_100000042424 [0,2,0,0,0,1|1,0,0]=4 17563 B13R1.511 C=C(F)CSc1ccc(c(c1)C)Cl 62a_100000042424_100000049509 [0,2,0,0,0,1|1,0,0]=4 17564 B13R1.511 C=C(F)CSc1ccc(c(c1)C)Cl 62a_100000049509_100000042424 [0,2,0,0,0,1|1,0,0]=4 17565 B13R1.511 C=C(F)CSc1ccc(c(c1)C)F 62a_100000042424_100011218330 [0,2,0,0,0,1|1,0,0]=4 17566 B13R1.511 C=C(F)CSc1ccc(c(c1)C)F 62a_100011218330_100000042424 [0,2,0,0,0,1|1,0,0]=4 17567 B13R1.511 C=C(F)CSc1ccc(c(c1)C)N 62a_100000042424_100000211769 [0,2,0,0,0,1|1,0,0]=4 17568 B13R1.511 C=C(F)CSc1ccc(c(c1)C)N 62a_100000211769_100000042424 [0,2,0,0,0,1|1,0,0]=4 17569 B13R1.511 C=C(F)CSc1ccc(c(c1)C)O 62a_100000042424_100000186361 [0,2,0,0,0,1|1,0,0]=4 17570 B13R1.511 C=C(F)CSc1ccc(c(c1)Cl)Br 62a_100000042424_100012047281 [0,2,0,0,0,1|1,0,0]=4 17571 B13R1.511 C=C(F)CSc1ccc(c(c1)Cl)Br 62a_100012047281_100000042424 [0,2,0,0,0,1|1,0,0]=4 17572 B13R1.511 C=C(F)CSc1ccc(c(c1)Cl)C 62a_100000042424_100011216363 [0,2,0,0,0,1|1,0,0]=4 17573 B13R1.511 C=C(F)CSc1ccc(c(c1)Cl)C 62a_100011216363_100000042424 [0,2,0,0,0,1|1,0,0]=4 17574 B13R1.511 C=C(F)CSc1ccc(c(c1)Cl)Cl 62a_100000042424_100011214914 [0,2,0,0,0,1|1,0,0]=4 17575 B13R1.511 C=C(F)CSc1ccc(c(c1)Cl)Cl 62a_100011214914_100000042424 [0,2,0,0,0,1|1,0,0]=4 17576 B13R1.511 C=C(F)CSc1ccc(c(c1)Cl)F 62a_100000042424_100011215976 [0,2,0,0,0,1|1,0,0]=4 17577 B13R1.511 C=C(F)CSc1ccc(c(c1)Cl)F 62a_100011215976_100000042424 [0,2,0,0,0,1|1,0,0]=4 17578 B13R1.511 C=C(F)CSc1ccc(c(c1)Cl)N 62a_100000042424_100011218065 [0,2,0,0,0,1|1,0,0]=4 17579 B13R1.511 C=C(F)CSc1ccc(c(c1)Cl)N 62a_100011218065_100000042424 [0,2,0,0,0,1|1,0,0]=4 17580 B13R1.511 C=C(F)CSc1ccc(c(c1)Cl)O 62a_100000042424_100012360047 [0,2,0,0,0,1|1,0,0]=4 17581 B13R1.511 C=C(F)CSc1ccc(c(c1)Cl)O 62a_100012360047_100000042424 [0,2,0,0,0,1|1,0,0]=4 17582 B13R1.511 C=C(F)CSc1ccc(c(c1)F)Br 62a_100000042424_100000685389 [0,2,0,0,0,1|1,0,0]=4 17583 B13R1.511 C=C(F)CSc1ccc(c(c1)F)Br 62a_100000685389_100000042424 [0,2,0,0,0,1|1,0,0]=4 17584 B13R1.511 C=C(F)CSc1ccc(c(c1)F)C 62a_100000042424_100000720648 [0,2,0,0,0,1|1,0,0]=4 17585 B13R1.511 C=C(F)CSc1ccc(c(c1)F)C 62a_100000720648_100000042424 [0,2,0,0,0,1|1,0,0]=4 17586 B13R1.511 C=C(F)CSc1ccc(c(c1)F)Cl 62a_100000042424_100011216805 [0,2,0,0,0,1|1,0,0]=4 17587 B13R1.511 C=C(F)CSc1ccc(c(c1)F)Cl 62a_100011216805_100000042424 [0,2,0,0,0,1|1,0,0]=4 17588 B13R1.511 C=C(F)CSc1ccc(c(c1)F)F 62a_100000042424_100000703953 [0,2,0,0,0,1|1,0,0]=4 17589 B13R1.511 C=C(F)CSc1ccc(c(c1)F)F 62a_100000703953_100000042424 [0,2,0,0,0,1|1,0,0]=4 17590 B13R1.511 C=C(F)CSc1ccc(c(c1)F)N 62a_100000042424_100011215594 [0,2,0,0,0,1|1,0,0]=4 17591 B13R1.511 C=C(F)CSc1ccc(c(c1)F)N 62a_100011215594_100000042424 [0,2,0,0,0,1|1,0,0]=4 17592 B13R1.511 C=C(F)CSc1ccc(c(c1)F)O 62a_100000042424_100000185481 [0,2,0,0,0,1|1,0,0]=4 17593 B13R1.511 C=C(F)CSc1ccc(c(c1)F)O 62a_100000185481_100000042424 [0,2,0,0,0,1|1,0,0]=4 17594 B13R1.511 C=C(F)CSc1ccc(c(c1)N)Br 62a_100000042424_100000750456 [0,2,0,0,0,1|1,0,0]=4 17595 B13R1.511 C=C(F)CSc1ccc(c(c1)N)Br 62a_100000750456_100000042424 [0,2,0,0,0,1|1,0,0]=4 17596 B13R1.511 C=C(F)CSc1ccc(c(c1)N)C 62a_100000042424_100000761890 [0,2,0,0,0,1|1,0,0]=4 17597 B13R1.511 C=C(F)CSc1ccc(c(c1)N)C 62a_100000761890_100000042424 [0,2,0,0,0,1|1,0,0]=4 17598 B13R1.511 C=C(F)CSc1ccc(c(c1)N)Cl 62a_100000042424_200000761891 [0,2,0,0,0,1|1,0,0]=4 17599 B13R1.511 C=C(F)CSc1ccc(c(c1)N)Cl 62a_200000761891_100000042424 [0,2,0,0,0,1|1,0,0]=4 17600 B13R1.511 C=C(F)CSc1ccc(c(c1)N)F 62a_100000042424_100000740924 [0,2,0,0,0,1|1,0,0]=4 17601 B13R1.511 C=C(F)CSc1ccc(c(c1)N)F 62a_100000740924_100000042424 [0,2,0,0,0,1|1,0,0]=4 17602 B13R1.511 C=C(F)CSc1ccc(c(c1)N)N 62a_100000042424_100011534411 [0,2,0,0,0,1|1,0,0]=4 17603 B13R1.511 C=C(F)CSc1ccc(c(c1)N)N 62a_100000741789_100000042424 [0,2,0,0,0,1|1,0,0]=4 17604 B13R1.511 C=C(F)CSc1ccc(c(c1)N)O 62a_100000042424_100000752626 [0,2,0,0,0,1|1,0,0]=4 17605 B13R1.511 C=C(F)CSc1ccc(c(c1)N)O 62a_100000752626_100000042424 [0,2,0,0,0,1|1,0,0]=4 17606 B13R1.511 C=C(F)CSc1ccc(c(c1)O)Br 62a_100000042424_100012356990 [0,2,0,0,0,1|1,0,0]=4 17607 B13R1.511 C=C(F)CSc1ccc(c(c1)O)Br 62a_100012356990_100000042424 [0,2,0,0,0,1|1,0,0]=4 17608 B13R1.511 C=C(F)CSc1ccc(c(c1)O)C 62a_100000042424_100000685420 [0,2,0,0,0,1|1,0,0]=4 17609 B13R1.511 C=C(F)CSc1ccc(c(c1)O)C 62a_100000685420_100000042424 [0,2,0,0,0,1|1,0,0]=4 17610 B13R1.511 C=C(F)CSc1ccc(c(c1)O)Cl 62a_100000042424_100011356854 [0,2,0,0,0,1|1,0,0]=4 17611 B13R1.511 C=C(F)CSc1ccc(c(c1)O)Cl 62a_100011356854_100000042424 [0,2,0,0,0,1|1,0,0]=4 17612 B13R1.511 C=C(F)CSc1ccc(c(c1)O)F 62a_100000042424_100000686035 [0,2,0,0,0,1|1,0,0]=4 17613 B13R1.511 C=C(F)CSc1ccc(c(c1)O)F 62a_100000686035_100000042424 [0,2,0,0,0,1|1,0,0]=4 17614 B13R1.511 C=C(F)CSc1ccc(c(c1)O)N 62a_100000042424_100000739049 [0,2,0,0,0,1|1,0,0]=4 17615 B13R1.511 C=C(F)CSc1ccc(c(c1)O)N 62a_100000739049_100000042424 [0,2,0,0,0,1|1,0,0]=4 17616 B13R1.511 C=C(F)CSc1ccc(c(c1)O)O 62a_100000042424_100009813601 [0,2,0,0,0,1|1,0,0]=4 17617 B13R1.511 CC(=O)CCc1ccc(c(c1)Br)C 1458a_100010220830_200000210301 [0,2,0,0,0,1|1,0,0]=4 17618 B13R1.511 CC(=O)CCc1ccc(c(c1)Br)F 1458a_100011308364_200000210301 [0,2,0,0,0,1|1,0,0]=4 17619 B13R1.511 CC(=O)CCc1ccc(c(c1)C)C 1458a_100011338283_200000210301 [0,2,0,0,0,1|1,0,0]=4 17620 B13R1.511 CC(=O)CCc1ccc(c(c1)C)F 1458a_100011615030_200000210301 [0,2,0,0,0,1|1,0,0]=4 17621 B13R1.511 CC(=O)CCc1ccc(c(c1)Cl)Br 1458a_100009812081_200000210301 [0,2,0,0,0,1|1,0,0]=4 17622 B13R1.511 CC(=O)CCc1ccc(c(c1)Cl)Cl 1458a_100000070787_100011713676 [0,2,0,0,0,1|1,0,0]=4 17623 B13R1.511 CC(=O)CCc1ccc(c(c1)Cl)Cl 1458a_100000735579_200000210301 [0,2,0,0,0,1|1,0,0]=4 17624 B13R1.511 CC(=O)CCc1ccc(c(c1)Cl)F 1458a_100000070787_100012361305 [0,2,0,0,0,1|1,0,0]=4 17625 B13R1.511 CC(=O)CCc1ccc(c(c1)Cl)F 1458a_100011218152_200000210301 [0,2,0,0,0,1|1,0,0]=4 17626 B13R1.511 CC(=O)CCc1ccc(c(c1)F)Br 1458a_100010146367_200000210301 [0,2,0,0,0,1|1,0,0]=4 17627 B13R1.511 CC(=O)CCc1ccc(c(c1)F)C 1458a_100011830284_200000210301 [0,2,0,0,0,1|1,0,0]=4 17628 B13R1.511 CC(=O)CCc1ccc(c(c1)F)Cl 1458a_100011518922_200000210301 [0,2,0,0,0,1|1,0,0]=4 17629 B13R1.511 CC(=O)CCc1ccc(c(c1)F)F 1458a_100000070787_100000690553 [0,2,0,0,0,1|1,0,0]=4 17630 B13R1.511 CC(=O)CCc1ccc(c(c1)F)F 1458a_100000737970_200000210301 [0,2,0,0,0,1|1,0,0]=4 17631 B13R1.511 CC(=O)CCc1ccc(c(c1)O)O 1458a_100000042615_200000210301 [0,2,0,0,0,1|1,0,0]=4 17632 B13R1.511 CC(=O)CCc1ccc(c(c1)O)O 1458a_100000070787_200010393615 [0,2,0,0,0,1|1,0,0]=4 17633 B13R1.511 CC(=O)COc1ccc(c(c1)C)C 1458a_100000182425_200000210301 [0,2,0,0,0,1|1,0,0]=4 17634 B13R1.511 CC(=O)COc1ccc(c(c1)C)Cl 1458a_100000182483_200000210301 [0,2,0,0,0,1|1,0,0]=4 17635 B13R1.511 CC(=O)COc1ccc(c(c1)Cl)Cl 1458a_100000191221_200000210301 [0,2,0,0,0,1|1,0,0]=4 17636 B13R1.511 CC(=O)COc1ccc(c(c1)Cl)F 1458a_100000191248_200000210301 [0,2,0,0,0,1|1,0,0]=4 17637 B13R1.511 CC(=O)COc1ccc(c(c1)F)Cl 1458a_100012982646_200000210301 [0,2,0,0,0,1|1,0,0]=4 17638 B13R1.511 CC(=O)COc1ccc(c(c1)F)F 1458a_100000246063_200000210301 [0,2,0,0,0,1|1,0,0]=4 17639 B13R1.511 CC(=O)CSc1ccc(c(c1)F)F 1458a_100000204393_200000210301 [0,2,0,0,0,1|1,0,0]=4 17640 B13R1.511 CC(=O)NCc1ccc(c(c1)Br)Br 11a_100012351559_100015343762 [0,2,0,0,0,1|1,0,0]=4 17641 B13R1.511 CC(=O)NCc1ccc(c(c1)Br)Br 1626a_100012351559_100015343762 [0,2,0,0,0,1|1,0,0]=4 17642 B13R1.511 CC(=O)NCc1ccc(c(c1)Br)Br 240690a_100012351559_100015343762 [0,2,0,0,0,1|1,0,0]=4 17643 B13R1.511 CC(=O)NCc1ccc(c(c1)Br)Br 527a_100012351559_100103153847 [0,2,0,0,0,1|1,0,0]=4 17644 B13R1.511 CC(=O)NCc1ccc(c(c1)Br)Cl 11a_100012349490_100015343762 [0,2,0,0,0,1|1,0,0]=4 17645 B13R1.511 CC(=O)NCc1ccc(c(c1)Br)Cl 1626a_100012349490_100015343762 [0,2,0,0,0,1|1,0,0]=4 17646 B13R1.511 CC(=O)NCc1ccc(c(c1)Br)Cl 240690a_100012349490_100015343762 [0,2,0,0,0,1|1,0,0]=4 17647 B13R1.511 CC(=O)NCc1ccc(c(c1)Br)Cl 527a_100012349490_100103153847 [0,2,0,0,0,1|1,0,0]=4 17648 B13R1.511 CC(=O)NCc1ccc(c(c1)Br)F 11a_100015193890_100015343762 [0,2,0,0,0,1|1,0,0]=4 17649 B13R1.511 CC(=O)NCc1ccc(c(c1)Br)F 1626a_100015193890_100015343762 [0,2,0,0,0,1|1,0,0]=4 17650 B13R1.511 CC(=O)NCc1ccc(c(c1)Br)F 240690a_100015193890_100015343762 [0,2,0,0,0,1|1,0,0]=4 17651 B13R1.511 CC(=O)NCc1ccc(c(c1)Br)F 527a_100015193890_100103153847 [0,2,0,0,0,1|1,0,0]=4 17652 B13R1.511 CC(=O)NCc1ccc(c(c1)C)Br 11a_100015205234_100015343762 [0,2,0,0,0,1|1,0,0]=4 17653 B13R1.511 CC(=O)NCc1ccc(c(c1)C)Br 1626a_100015205234_100015343762 [0,2,0,0,0,1|1,0,0]=4 17654 B13R1.511 CC(=O)NCc1ccc(c(c1)C)Br 240690a_100015205234_100015343762 [0,2,0,0,0,1|1,0,0]=4 17655 B13R1.511 CC(=O)NCc1ccc(c(c1)C)Br 527a_100015205234_100103153847 [0,2,0,0,0,1|1,0,0]=4 17656 B13R1.511 CC(=O)NCc1ccc(c(c1)C)C 11a_100025706692_100015343762 [0,2,0,0,0,1|1,0,0]=4 17657 B13R1.511 CC(=O)NCc1ccc(c(c1)C)C 1626a_100025706692_100015343762 [0,2,0,0,0,1|1,0,0]=4 17658 B13R1.511 CC(=O)NCc1ccc(c(c1)C)C 240690a_100025706692_100015343762 [0,2,0,0,0,1|1,0,0]=4 17659 B13R1.511 CC(=O)NCc1ccc(c(c1)C)C 527a_100025706692_100103153847 [0,2,0,0,0,1|1,0,0]=4 17660 B13R1.511 CC(=O)NCc1ccc(c(c1)C)F 11a_100000239911_100015343762 [0,2,0,0,0,1|1,0,0]=4 17661 B13R1.511 CC(=O)NCc1ccc(c(c1)C)F 1626a_100000239911_100015343762 [0,2,0,0,0,1|1,0,0]=4 17662 B13R1.511 CC(=O)NCc1ccc(c(c1)C)F 240690a_100000239911_100015343762 [0,2,0,0,0,1|1,0,0]=4 17663 B13R1.511 CC(=O)NCc1ccc(c(c1)C)F 527a_100000239911_100103153847 [0,2,0,0,0,1|1,0,0]=4 17664 B13R1.511 CC(=O)NCc1ccc(c(c1)Cl)Br 11a_100012362553_100015343762 [0,2,0,0,0,1|1,0,0]=4 17665 B13R1.511 CC(=O)NCc1ccc(c(c1)Cl)Br 1626a_100012362553_100015343762 [0,2,0,0,0,1|1,0,0]=4 17666 B13R1.511 CC(=O)NCc1ccc(c(c1)Cl)Br 240690a_100012362553_100015343762 [0,2,0,0,0,1|1,0,0]=4 17667 B13R1.511 CC(=O)NCc1ccc(c(c1)Cl)Br 527a_100012362553_100103153847 [0,2,0,0,0,1|1,0,0]=4 17668 B13R1.511 CC(=O)NCc1ccc(c(c1)Cl)C 11a_102495364989_100015343762 [0,2,0,0,0,1|1,0,0]=4 17669 B13R1.511 CC(=O)NCc1ccc(c(c1)Cl)C 1626a_102495364989_100015343762 [0,2,0,0,0,1|1,0,0]=4 17670 B13R1.511 CC(=O)NCc1ccc(c(c1)Cl)C 240690a_102495364989_100015343762 [0,2,0,0,0,1|1,0,0]=4 17671 B13R1.511 CC(=O)NCc1ccc(c(c1)Cl)C 527a_102495364989_100103153847 [0,2,0,0,0,1|1,0,0]=4 17672 B13R1.511 CC(=O)NCc1ccc(c(c1)Cl)Cl 11a_100000174881_100015343762 [0,2,0,0,0,1|1,0,0]=4 17673 B13R1.511 CC(=O)NCc1ccc(c(c1)Cl)Cl 1626a_100000174881_100015343762 [0,2,0,0,0,1|1,0,0]=4 17674 B13R1.511 CC(=O)NCc1ccc(c(c1)Cl)Cl 240690a_100000174881_100015343762 [0,2,0,0,0,1|1,0,0]=4 17675 B13R1.511 CC(=O)NCc1ccc(c(c1)Cl)Cl 527a_100000174881_100103153847 [0,2,0,0,0,1|1,0,0]=4 17676 B13R1.511 CC(=O)NCc1ccc(c(c1)Cl)F 11a_100000749334_100015343762 [0,2,0,0,0,1|1,0,0]=4 17677 B13R1.511 CC(=O)NCc1ccc(c(c1)Cl)F 1626a_100000749334_100015343762 [0,2,0,0,0,1|1,0,0]=4 17678 B13R1.511 CC(=O)NCc1ccc(c(c1)Cl)F 240690a_100000749334_100015343762 [0,2,0,0,0,1|1,0,0]=4 17679 B13R1.511 CC(=O)NCc1ccc(c(c1)Cl)F 527a_100000749334_100103153847 [0,2,0,0,0,1|1,0,0]=4 17680 B13R1.511 CC(=O)NCc1ccc(c(c1)F)Br 11a_100000755036_100015343762 [0,2,0,0,0,1|1,0,0]=4 17681 B13R1.511 CC(=O)NCc1ccc(c(c1)F)Br 1626a_100000755036_100015343762 [0,2,0,0,0,1|1,0,0]=4 17682 B13R1.511 CC(=O)NCc1ccc(c(c1)F)Br 240690a_100000755036_100015343762 [0,2,0,0,0,1|1,0,0]=4 17683 B13R1.511 CC(=O)NCc1ccc(c(c1)F)Br 527a_100000755036_100103153847 [0,2,0,0,0,1|1,0,0]=4 17684 B13R1.511 CC(=O)NCc1ccc(c(c1)F)C 11a_100102708794_100015343762 [0,2,0,0,0,1|1,0,0]=4 17685 B13R1.511 CC(=O)NCc1ccc(c(c1)F)C 1626a_100102708794_100015343762 [0,2,0,0,0,1|1,0,0]=4 17686 B13R1.511 CC(=O)NCc1ccc(c(c1)F)C 240690a_100102708794_100015343762 [0,2,0,0,0,1|1,0,0]=4 17687 B13R1.511 CC(=O)NCc1ccc(c(c1)F)C 527a_100102708794_100103153847 [0,2,0,0,0,1|1,0,0]=4 17688 B13R1.511 CC(=O)NCc1ccc(c(c1)F)Cl 11a_100011219866_100015343762 [0,2,0,0,0,1|1,0,0]=4 17689 B13R1.511 CC(=O)NCc1ccc(c(c1)F)Cl 1626a_100011219866_100015343762 [0,2,0,0,0,1|1,0,0]=4 17690 B13R1.511 CC(=O)NCc1ccc(c(c1)F)Cl 240690a_100011219866_100015343762 [0,2,0,0,0,1|1,0,0]=4 17691 B13R1.511 CC(=O)NCc1ccc(c(c1)F)Cl 527a_100011219866_100103153847 [0,2,0,0,0,1|1,0,0]=4 17692 B13R1.511 CC(=O)NCc1ccc(c(c1)F)F 11a_100000737897_100015343762 [0,2,0,0,0,1|1,0,0]=4 17693 B13R1.511 CC(=O)NCc1ccc(c(c1)F)F 1626a_100000737897_100015343762 [0,2,0,0,0,1|1,0,0]=4 17694 B13R1.511 CC(=O)NCc1ccc(c(c1)F)F 240690a_100000737897_100015343762 [0,2,0,0,0,1|1,0,0]=4 17695 B13R1.511 CC(=O)NCc1ccc(c(c1)F)F 527a_100000737897_100103153847 [0,2,0,0,0,1|1,0,0]=4 17696 B13R1.511 CC(=O)NCc1ccc(c(c1)F)O 240690a_100000758358_100015343762 [0,2,0,0,0,1|1,0,0]=4 17697 B13R1.511 CC(=O)NCc1ccc(c(c1)F)O 527a_100000758358_100103153847 [0,2,0,0,0,1|1,0,0]=4 17698 B13R1.511 CC(=O)NCc1ccc(c(c1)O)Cl 240690a_100020636435_100015343762 [0,2,0,0,0,1|1,0,0]=4 17699 B13R1.511 CC(=O)NCc1ccc(c(c1)O)Cl 527a_100020636435_100103153847 [0,2,0,0,0,1|1,0,0]=4 17700 B13R1.511 CC(=O)NCc1ccc(c(c1)O)F 240690a_100160469508_100015343762 [0,2,0,0,0,1|1,0,0]=4 17701 B13R1.511 CC(=O)NCc1ccc(c(c1)O)F 527a_100160469508_100103153847 [0,2,0,0,0,1|1,0,0]=4 17702 B13R1.511 CC(=O)NCc1ccc(c(c1)O)O 240690a_100000010075_100015343762 [0,2,0,0,0,1|1,0,0]=4 17703 B13R1.511 Cc1cc(ccc1Cl)OCC(=O)[13CH3] 1458a_100000182483_200025704644 [0,2,0,0,0,1|1,0,0]=4 17704 B13R1.511 Cc1cc(ccc1F)CCC(=O)[13CH3] 1458a_100011615030_200025704644 [0,2,0,0,0,1|1,0,0]=4 17705 B13R1.511 Cc1ccc(cc1Br)CCC(=O)[13CH3] 1458a_100010220830_200025704644 [0,2,0,0,0,1|1,0,0]=4 17706 B13R1.511 Cc1ccc(cc1C)CCC(=O)[13CH3] 1458a_100011338283_200025704644 [0,2,0,0,0,1|1,0,0]=4 17707 B13R1.511 Cc1ccc(cc1C)OCC(=O)[13CH3] 1458a_100000182425_200025704644 [0,2,0,0,0,1|1,0,0]=4 17708 B13R1.511 Cc1ccc(cc1F)CCC(=O)[13CH3] 1458a_100011830284_200025704644 [0,2,0,0,0,1|1,0,0]=4 17709 B13R1.511 [13CH3]C(=O)CCc1ccc(c(c1)Br)F 1458a_100011308364_200025704644 [0,2,0,0,0,1|1,0,0]=4 17710 B13R1.511 [13CH3]C(=O)CCc1ccc(c(c1)Cl)Br 1458a_100009812081_200025704644 [0,2,0,0,0,1|1,0,0]=4 17711 B13R1.511 [13CH3]C(=O)CCc1ccc(c(c1)Cl)Cl 1458a_100000735579_200025704644 [0,2,0,0,0,1|1,0,0]=4 17712 B13R1.511 [13CH3]C(=O)CCc1ccc(c(c1)Cl)F 1458a_100011218152_200025704644 [0,2,0,0,0,1|1,0,0]=4 17713 B13R1.511 [13CH3]C(=O)CCc1ccc(c(c1)F)Br 1458a_100010146367_200025704644 [0,2,0,0,0,1|1,0,0]=4 17714 B13R1.511 [13CH3]C(=O)CCc1ccc(c(c1)F)Cl 1458a_100011518922_200025704644 [0,2,0,0,0,1|1,0,0]=4 17715 B13R1.511 [13CH3]C(=O)CCc1ccc(c(c1)F)F 1458a_100000737970_200025704644 [0,2,0,0,0,1|1,0,0]=4 17716 B13R1.511 [13CH3]C(=O)CCc1ccc(c(c1)O)O 1458a_100000042615_200025704644 [0,2,0,0,0,1|1,0,0]=4 17717 B13R1.511 [13CH3]C(=O)COc1ccc(c(c1)Cl)Cl 1458a_100000191221_200025704644 [0,2,0,0,0,1|1,0,0]=4 17718 B13R1.511 [13CH3]C(=O)COc1ccc(c(c1)Cl)F 1458a_100000191248_200025704644 [0,2,0,0,0,1|1,0,0]=4 17719 B13R1.511 [13CH3]C(=O)COc1ccc(c(c1)F)Cl 1458a_100012982646_200025704644 [0,2,0,0,0,1|1,0,0]=4 17720 B13R1.511 [13CH3]C(=O)COc1ccc(c(c1)F)F 1458a_100000246063_200025704644 [0,2,0,0,0,1|1,0,0]=4 17721 B13R1.511 [13CH3]C(=O)CSc1ccc(c(c1)F)F 1458a_100000204393_200025704644 [0,2,0,0,0,1|1,0,0]=4 17722 B13R1.11 C=C(C#N)CC(=O)c1ccccc1 1458a_100000185807_100000694840 [0,2,0,0,0,1|0,0,1]=4 17723 B13R1.11 C=C(C#N)CN(C)c1ccccc1 2230a_100000210012_100000694840 [0,2,0,0,0,1|0,0,1]=4 17724 B13R1.11 C=C(C#N)CN(C)c1ccccc1 269982a_100000210012_100000694840 [0,2,0,0,0,1|0,0,1]=4 17725 B13R1.11 C=C(C#N)CN(C)c1ccccc1 34a_100000210012_100000694840 [0,2,0,0,0,1|0,0,1]=4 17726 B13R1.11 C=CC(=O)CC(=O)c1ccccc1 1458a_100000185746_100000211460 [0,2,0,0,0,1|1,0,0]=4 17727 B13R1.11 C=CC(=O)CC(C)c1ccccc1 1458a_100000185746_100000756946 [0,2,0,0,0,1|1,0,0]=4 17728 B13R1.11 C=CC(=O)CC(O)c1ccccc1 1458a_100000185746_100000185958 [0,2,0,0,0,1|1,0,0]=4 17729 B13R1.11 C=CC(=O)C[C@@H](O)c1ccccc1 1458a_100000185746_100011933945 [0,2,0,0,0,1|1,0,0]=4 17730 B13R1.11 C=CC(=O)N[C@H](C)c1ccccc1 1626a_100000751104_100000185746 [0,2,0,0,0,1|1,0,0]=4 17731 B13R1.11 C=CC(=O)N[C@H](C)c1ccccc1 240690a_100000751104_200121576911 [0,2,0,0,0,1|1,0,0]=4 17732 B13R1.11 C=CC(C)OC(C)c1ccccc1 34a_100000695699_100000211855 [0,2,0,0,0,1|0,0,1]=4 17733 B13R1.11 C=CC(C)SC(C)c1ccccc1 62a_100011215867_100000230085 [0,2,0,0,0,1|0,0,1]=4 17734 B13R1.11 CC(CC(=O)CF)c1ccccc1 1458a_100000183687_100015361967 [0,2,0,0,0,1|1,0,0]=4 17735 B13R1.11 CC(CC(=O)CO)c1ccccc1 1458a_100000210174_100000756946 [0,2,0,0,0,1|1,0,0]=4 17736 B13R1.11 CCC(=O)CC(=O)c1ccccc1 1458a_100000185807_100000747405 [0,2,0,0,0,1|1,0,0]=4 17737 B13R1.11 CCC(=O)CC(=O)c1ccccc1 1458a_100000210414_100000211460 [0,2,0,0,0,1|1,0,0]=4 17738 B13R1.11 CCC(=O)CC(C)c1ccccc1 1458a_100000183687_100000210202 [0,2,0,0,0,1|1,0,0]=4 17739 B13R1.11 CCC(=O)CC(C)c1ccccc1 1458a_100000210414_100000756946 [0,2,0,0,0,1|1,0,0]=4 17740 B13R1.11 CCC(=O)CC(O)c1ccccc1 1458a_100000210414_100000185958 [0,2,0,0,0,1|1,0,0]=4 17741 B13R1.11 CCC(=O)CC(O)c1ccccc1 1458a_100000690199_100000210202 [0,2,0,0,0,1|1,0,0]=4 17742 B13R1.11 CCC(=O)CN(C)c1ccccc1 1458a_100000745425_100000210202 [0,2,0,0,0,1|1,0,0]=4 17743 B13R1.11 CCC(=O)CN(C)c1ccccc1 269982a_100000210012_100000747405 [0,2,0,0,0,1|1,0,0]=4 17744 B13R1.11 CCC(=O)C[C@@H](O)c1ccccc1 1458a_100000210414_100011933945 [0,2,0,0,0,1|1,0,0]=4 17745 B13R1.11 CCC(=O)N[C@H](C)c1ccccc1 11a_100000751104_100000210414 [0,2,0,0,0,1|1,0,0]=4 17746 B13R1.11 CCC(=O)N[C@H](C)c1ccccc1 1626a_100000751104_100000210414 [0,2,0,0,0,1|1,0,0]=4 17747 B13R1.11 CCC(=O)N[C@H](C)c1ccccc1 240690a_100000751104_100000210414 [0,2,0,0,0,1|1,0,0]=4 17748 B13R1.11 CCC(=O)N[C@H](C)c1ccccc1 527a_100000751104_100000210414 [0,2,0,0,0,1|1,0,0]=4 17749 B13R1.11 CN(CC(=O)CF)c1ccccc1 1458a_100000745425_100015361967 [0,2,0,0,0,1|1,0,0]=4 17750 B13R1.11 CNC(=O)CC(=O)c1ccccc1 1458a_100000185807_100000183359 [0,2,0,0,0,1|1,0,0]=4 17751 B13R1.11 CNC(=O)CC(C)c1ccccc1 11a_106832991635_100000183687 [0,2,0,0,0,1|1,0,0]=4 17752 B13R1.11 CNC(=O)CC(C)c1ccccc1 1626a_100102657272_100000183687 [0,2,0,0,0,1|1,0,0]=4 17753 B13R1.11 CNC(=O)CC(C)c1ccccc1 240690a_100102657272_100000183687 [0,2,0,0,0,1|1,0,0]=4 17754 B13R1.11 CNC(=O)CC(C)c1ccccc1 527a_100102657272_100000183687 [0,2,0,0,0,1|1,0,0]=4 17755 B13R1.11 CNC(=O)CC(O)c1ccccc1 240690a_100102657272_100000690199 [0,2,0,0,0,1|1,0,0]=4 17756 B13R1.11 CNC(=O)CN(C)c1ccccc1 2230a_100000210012_100000183359 [0,2,0,0,0,1|1,0,0]=4 17757 B13R1.11 CNC(=O)CN(C)c1ccccc1 240690a_100102657272_100000745425 [0,2,0,0,0,1|1,0,0]=4 17758 B13R1.11 CNC(=O)CN(C)c1ccccc1 269982a_100000210012_100000183359 [0,2,0,0,0,1|1,0,0]=4 17759 B13R1.11 CNC(=O)CN(C)c1ccccc1 34a_100000210012_100000183359 [0,2,0,0,0,1|1,0,0]=4 17760 B13R1.11 CNC(=O)CN(C)c1ccccc1 527a_100102657272_100000745425 [0,2,0,0,0,1|1,0,0]=4 17761 B13R1.11 CNC(=O)N[C@H](C)c1ccccc1 2708a_100000751104_106832991635 [0,2,0,0,0,1|1,0,0]=4 17762 B13R1.11 CNC(=O)N[C@H](C)c1ccccc1 2708a_100102657272_100000751104 [0,2,0,0,0,1|1,0,0]=4 17763 B13R1.11 CNC(=O)N[C@H](C)c1ccccc1 273464a_100000751104_100102657272 [0,2,0,0,0,1|1,0,0]=4 17764 B13R1.11 CNC(=O)N[C@H](C)c1ccccc1 273464a_100102657272_100000751104 [0,2,0,0,0,1|1,0,0]=4 17765 B13R1.11 CNC(=O)N[C@H](C)c1ccccc1 512a_100000751104_100102657272 [0,2,0,0,0,1|1,0,0]=4 17766 B13R1.11 CNC(=O)N[C@H](C)c1ccccc1 512a_106832991638_100000751104 [0,2,0,0,0,1|1,0,0]=4 17767 B13R1.11 COC(=O)CC(=O)c1ccccc1 1458a_100000185807_100000747449 [0,2,0,0,0,1|1,0,0]=4 17768 B13R1.11 COC(=O)CN(C)c1ccccc1 2230a_100000210012_100000747449 [0,2,0,0,0,1|1,0,0]=4 17769 B13R1.11 COC(=O)CN(C)c1ccccc1 2230a_100000757779_200000210301 [0,2,0,0,0,1|1,0,0]=4 17770 B13R1.11 COC(=O)CN(C)c1ccccc1 269982a_100000210012_100000747449 [0,2,0,0,0,1|1,0,0]=4 17771 B13R1.11 COC(=O)CN(C)c1ccccc1 269982a_100000757779_200000210301 [0,2,0,0,0,1|1,0,0]=4 17772 B13R1.11 COC(=O)CN(C)c1ccccc1 34a_100000210012_100000747449 [0,2,0,0,0,1|1,0,0]=4 17773 B13R1.11 COC(=O)CN([13CH3])c1ccccc1 2230a_100000757779_200025704644 [0,2,0,0,0,1|1,0,0]=4 17774 B13R1.11 COC(=O)CN([13CH3])c1ccccc1 269982a_100000757779_200025704644 [0,2,0,0,0,1|1,0,0]=4 17775 B13R1.11 C[C@@H](NC(=O)CO)c1ccccc1 240690a_100000751104_100000210174 [0,2,0,0,0,1|1,0,0]=4 17776 B13R1.11 C[C@@H](NC(=O)CO)c1ccccc1 527a_100000751104_100000210174 [0,2,0,0,0,1|1,0,0]=4 17777 B13R1.11 O=C(CF)CC(O)c1ccccc1 1458a_100000690199_100015361967 [0,2,0,0,0,1|1,0,0]=4 17778 B13R1.11 O=C(CO)CC(=O)c1ccccc1 1458a_100000210174_100000211460 [0,2,0,0,0,1|1,0,0]=4 17779 B13R1.11 O=C(CO)CC(O)c1ccccc1 1458a_100000210174_100000185958 [0,2,0,0,0,1|1,0,0]=4 17780 B13R1.11 O=C(CO)C[C@@H](O)c1ccccc1 1458a_100000210174_100011933945 [0,2,0,0,0,1|1,0,0]=4 17781 B13R1.15 C=C(C#N)CNc1cccc(c1)Br 34a_100000210019_100000694840 [0,2,0,0,0,1|0,0,1]=4 17782 B13R1.15 C=C(C#N)CNc1cccc(c1)C 2230a_100000188690_100000694840 [0,2,0,0,0,1|0,0,1]=4 17783 B13R1.15 C=C(C#N)CNc1cccc(c1)C 34a_100000188690_100000694840 [0,2,0,0,0,1|0,0,1]=4 17784 B13R1.15 C=C(C#N)CNc1cccc(c1)Cl 34a_100000185859_100000694840 [0,2,0,0,0,1|0,0,1]=4 17785 B13R1.15 C=C(C#N)CNc1cccc(c1)F 34a_100000210047_100000694840 [0,2,0,0,0,1|0,0,1]=4 17786 B13R1.15 C=C(C#N)CNc1cccc(c1)I 34a_100000211102_100000694840 [0,2,0,0,0,1|0,0,1]=4 17787 B13R1.15 C=C(C#N)CNc1cccc(c1)O 34a_100000210217_100000694840 [0,2,0,0,0,1|0,0,1]=4 17788 B13R1.15 C=C(C#N)COc1cccc(c1)Br 34a_100000210342_100000694840 [0,2,0,0,0,1|0,0,1]=4 17789 B13R1.15 C=C(C#N)COc1cccc(c1)C 34a_100000210337_100000694840 [0,2,0,0,0,1|0,0,1]=4 17790 B13R1.15 C=C(C#N)COc1cccc(c1)Cl 34a_100000210295_100000694840 [0,2,0,0,0,1|0,0,1]=4 17791 B13R1.15 C=C(C#N)COc1cccc(c1)F 34a_100000210426_100000694840 [0,2,0,0,0,1|0,0,1]=4 17792 B13R1.15 C=C(C#N)COc1cccc(c1)I 34a_100000211634_100000694840 [0,2,0,0,0,1|0,0,1]=4 17793 B13R1.15 C=C(C#N)COc1cccc(c1)N 34a_100000210217_100000694840 [0,2,0,0,0,1|0,0,1]=4 17794 B13R1.15 C=C(C#N)CSc1cccc(c1)Br 62a_100000691529_100000694840 [0,2,0,0,0,1|0,0,1]=4 17795 B13R1.15 C=C(C#N)CSc1cccc(c1)C 62a_100011215228_100000694840 [0,2,0,0,0,1|0,0,1]=4 17796 B13R1.15 C=C(C#N)CSc1cccc(c1)Cl 62a_100000699651_100000694840 [0,2,0,0,0,1|0,0,1]=4 17797 B13R1.15 C=C(C#N)CSc1cccc(c1)F 62a_100000685547_100000694840 [0,2,0,0,0,1|0,0,1]=4 17798 B13R1.15 C=C(C#N)CSc1cccc(c1)N 62a_100000210019_100000694840 [0,2,0,0,0,1|0,0,1]=4 17799 B13R1.15 C=C(C#N)CSc1cccc(c1)[S] 62a_114929384022_100000694840 [0,2,0,0,0,1|0,0,1]=4 17800 B13R1.15 C=CC(=NNc1cccc(c1)Br)C 4a_100000217339_200015361842 [0,2,0,0,0,1|1,0,0]=4 17801 B13R1.15 C=CC(=NNc1cccc(c1)C)C 4a_100000681630_200015361842 [0,2,0,0,0,1|1,0,0]=4 17802 B13R1.15 C=CC(=NNc1cccc(c1)Cl)C 4a_100000184277_200015361842 [0,2,0,0,0,1|1,0,0]=4 17803 B13R1.15 C=CC(=NNc1cccc(c1)F)C 4a_100000745080_200015361842 [0,2,0,0,0,1|1,0,0]=4 17804 B13R1.15 C=CC(=NNc1cccc(c1)I)C 4a_100020605690_200015361842 [0,2,0,0,0,1|1,0,0]=4 17805 B13R1.15 C=CC(=O)CCc1cccc(c1)Br 1458a_100000185746_100011740638 [0,2,0,0,0,1|1,0,0]=4 17806 B13R1.15 C=CC(=O)CCc1cccc(c1)C 1458a_100000185746_100011713685 [0,2,0,0,0,1|1,0,0]=4 17807 B13R1.15 C=CC(=O)CCc1cccc(c1)Cl 1458a_100000185746_100011713710 [0,2,0,0,0,1|1,0,0]=4 17808 B13R1.15 C=CC(=O)CCc1cccc(c1)F 1458a_100000185746_100011217235 [0,2,0,0,0,1|1,0,0]=4 17809 B13R1.15 C=CC(=O)NCc1cccc(c1)Br 1626a_100000174977_100000185746 [0,2,0,0,0,1|1,0,0]=4 17810 B13R1.15 C=CC(=O)NCc1cccc(c1)Br 240690a_100000174977_200121576911 [0,2,0,0,0,1|1,0,0]=4 17811 B13R1.15 C=CC(=O)NCc1cccc(c1)C 1626a_100000185548_100000185746 [0,2,0,0,0,1|1,0,0]=4 17812 B13R1.15 C=CC(=O)NCc1cccc(c1)C 240690a_100000185548_200121576911 [0,2,0,0,0,1|1,0,0]=4 17813 B13R1.15 C=CC(=O)NCc1cccc(c1)Cl 1626a_100000174878_100000185746 [0,2,0,0,0,1|1,0,0]=4 17814 B13R1.15 C=CC(=O)NCc1cccc(c1)Cl 240690a_100000174878_200121576911 [0,2,0,0,0,1|1,0,0]=4 17815 B13R1.15 C=CC(=O)NCc1cccc(c1)F 1626a_100000174948_100000185746 [0,2,0,0,0,1|1,0,0]=4 17816 B13R1.15 C=CC(=O)NCc1cccc(c1)F 240690a_100000174948_200121576911 [0,2,0,0,0,1|1,0,0]=4 17817 B13R1.15 C=CC(=O)NCc1cccc(c1)I 1626a_100000106179_100000185746 [0,2,0,0,0,1|1,0,0]=4 17818 B13R1.15 C=CC(=O)NCc1cccc(c1)I 240690a_100000106179_200121576911 [0,2,0,0,0,1|1,0,0]=4 17819 B13R1.15 C=CC(=O)NCc1cccc(c1)O 240690a_100000743036_200121576911 [0,2,0,0,0,1|1,0,0]=4 17820 B13R1.15 C=CC(C)OCc1cccc(c1)Br 34a_100000695699_100000698116 [0,2,0,0,0,1|0,0,1]=4 17821 B13R1.15 C=CC(C)OCc1cccc(c1)C 34a_100000695699_100000211840 [0,2,0,0,0,1|0,0,1]=4 17822 B13R1.15 C=CC(C)OCc1cccc(c1)Cl 34a_100000695699_100000187163 [0,2,0,0,0,1|0,0,1]=4 17823 B13R1.15 C=CC(C)OCc1cccc(c1)F 34a_100000695699_100000187166 [0,2,0,0,0,1|0,0,1]=4 17824 B13R1.15 C=CC(C)OCc1cccc(c1)I 34a_100000695699_100011218688 [0,2,0,0,0,1|0,0,1]=4 17825 B13R1.15 C=CC(C)OCc1cccc(c1)O 34a_100000695699_100011660834 [0,2,0,0,0,1|0,0,1]=4 17826 B13R1.15 C=CC(C)SCc1cccc(c1)Br 62a_100011215867_100000211773 [0,2,0,0,0,1|0,0,1]=4 17827 B13R1.15 C=CC(C)SCc1cccc(c1)C 62a_100011215867_100000211840 [0,2,0,0,0,1|0,0,1]=4 17828 B13R1.15 C=CC(C)SCc1cccc(c1)Cl 62a_100011215867_100000187163 [0,2,0,0,0,1|0,0,1]=4 17829 B13R1.15 C=CC(C)SCc1cccc(c1)F 62a_100011215867_100000230114 [0,2,0,0,0,1|0,0,1]=4 17830 B13R1.15 C=CC(C)SCc1cccc(c1)I 62a_100011215867_100011218688 [0,2,0,0,0,1|0,0,1]=4 17831 B13R1.15 C=CC(C)SCc1cccc(c1)O 62a_100011215867_100011660834 [0,2,0,0,0,1|0,0,1]=4 17832 B13R1.15 CCC(=O)CCc1cccc(c1)Br 1458a_100000184314_100000210202 [0,2,0,0,0,1|1,0,0]=4 17833 B13R1.15 CCC(=O)CCc1cccc(c1)Br 1458a_100000210414_100011740638 [0,2,0,0,0,1|1,0,0]=4 17834 B13R1.15 CCC(=O)CCc1cccc(c1)C 1458a_100000210414_100011713685 [0,2,0,0,0,1|1,0,0]=4 17835 B13R1.15 CCC(=O)CCc1cccc(c1)C 1458a_100000234952_100000210202 [0,2,0,0,0,1|1,0,0]=4 17836 B13R1.15 CCC(=O)CCc1cccc(c1)Cl 1458a_100000210414_100011713710 [0,2,0,0,0,1|1,0,0]=4 17837 B13R1.15 CCC(=O)CCc1cccc(c1)Cl 1458a_100000235675_100000210202 [0,2,0,0,0,1|1,0,0]=4 17838 B13R1.15 CCC(=O)CCc1cccc(c1)F 1458a_100000210414_100011217235 [0,2,0,0,0,1|1,0,0]=4 17839 B13R1.15 CCC(=O)CCc1cccc(c1)F 1458a_100000235673_100000210202 [0,2,0,0,0,1|1,0,0]=4 17840 B13R1.15 CCC(=O)CCc1cccc(c1)I 1458a_100010007846_100000210202 [0,2,0,0,0,1|1,0,0]=4 17841 B13R1.15 CCC(=O)CCc1cccc(c1)O 1458a_100011216126_100000210202 [0,2,0,0,0,1|1,0,0]=4 17842 B13R1.15 CCC(=O)COc1cccc(c1)Br 1458a_100000182359_100000210202 [0,2,0,0,0,1|1,0,0]=4 17843 B13R1.15 CCC(=O)COc1cccc(c1)Br 7a_100000210342_100000747405 [0,2,0,0,0,1|1,0,0]=4 17844 B13R1.15 CCC(=O)COc1cccc(c1)C 1458a_100000183606_100000210202 [0,2,0,0,0,1|1,0,0]=4 17845 B13R1.15 CCC(=O)COc1cccc(c1)C 7a_100000210337_100000747405 [0,2,0,0,0,1|1,0,0]=4 17846 B13R1.15 CCC(=O)COc1cccc(c1)Cl 1458a_100000184978_100000210202 [0,2,0,0,0,1|1,0,0]=4 17847 B13R1.15 CCC(=O)COc1cccc(c1)Cl 7a_100000210295_100000747405 [0,2,0,0,0,1|1,0,0]=4 17848 B13R1.15 CCC(=O)COc1cccc(c1)F 1458a_100000182781_100000210202 [0,2,0,0,0,1|1,0,0]=4 17849 B13R1.15 CCC(=O)COc1cccc(c1)F 7a_100000210426_100000747405 [0,2,0,0,0,1|1,0,0]=4 17850 B13R1.15 CCC(=O)COc1cccc(c1)I 7a_100000211634_100000747405 [0,2,0,0,0,1|1,0,0]=4 17851 B13R1.15 CCC(=O)CSc1cccc(c1)Br 1458a_100000760868_100000210202 [0,2,0,0,0,1|1,0,0]=4 17852 B13R1.15 CCC(=O)CSc1cccc(c1)Br 62a_100000691529_100000747405 [0,2,0,0,0,1|1,0,0]=4 17853 B13R1.15 CCC(=O)CSc1cccc(c1)Br 62a_100000747405_100000691529 [0,2,0,0,0,1|1,0,0]=4 17854 B13R1.15 CCC(=O)CSc1cccc(c1)C 62a_100000747405_100011215228 [0,2,0,0,0,1|1,0,0]=4 17855 B13R1.15 CCC(=O)CSc1cccc(c1)C 62a_100011215228_100000747405 [0,2,0,0,0,1|1,0,0]=4 17856 B13R1.15 CCC(=O)CSc1cccc(c1)Cl 62a_100000699651_100000747405 [0,2,0,0,0,1|1,0,0]=4 17857 B13R1.15 CCC(=O)CSc1cccc(c1)Cl 62a_100000747405_100000699651 [0,2,0,0,0,1|1,0,0]=4 17858 B13R1.15 CCC(=O)CSc1cccc(c1)F 62a_100000685547_100000747405 [0,2,0,0,0,1|1,0,0]=4 17859 B13R1.15 CCC(=O)CSc1cccc(c1)F 62a_100000747405_100000685547 [0,2,0,0,0,1|1,0,0]=4 17860 B13R1.15 CCC(=O)CSc1cccc(c1)N 62a_100000210019_100000747405 [0,2,0,0,0,1|1,0,0]=4 17861 B13R1.15 CCC(=O)CSc1cccc(c1)N 62a_100000747405_100000210019 [0,2,0,0,0,1|1,0,0]=4 17862 B13R1.15 CCC(=O)CSc1cccc(c1)O 62a_100000747405_100000211634 [0,2,0,0,0,1|1,0,0]=4 17863 B13R1.15 CCC(=O)CSc1cccc(c1)[S] 62a_100000747405_114929384022 [0,2,0,0,0,1|1,0,0]=4 17864 B13R1.15 CCC(=O)CSc1cccc(c1)[S] 62a_114929384022_100000747405 [0,2,0,0,0,1|1,0,0]=4 17865 B13R1.15 CCC(=O)NCc1cccc(c1)Br 11a_100000174977_100000210414 [0,2,0,0,0,1|1,0,0]=4 17866 B13R1.15 CCC(=O)NCc1cccc(c1)Br 1626a_100000174977_100000210414 [0,2,0,0,0,1|1,0,0]=4 17867 B13R1.15 CCC(=O)NCc1cccc(c1)Br 240690a_100000174977_100000210414 [0,2,0,0,0,1|1,0,0]=4 17868 B13R1.15 CCC(=O)NCc1cccc(c1)Br 527a_100000174977_100000210414 [0,2,0,0,0,1|1,0,0]=4 17869 B13R1.15 CCC(=O)NCc1cccc(c1)C 11a_100000185548_100000210414 [0,2,0,0,0,1|1,0,0]=4 17870 B13R1.15 CCC(=O)NCc1cccc(c1)C 1626a_100000185548_100000210414 [0,2,0,0,0,1|1,0,0]=4 17871 B13R1.15 CCC(=O)NCc1cccc(c1)C 240690a_100000185548_100000210414 [0,2,0,0,0,1|1,0,0]=4 17872 B13R1.15 CCC(=O)NCc1cccc(c1)C 527a_100000185548_100000210414 [0,2,0,0,0,1|1,0,0]=4 17873 B13R1.15 CCC(=O)NCc1cccc(c1)Cl 11a_100000174878_100000210414 [0,2,0,0,0,1|1,0,0]=4 17874 B13R1.15 CCC(=O)NCc1cccc(c1)Cl 1626a_100000174878_100000210414 [0,2,0,0,0,1|1,0,0]=4 17875 B13R1.15 CCC(=O)NCc1cccc(c1)Cl 240690a_100000174878_100000210414 [0,2,0,0,0,1|1,0,0]=4 17876 B13R1.15 CCC(=O)NCc1cccc(c1)Cl 527a_100000174878_100000210414 [0,2,0,0,0,1|1,0,0]=4 17877 B13R1.15 CCC(=O)NCc1cccc(c1)F 11a_100000174948_100000210414 [0,2,0,0,0,1|1,0,0]=4 17878 B13R1.15 CCC(=O)NCc1cccc(c1)F 1626a_100000174948_100000210414 [0,2,0,0,0,1|1,0,0]=4 17879 B13R1.15 CCC(=O)NCc1cccc(c1)F 240690a_100000174948_100000210414 [0,2,0,0,0,1|1,0,0]=4 17880 B13R1.15 CCC(=O)NCc1cccc(c1)F 527a_100000174948_100000210414 [0,2,0,0,0,1|1,0,0]=4 17881 B13R1.15 CCC(=O)NCc1cccc(c1)I 11a_100000106179_100000210414 [0,2,0,0,0,1|1,0,0]=4 17882 B13R1.15 CCC(=O)NCc1cccc(c1)I 1626a_100000106179_100000210414 [0,2,0,0,0,1|1,0,0]=4 17883 B13R1.15 CCC(=O)NCc1cccc(c1)I 240690a_100000106179_100000210414 [0,2,0,0,0,1|1,0,0]=4 17884 B13R1.15 CCC(=O)NCc1cccc(c1)I 527a_100000106179_100000210414 [0,2,0,0,0,1|1,0,0]=4 17885 B13R1.15 CCC(=O)NCc1cccc(c1)O 240690a_100000743036_100000210414 [0,2,0,0,0,1|1,0,0]=4 17886 B13R1.15 CCC(=O)NCc1cccc(c1)O 271570a_203496583355_200011236840 [0,2,0,0,0,1|1,0,0]=4 17887 B13R1.15 CCC(=O)NCc1cccc(c1)O 527a_100000743036_100000210414 [0,2,0,0,0,1|1,0,0]=4 17888 B13R1.15 CNC(=O)CCc1cccc(c1)Br 11a_106832991635_100000184314 [0,2,0,0,0,1|1,0,0]=4 17889 B13R1.15 CNC(=O)CCc1cccc(c1)Br 1626a_100102657272_100000184314 [0,2,0,0,0,1|1,0,0]=4 17890 B13R1.15 CNC(=O)CCc1cccc(c1)Br 240690a_100102657272_100000184314 [0,2,0,0,0,1|1,0,0]=4 17891 B13R1.15 CNC(=O)CCc1cccc(c1)Br 527a_100102657272_100000184314 [0,2,0,0,0,1|1,0,0]=4 17892 B13R1.15 CNC(=O)CCc1cccc(c1)C 11a_106832991635_100000234952 [0,2,0,0,0,1|1,0,0]=4 17893 B13R1.15 CNC(=O)CCc1cccc(c1)C 1626a_100102657272_100000234952 [0,2,0,0,0,1|1,0,0]=4 17894 B13R1.15 CNC(=O)CCc1cccc(c1)C 240690a_100102657272_100000234952 [0,2,0,0,0,1|1,0,0]=4 17895 B13R1.15 CNC(=O)CCc1cccc(c1)C 527a_100102657272_100000234952 [0,2,0,0,0,1|1,0,0]=4 17896 B13R1.15 CNC(=O)CCc1cccc(c1)Cl 11a_106832991635_100000235675 [0,2,0,0,0,1|1,0,0]=4 17897 B13R1.15 CNC(=O)CCc1cccc(c1)Cl 1626a_100102657272_100000235675 [0,2,0,0,0,1|1,0,0]=4 17898 B13R1.15 CNC(=O)CCc1cccc(c1)Cl 240690a_100102657272_100000235675 [0,2,0,0,0,1|1,0,0]=4 17899 B13R1.15 CNC(=O)CCc1cccc(c1)Cl 527a_100102657272_100000235675 [0,2,0,0,0,1|1,0,0]=4 17900 B13R1.15 CNC(=O)CCc1cccc(c1)F 11a_106832991635_100000235673 [0,2,0,0,0,1|1,0,0]=4 17901 B13R1.15 CNC(=O)CCc1cccc(c1)F 1626a_100102657272_100000235673 [0,2,0,0,0,1|1,0,0]=4 17902 B13R1.15 CNC(=O)CCc1cccc(c1)F 240690a_100102657272_100000235673 [0,2,0,0,0,1|1,0,0]=4 17903 B13R1.15 CNC(=O)CCc1cccc(c1)F 527a_100102657272_100000235673 [0,2,0,0,0,1|1,0,0]=4 17904 B13R1.15 CNC(=O)CCc1cccc(c1)I 11a_106832991635_100010007846 [0,2,0,0,0,1|1,0,0]=4 17905 B13R1.15 CNC(=O)CCc1cccc(c1)I 1626a_100102657272_100010007846 [0,2,0,0,0,1|1,0,0]=4 17906 B13R1.15 CNC(=O)CCc1cccc(c1)I 240690a_100102657272_100010007846 [0,2,0,0,0,1|1,0,0]=4 17907 B13R1.15 CNC(=O)CCc1cccc(c1)I 527a_100102657272_100010007846 [0,2,0,0,0,1|1,0,0]=4 17908 B13R1.15 CNC(=O)CCc1cccc(c1)O 240690a_100102657272_100011216126 [0,2,0,0,0,1|1,0,0]=4 17909 B13R1.15 CNC(=O)CCc1cccc(c1)O 527a_100102657272_100011216126 [0,2,0,0,0,1|1,0,0]=4 17910 B13R1.15 CNC(=O)CNc1cccc(c1)Br 34a_100000210019_100000183359 [0,2,0,0,0,1|1,0,0]=4 17911 B13R1.15 CNC(=O)CNc1cccc(c1)C 2230a_100000188690_100000183359 [0,2,0,0,0,1|1,0,0]=4 17912 B13R1.15 CNC(=O)CNc1cccc(c1)C 34a_100000188690_100000183359 [0,2,0,0,0,1|1,0,0]=4 17913 B13R1.15 CNC(=O)CNc1cccc(c1)Cl 34a_100000185859_100000183359 [0,2,0,0,0,1|1,0,0]=4 17914 B13R1.15 CNC(=O)CNc1cccc(c1)F 34a_100000210047_100000183359 [0,2,0,0,0,1|1,0,0]=4 17915 B13R1.15 CNC(=O)CNc1cccc(c1)I 34a_100000211102_100000183359 [0,2,0,0,0,1|1,0,0]=4 17916 B13R1.15 CNC(=O)CNc1cccc(c1)O 34a_100000210217_100000183359 [0,2,0,0,0,1|1,0,0]=4 17917 B13R1.15 CNC(=O)COc1cccc(c1)Br 11a_106832991635_100000182359 [0,2,0,0,0,1|1,0,0]=4 17918 B13R1.15 CNC(=O)COc1cccc(c1)Br 1626a_100102657272_100000182359 [0,2,0,0,0,1|1,0,0]=4 17919 B13R1.15 CNC(=O)COc1cccc(c1)Br 240690a_100102657272_100000182359 [0,2,0,0,0,1|1,0,0]=4 17920 B13R1.15 CNC(=O)COc1cccc(c1)Br 34a_100000210342_100000183359 [0,2,0,0,0,1|1,0,0]=4 17921 B13R1.15 CNC(=O)COc1cccc(c1)Br 527a_100102657272_100000182359 [0,2,0,0,0,1|1,0,0]=4 17922 B13R1.15 CNC(=O)COc1cccc(c1)Br 7a_100000210342_100000183359 [0,2,0,0,0,1|1,0,0]=4 17923 B13R1.15 CNC(=O)COc1cccc(c1)C 11a_106832991635_100000183606 [0,2,0,0,0,1|1,0,0]=4 17924 B13R1.15 CNC(=O)COc1cccc(c1)C 1626a_100102657272_100000183606 [0,2,0,0,0,1|1,0,0]=4 17925 B13R1.15 CNC(=O)COc1cccc(c1)C 240690a_100102657272_100000183606 [0,2,0,0,0,1|1,0,0]=4 17926 B13R1.15 CNC(=O)COc1cccc(c1)C 34a_100000210337_100000183359 [0,2,0,0,0,1|1,0,0]=4 17927 B13R1.15 CNC(=O)COc1cccc(c1)C 527a_100102657272_100000183606 [0,2,0,0,0,1|1,0,0]=4 17928 B13R1.15 CNC(=O)COc1cccc(c1)C 7a_100000210337_100000183359 [0,2,0,0,0,1|1,0,0]=4 17929 B13R1.15 CNC(=O)COc1cccc(c1)Cl 11a_106832991635_100000184978 [0,2,0,0,0,1|1,0,0]=4 17930 B13R1.15 CNC(=O)COc1cccc(c1)Cl 1626a_100102657272_100000184978 [0,2,0,0,0,1|1,0,0]=4 17931 B13R1.15 CNC(=O)COc1cccc(c1)Cl 240690a_100102657272_100000184978 [0,2,0,0,0,1|1,0,0]=4 17932 B13R1.15 CNC(=O)COc1cccc(c1)Cl 34a_100000210295_100000183359 [0,2,0,0,0,1|1,0,0]=4 17933 B13R1.15 CNC(=O)COc1cccc(c1)Cl 527a_100102657272_100000184978 [0,2,0,0,0,1|1,0,0]=4 17934 B13R1.15 CNC(=O)COc1cccc(c1)Cl 7a_100000210295_100000183359 [0,2,0,0,0,1|1,0,0]=4 17935 B13R1.15 CNC(=O)COc1cccc(c1)F 11a_106832991635_100000182781 [0,2,0,0,0,1|1,0,0]=4 17936 B13R1.15 CNC(=O)COc1cccc(c1)F 1626a_100102657272_100000182781 [0,2,0,0,0,1|1,0,0]=4 17937 B13R1.15 CNC(=O)COc1cccc(c1)F 240690a_100102657272_100000182781 [0,2,0,0,0,1|1,0,0]=4 17938 B13R1.15 CNC(=O)COc1cccc(c1)F 34a_100000210426_100000183359 [0,2,0,0,0,1|1,0,0]=4 17939 B13R1.15 CNC(=O)COc1cccc(c1)F 527a_100102657272_100000182781 [0,2,0,0,0,1|1,0,0]=4 17940 B13R1.15 CNC(=O)COc1cccc(c1)F 7a_100000210426_100000183359 [0,2,0,0,0,1|1,0,0]=4 17941 B13R1.15 CNC(=O)COc1cccc(c1)I 34a_100000211634_100000183359 [0,2,0,0,0,1|1,0,0]=4 17942 B13R1.15 CNC(=O)COc1cccc(c1)I 7a_100000211634_100000183359 [0,2,0,0,0,1|1,0,0]=4 17943 B13R1.15 CNC(=O)COc1cccc(c1)N 34a_100000210217_100000183359 [0,2,0,0,0,1|1,0,0]=4 17944 B13R1.15 CNC(=O)COc1cccc(c1)O 271570a_203496583355_200000150594 [0,2,0,0,0,1|1,0,0]=4 17945 B13R1.15 CNC(=O)CSc1cccc(c1)Br 11a_106832991635_100000760868 [0,2,0,0,0,1|1,0,0]=4 17946 B13R1.15 CNC(=O)CSc1cccc(c1)Br 1626a_100102657272_100000760868 [0,2,0,0,0,1|1,0,0]=4 17947 B13R1.15 CNC(=O)CSc1cccc(c1)Br 240690a_100102657272_100000760868 [0,2,0,0,0,1|1,0,0]=4 17948 B13R1.15 CNC(=O)CSc1cccc(c1)Br 527a_100102657272_100000760868 [0,2,0,0,0,1|1,0,0]=4 17949 B13R1.15 CNC(=O)CSc1cccc(c1)Br 62a_100000183359_100000691529 [0,2,0,0,0,1|1,0,0]=4 17950 B13R1.15 CNC(=O)CSc1cccc(c1)Br 62a_100000691529_100000183359 [0,2,0,0,0,1|1,0,0]=4 17951 B13R1.15 CNC(=O)CSc1cccc(c1)C 62a_100000183359_100011215228 [0,2,0,0,0,1|1,0,0]=4 17952 B13R1.15 CNC(=O)CSc1cccc(c1)C 62a_100011215228_100000183359 [0,2,0,0,0,1|1,0,0]=4 17953 B13R1.15 CNC(=O)CSc1cccc(c1)Cl 62a_100000183359_100000699651 [0,2,0,0,0,1|1,0,0]=4 17954 B13R1.15 CNC(=O)CSc1cccc(c1)Cl 62a_100000699651_100000183359 [0,2,0,0,0,1|1,0,0]=4 17955 B13R1.15 CNC(=O)CSc1cccc(c1)F 62a_100000183359_100000685547 [0,2,0,0,0,1|1,0,0]=4 17956 B13R1.15 CNC(=O)CSc1cccc(c1)F 62a_100000685547_100000183359 [0,2,0,0,0,1|1,0,0]=4 17957 B13R1.15 CNC(=O)CSc1cccc(c1)N 62a_100000183359_100000210019 [0,2,0,0,0,1|1,0,0]=4 17958 B13R1.15 CNC(=O)CSc1cccc(c1)N 62a_100000210019_100000183359 [0,2,0,0,0,1|1,0,0]=4 17959 B13R1.15 CNC(=O)CSc1cccc(c1)O 62a_100000183359_100000211634 [0,2,0,0,0,1|1,0,0]=4 17960 B13R1.15 CNC(=O)CSc1cccc(c1)[S] 62a_100000183359_114929384022 [0,2,0,0,0,1|1,0,0]=4 17961 B13R1.15 CNC(=O)CSc1cccc(c1)[S] 62a_114929384022_100000183359 [0,2,0,0,0,1|1,0,0]=4 17962 B13R1.15 CNC(=O)NCc1cccc(c1)Br 2708a_100000174977_106832991635 [0,2,0,0,0,1|1,0,0]=4 17963 B13R1.15 CNC(=O)NCc1cccc(c1)Br 2708a_100102657272_100000174977 [0,2,0,0,0,1|1,0,0]=4 17964 B13R1.15 CNC(=O)NCc1cccc(c1)Br 273464a_100000174977_100102657272 [0,2,0,0,0,1|1,0,0]=4 17965 B13R1.15 CNC(=O)NCc1cccc(c1)Br 273464a_100102657272_100000174977 [0,2,0,0,0,1|1,0,0]=4 17966 B13R1.15 CNC(=O)NCc1cccc(c1)Br 512a_100000174977_100102657272 [0,2,0,0,0,1|1,0,0]=4 17967 B13R1.15 CNC(=O)NCc1cccc(c1)Br 512a_106832991638_100000174977 [0,2,0,0,0,1|1,0,0]=4 17968 B13R1.15 CNC(=O)NCc1cccc(c1)C 2708a_100000185548_106832991635 [0,2,0,0,0,1|1,0,0]=4 17969 B13R1.15 CNC(=O)NCc1cccc(c1)C 2708a_100102657272_100000185548 [0,2,0,0,0,1|1,0,0]=4 17970 B13R1.15 CNC(=O)NCc1cccc(c1)C 273464a_100000185548_100102657272 [0,2,0,0,0,1|1,0,0]=4 17971 B13R1.15 CNC(=O)NCc1cccc(c1)C 273464a_100102657272_100000185548 [0,2,0,0,0,1|1,0,0]=4 17972 B13R1.15 CNC(=O)NCc1cccc(c1)C 512a_100000185548_100102657272 [0,2,0,0,0,1|1,0,0]=4 17973 B13R1.15 CNC(=O)NCc1cccc(c1)C 512a_106832991638_100000185548 [0,2,0,0,0,1|1,0,0]=4 17974 B13R1.15 CNC(=O)NCc1cccc(c1)Cl 2708a_100000174878_106832991635 [0,2,0,0,0,1|1,0,0]=4 17975 B13R1.15 CNC(=O)NCc1cccc(c1)Cl 2708a_100102657272_100000174878 [0,2,0,0,0,1|1,0,0]=4 17976 B13R1.15 CNC(=O)NCc1cccc(c1)Cl 273464a_100000174878_100102657272 [0,2,0,0,0,1|1,0,0]=4 17977 B13R1.15 CNC(=O)NCc1cccc(c1)Cl 273464a_100102657272_100000174878 [0,2,0,0,0,1|1,0,0]=4 17978 B13R1.15 CNC(=O)NCc1cccc(c1)Cl 512a_100000174878_100102657272 [0,2,0,0,0,1|1,0,0]=4 17979 B13R1.15 CNC(=O)NCc1cccc(c1)Cl 512a_106832991638_100000174878 [0,2,0,0,0,1|1,0,0]=4 17980 B13R1.15 CNC(=O)NCc1cccc(c1)F 2708a_100000174948_106832991635 [0,2,0,0,0,1|1,0,0]=4 17981 B13R1.15 CNC(=O)NCc1cccc(c1)F 2708a_100102657272_100000174948 [0,2,0,0,0,1|1,0,0]=4 17982 B13R1.15 CNC(=O)NCc1cccc(c1)F 273464a_100000174948_100102657272 [0,2,0,0,0,1|1,0,0]=4 17983 B13R1.15 CNC(=O)NCc1cccc(c1)F 273464a_100102657272_100000174948 [0,2,0,0,0,1|1,0,0]=4 17984 B13R1.15 CNC(=O)NCc1cccc(c1)F 512a_100000174948_100102657272 [0,2,0,0,0,1|1,0,0]=4 17985 B13R1.15 CNC(=O)NCc1cccc(c1)F 512a_106832991638_100000174948 [0,2,0,0,0,1|1,0,0]=4 17986 B13R1.15 CNC(=O)NCc1cccc(c1)I 2708a_100000106179_106832991635 [0,2,0,0,0,1|1,0,0]=4 17987 B13R1.15 CNC(=O)NCc1cccc(c1)I 2708a_100102657272_100000106179 [0,2,0,0,0,1|1,0,0]=4 17988 B13R1.15 CNC(=O)NCc1cccc(c1)I 273464a_100000106179_100102657272 [0,2,0,0,0,1|1,0,0]=4 17989 B13R1.15 CNC(=O)NCc1cccc(c1)I 273464a_100102657272_100000106179 [0,2,0,0,0,1|1,0,0]=4 17990 B13R1.15 CNC(=O)NCc1cccc(c1)I 512a_100000106179_100102657272 [0,2,0,0,0,1|1,0,0]=4 17991 B13R1.15 CNC(=O)NCc1cccc(c1)I 512a_106832991638_100000106179 [0,2,0,0,0,1|1,0,0]=4 17992 B13R1.15 CNC(=O)NCc1cccc(c1)O 2708a_100000743036_106832991635 [0,2,0,0,0,1|1,0,0]=4 17993 B13R1.15 CNC(=O)NCc1cccc(c1)O 2708a_100102657272_100000743036 [0,2,0,0,0,1|1,0,0]=4 17994 B13R1.15 CNC(=O)NCc1cccc(c1)O 273464a_100000743036_100102657272 [0,2,0,0,0,1|1,0,0]=4 17995 B13R1.15 CNC(=O)NCc1cccc(c1)O 273464a_100102657272_100000743036 [0,2,0,0,0,1|1,0,0]=4 17996 B13R1.15 CNC(=O)NCc1cccc(c1)O 512a_100000743036_100102657272 [0,2,0,0,0,1|1,0,0]=4 17997 B13R1.15 CNC(=O)NCc1cccc(c1)O 512a_106832991638_100000743036 [0,2,0,0,0,1|1,0,0]=4 17998 B13R1.15 COC(=O)CCc1cccc(c1)O 271570a_203496583355_100000151591 [0,2,0,0,0,1|1,0,0]=4 17999 B13R1.15 COC(=O)CNc1cccc(c1)Br 34a_100000210019_100000747449 [0,2,0,0,0,1|1,0,0]=4 18000 B13R1.15 COC(=O)CNc1cccc(c1)C 2230a_100000188690_100000747449 [0,2,0,0,0,1|1,0,0]=4 18001 B13R1.15 COC(=O)CNc1cccc(c1)C 34a_100000188690_100000747449 [0,2,0,0,0,1|1,0,0]=4 18002 B13R1.15 COC(=O)CNc1cccc(c1)Cl 34a_100000185859_100000747449 [0,2,0,0,0,1|1,0,0]=4 18003 B13R1.15 COC(=O)CNc1cccc(c1)F 34a_100000210047_100000747449 [0,2,0,0,0,1|1,0,0]=4 18004 B13R1.15 COC(=O)CNc1cccc(c1)I 34a_100000211102_100000747449 [0,2,0,0,0,1|1,0,0]=4 18005 B13R1.15 COC(=O)CNc1cccc(c1)O 34a_100000210217_100000747449 [0,2,0,0,0,1|1,0,0]=4 18006 B13R1.15 COC(=O)COc1cccc(c1)Br 34a_100000210342_100000747449 [0,2,0,0,0,1|1,0,0]=4 18007 B13R1.15 COC(=O)COc1cccc(c1)Br 7a_100000210342_100000747449 [0,2,0,0,0,1|1,0,0]=4 18008 B13R1.15 COC(=O)COc1cccc(c1)C 34a_100000210337_100000747449 [0,2,0,0,0,1|1,0,0]=4 18009 B13R1.15 COC(=O)COc1cccc(c1)C 7a_100000210337_100000747449 [0,2,0,0,0,1|1,0,0]=4 18010 B13R1.15 COC(=O)COc1cccc(c1)Cl 34a_100000210295_100000747449 [0,2,0,0,0,1|1,0,0]=4 18011 B13R1.15 COC(=O)COc1cccc(c1)Cl 7a_100000210295_100000747449 [0,2,0,0,0,1|1,0,0]=4 18012 B13R1.15 COC(=O)COc1cccc(c1)F 34a_100000210426_100000747449 [0,2,0,0,0,1|1,0,0]=4 18013 B13R1.15 COC(=O)COc1cccc(c1)F 7a_100000210426_100000747449 [0,2,0,0,0,1|1,0,0]=4 18014 B13R1.15 COC(=O)COc1cccc(c1)I 34a_100000211634_100000747449 [0,2,0,0,0,1|1,0,0]=4 18015 B13R1.15 COC(=O)COc1cccc(c1)I 7a_100000211634_100000747449 [0,2,0,0,0,1|1,0,0]=4 18016 B13R1.15 COC(=O)COc1cccc(c1)N 34a_100000210217_100000747449 [0,2,0,0,0,1|1,0,0]=4 18017 B13R1.15 COC(=O)COc1cccc(c1)O 271570a_203496583355_200000148702 [0,2,0,0,0,1|1,0,0]=4 18018 B13R1.15 COC(=O)CSc1cccc(c1)Br 62a_100000691529_100000747449 [0,2,0,0,0,1|1,0,0]=4 18019 B13R1.15 COC(=O)CSc1cccc(c1)Br 62a_100000747449_100000691529 [0,2,0,0,0,1|1,0,0]=4 18020 B13R1.15 COC(=O)CSc1cccc(c1)C 62a_100000747449_100011215228 [0,2,0,0,0,1|1,0,0]=4 18021 B13R1.15 COC(=O)CSc1cccc(c1)C 62a_100011215228_100000747449 [0,2,0,0,0,1|1,0,0]=4 18022 B13R1.15 COC(=O)CSc1cccc(c1)Cl 62a_100000699651_100000747449 [0,2,0,0,0,1|1,0,0]=4 18023 B13R1.15 COC(=O)CSc1cccc(c1)Cl 62a_100000747449_100000699651 [0,2,0,0,0,1|1,0,0]=4 18024 B13R1.15 COC(=O)CSc1cccc(c1)F 62a_100000685547_100000747449 [0,2,0,0,0,1|1,0,0]=4 18025 B13R1.15 COC(=O)CSc1cccc(c1)F 62a_100000747449_100000685547 [0,2,0,0,0,1|1,0,0]=4 18026 B13R1.15 COC(=O)CSc1cccc(c1)N 62a_100000210019_100000747449 [0,2,0,0,0,1|1,0,0]=4 18027 B13R1.15 COC(=O)CSc1cccc(c1)N 62a_100000747449_100000210019 [0,2,0,0,0,1|1,0,0]=4 18028 B13R1.15 COC(=O)CSc1cccc(c1)O 271570a_203496583355_100011756034 [0,2,0,0,0,1|1,0,0]=4 18029 B13R1.15 COC(=O)CSc1cccc(c1)O 62a_100000747449_100000211634 [0,2,0,0,0,1|1,0,0]=4 18030 B13R1.15 COC(=O)CSc1cccc(c1)[S] 62a_100000747449_114929384022 [0,2,0,0,0,1|1,0,0]=4 18031 B13R1.15 COC(=O)CSc1cccc(c1)[S] 62a_114929384022_100000747449 [0,2,0,0,0,1|1,0,0]=4 18032 B13R1.15 Cc1cccc(c1)CCC(=O)CF 1458a_100000234952_100015361967 [0,2,0,0,0,1|1,0,0]=4 18033 B13R1.15 Cc1cccc(c1)CCC(=O)CO 1458a_100000210174_100011713685 [0,2,0,0,0,1|1,0,0]=4 18034 B13R1.15 Cc1cccc(c1)CNC(=O)CO 240690a_100000185548_100000210174 [0,2,0,0,0,1|1,0,0]=4 18035 B13R1.15 Cc1cccc(c1)CNC(=O)CO 527a_100000185548_100000210174 [0,2,0,0,0,1|1,0,0]=4 18036 B13R1.15 Cc1cccc(c1)OCC(=O)CF 1458a_100000183606_100015361967 [0,2,0,0,0,1|1,0,0]=4 18037 B13R1.15 O=C(CF)CCc1cccc(c1)Br 1458a_100000184314_100015361967 [0,2,0,0,0,1|1,0,0]=4 18038 B13R1.15 O=C(CF)CCc1cccc(c1)Cl 1458a_100000235675_100015361967 [0,2,0,0,0,1|1,0,0]=4 18039 B13R1.15 O=C(CF)CCc1cccc(c1)F 1458a_100000235673_100015361967 [0,2,0,0,0,1|1,0,0]=4 18040 B13R1.15 O=C(CF)CCc1cccc(c1)I 1458a_100010007846_100015361967 [0,2,0,0,0,1|1,0,0]=4 18041 B13R1.15 O=C(CF)CCc1cccc(c1)O 1458a_100011216126_100015361967 [0,2,0,0,0,1|1,0,0]=4 18042 B13R1.15 O=C(CF)COc1cccc(c1)Br 1458a_100000182359_100015361967 [0,2,0,0,0,1|1,0,0]=4 18043 B13R1.15 O=C(CF)COc1cccc(c1)Cl 1458a_100000184978_100015361967 [0,2,0,0,0,1|1,0,0]=4 18044 B13R1.15 O=C(CF)COc1cccc(c1)F 1458a_100000182781_100015361967 [0,2,0,0,0,1|1,0,0]=4 18045 B13R1.15 O=C(CF)CSc1cccc(c1)Br 1458a_100000760868_100015361967 [0,2,0,0,0,1|1,0,0]=4 18046 B13R1.15 O=C(CO)CCc1cccc(c1)Br 1458a_100000210174_100011740638 [0,2,0,0,0,1|1,0,0]=4 18047 B13R1.15 O=C(CO)CCc1cccc(c1)Cl 1458a_100000210174_100011713710 [0,2,0,0,0,1|1,0,0]=4 18048 B13R1.15 O=C(CO)CCc1cccc(c1)F 1458a_100000210174_100011217235 [0,2,0,0,0,1|1,0,0]=4 18049 B13R1.15 O=C(CO)NCc1cccc(c1)Br 240690a_100000174977_100000210174 [0,2,0,0,0,1|1,0,0]=4 18050 B13R1.15 O=C(CO)NCc1cccc(c1)Br 527a_100000174977_100000210174 [0,2,0,0,0,1|1,0,0]=4 18051 B13R1.15 O=C(CO)NCc1cccc(c1)Cl 240690a_100000174878_100000210174 [0,2,0,0,0,1|1,0,0]=4 18052 B13R1.15 O=C(CO)NCc1cccc(c1)Cl 527a_100000174878_100000210174 [0,2,0,0,0,1|1,0,0]=4 18053 B13R1.15 O=C(CO)NCc1cccc(c1)F 240690a_100000174948_100000210174 [0,2,0,0,0,1|1,0,0]=4 18054 B13R1.15 O=C(CO)NCc1cccc(c1)F 527a_100000174948_100000210174 [0,2,0,0,0,1|1,0,0]=4 18055 B13R1.15 O=C(CO)NCc1cccc(c1)I 240690a_100000106179_100000210174 [0,2,0,0,0,1|1,0,0]=4 18056 B13R1.15 O=C(CO)NCc1cccc(c1)I 527a_100000106179_100000210174 [0,2,0,0,0,1|1,0,0]=4 18057 B13R1.15 O=C(CO)NCc1cccc(c1)O 240690a_100000743036_100000210174 [0,2,0,0,0,1|1,0,0]=4 18058 B13R1.15 O=C(CO)NCc1cccc(c1)O 527a_100000743036_100000210174 [0,2,0,0,0,1|1,0,0]=4 18059 B13R1.42 C#CCC(=O)CCc1ccccc1 1458a_100000185753_100000184674 [0,2,0,0,0,1|1,0,0]=4 18060 B13R1.42 C#CCC(=O)CCc1ccccc1 1458a_100011220946_100000765856 [0,2,0,0,0,1|1,0,0]=4 18061 B13R1.42 C#CCC(=O)COc1ccccc1 1458a_100000186222_100000184674 [0,2,0,0,0,1|1,0,0]=4 18062 B13R1.42 C#CCC(=O)CSc1ccccc1 1458a_100000211596_100000184674 [0,2,0,0,0,1|1,0,0]=4 18063 B13R1.42 C#CCC(=O)NCc1ccccc1 1626a_100015324214_100011220946 [0,2,0,0,0,1|1,0,0]=4 18064 B13R1.42 C#CCC(=O)NCc1ccccc1 527a_100015324214_100011220946 [0,2,0,0,0,1|1,0,0]=4 18065 B13R1.42 C/C=C/C(C)OCc1ccccc1 34a_200102604097_100015291786 [0,2,0,0,0,1|0,0,1]=4 18066 B13R1.42 C=CCC(=O)CCc1ccccc1 1458a_100000185753_100000210623 [0,2,0,0,0,1|1,0,0]=4 18067 B13R1.42 C=CCC(=O)CCc1ccccc1 1458a_100000210193_100000765856 [0,2,0,0,0,1|1,0,0]=4 18068 B13R1.42 C=CCC(=O)COc1ccccc1 1458a_100000186222_100000210623 [0,2,0,0,0,1|1,0,0]=4 18069 B13R1.42 C=CCC(=O)CSc1ccccc1 1458a_100000211596_100000210623 [0,2,0,0,0,1|1,0,0]=4 18070 B13R1.42 C=CCC(=O)NCc1ccccc1 11a_100015324214_100000210193 [0,2,0,0,0,1|1,0,0]=4 18071 B13R1.42 C=CCC(=O)NCc1ccccc1 1626a_100015324214_100000210193 [0,2,0,0,0,1|1,0,0]=4 18072 B13R1.42 C=CCC(=O)NCc1ccccc1 240690a_100015324214_100000210193 [0,2,0,0,0,1|1,0,0]=4 18073 B13R1.42 C=CCC(=O)NCc1ccccc1 527a_100015324214_100000210193 [0,2,0,0,0,1|1,0,0]=4 18074 B13R1.42 C=CCN(C)CCc1ccccc1 2230a_100000207497_100000210623 [0,2,0,0,0,1|1,0,0]=4 18075 B13R1.42 C=CCN(C)CCc1ccccc1 2230a_100000225617_100000765856 [0,2,0,0,0,1|1,0,0]=4 18076 B13R1.42 C=CCN(C)CCc1ccccc1 269982a_100000207497_100000210623 [0,2,0,0,0,1|1,0,0]=4 18077 B13R1.42 C=CCN(C)CCc1ccccc1 269982a_100000225617_100000765856 [0,2,0,0,0,1|1,0,0]=4 18078 B13R1.42 C=CCN(C)CSc1ccccc1 2230a_100000225617_100011218342 [0,2,0,0,0,1|1,0,0]=4 18079 B13R1.42 C=CCN(C)CSc1ccccc1 269982a_100000225617_100011218342 [0,2,0,0,0,1|1,0,0]=4 18080 B13R1.42 C=CC[C@@H](C)OCc1ccccc1 34a_100000731007_100015291786 [0,2,0,0,0,1|0,0,1]=4 18081 B13R1.42 C=CC[C@@H](C)OCc1ccccc1 7a_100000731007_100000211182 [0,2,0,0,0,1|0,0,1]=4 18082 B13R1.42 C=COC(=O)CNc1ccccc1 34a_100000106764_100000036128 [0,2,0,0,0,1|1,0,0]=4 18083 B13R1.42 C=COC(=O)COc1ccccc1 34a_100000210340_100000036128 [0,2,0,0,0,1|1,0,0]=4 18084 B13R1.42 C=COC(=O)CSc1ccccc1 62a_100000036128_100000041952 [0,2,0,0,0,1|1,0,0]=4 18085 B13R1.42 C=COC(=O)CSc1ccccc1 62a_100000719477_100000036128 [0,2,0,0,0,1|1,0,0]=4 18086 B13R1.42 CC#CC(=O)CCc1ccccc1 1458a_100000763181_100000765856 [0,2,0,0,0,1|1,0,0]=4 18087 B13R1.42 CC=CC(=NNc1ccccc1)C 4a_100015195140_100011218416 [0,2,0,0,0,1|1,0,0]=4 18088 B13R1.42 CC=CC(=O)CCc1ccccc1 1458a_100000210699_100000765856 [0,2,0,0,0,1|1,0,0]=4 18089 B13R1.42 CC=CC(=O)NCc1ccccc1 11a_100015324214_100000210699 [0,2,0,0,0,1|1,0,0]=4 18090 B13R1.42 CC=CC(=O)NCc1ccccc1 1626a_100015324214_100000210699 [0,2,0,0,0,1|1,0,0]=4 18091 B13R1.42 CC=CC(=O)NCc1ccccc1 240690a_100015324214_100000210699 [0,2,0,0,0,1|1,0,0]=4 18092 B13R1.42 CCCC(=O)CCc1ccccc1 1458a_100000185753_100000210303 [0,2,0,0,0,1|1,0,0]=4 18093 B13R1.42 CCCC(=O)CCc1ccccc1 1458a_100000211992_100000765856 [0,2,0,0,0,1|1,0,0]=4 18094 B13R1.42 CCCC(=O)COc1ccccc1 1458a_100000186222_100000210303 [0,2,0,0,0,1|1,0,0]=4 18095 B13R1.42 CCCC(=O)COc1ccccc1 7a_100000210340_100000747444 [0,2,0,0,0,1|1,0,0]=4 18096 B13R1.42 CCCC(=O)CSc1ccccc1 1458a_100000211596_100000210303 [0,2,0,0,0,1|1,0,0]=4 18097 B13R1.42 CCCC(=O)CSc1ccccc1 62a_100000719477_100000747444 [0,2,0,0,0,1|1,0,0]=4 18098 B13R1.42 CCCC(=O)CSc1ccccc1 62a_100000747444_100000041952 [0,2,0,0,0,1|1,0,0]=4 18099 B13R1.42 CCCC(=O)NCc1ccccc1 11a_100015324214_100000211992 [0,2,0,0,0,1|1,0,0]=4 18100 B13R1.42 CCCC(=O)NCc1ccccc1 1626a_100015324214_100000211992 [0,2,0,0,0,1|1,0,0]=4 18101 B13R1.42 CCCC(=O)NCc1ccccc1 240690a_100015324214_100000211992 [0,2,0,0,0,1|1,0,0]=4 18102 B13R1.42 CCCC(=O)NCc1ccccc1 527a_100015324214_100000211992 [0,2,0,0,0,1|1,0,0]=4 18103 B13R1.42 CCNC(=O)CCc1ccccc1 11a_100015525214_100000185753 [0,2,0,0,0,1|1,0,0]=4 18104 B13R1.42 CCNC(=O)CCc1ccccc1 240690a_100015525214_100000185753 [0,2,0,0,0,1|1,0,0]=4 18105 B13R1.42 CCNC(=O)CCc1ccccc1 527a_100015525214_100000185753 [0,2,0,0,0,1|1,0,0]=4 18106 B13R1.42 CCNC(=O)CNc1ccccc1 34a_100000106764_100000183381 [0,2,0,0,0,1|1,0,0]=4 18107 B13R1.42 CCNC(=O)COc1ccccc1 11a_100015525214_100000186222 [0,2,0,0,0,1|1,0,0]=4 18108 B13R1.42 CCNC(=O)COc1ccccc1 240690a_100015525214_100000186222 [0,2,0,0,0,1|1,0,0]=4 18109 B13R1.42 CCNC(=O)COc1ccccc1 34a_100000210340_100000183381 [0,2,0,0,0,1|1,0,0]=4 18110 B13R1.42 CCNC(=O)COc1ccccc1 527a_100015525214_100000186222 [0,2,0,0,0,1|1,0,0]=4 18111 B13R1.42 CCNC(=O)COc1ccccc1 7a_100000210340_100000183381 [0,2,0,0,0,1|1,0,0]=4 18112 B13R1.42 CCNC(=O)CSc1ccccc1 11a_100015525214_100000211596 [0,2,0,0,0,1|1,0,0]=4 18113 B13R1.42 CCNC(=O)CSc1ccccc1 240690a_100015525214_100000211596 [0,2,0,0,0,1|1,0,0]=4 18114 B13R1.42 CCNC(=O)CSc1ccccc1 527a_100015525214_100000211596 [0,2,0,0,0,1|1,0,0]=4 18115 B13R1.42 CCNC(=O)CSc1ccccc1 62a_100000183381_100000041952 [0,2,0,0,0,1|1,0,0]=4 18116 B13R1.42 CCNC(=O)CSc1ccccc1 62a_100000719477_100000183381 [0,2,0,0,0,1|1,0,0]=4 18117 B13R1.42 CCNC(=O)NCc1ccccc1 2708a_100015324214_100015525214 [0,2,0,0,0,1|1,0,0]=4 18118 B13R1.42 CCNC(=O)NCc1ccccc1 2708a_100015525214_100015324214 [0,2,0,0,0,1|1,0,0]=4 18119 B13R1.42 CCNC(=O)NCc1ccccc1 273464a_100015324214_100015525214 [0,2,0,0,0,1|1,0,0]=4 18120 B13R1.42 CCNC(=O)NCc1ccccc1 273464a_100015525214_100015324214 [0,2,0,0,0,1|1,0,0]=4 18121 B13R1.42 CCNC(=O)NCc1ccccc1 512a_100015324214_100015525214 [0,2,0,0,0,1|1,0,0]=4 18122 B13R1.42 CCNC(=O)NCc1ccccc1 512a_100015525214_100015324214 [0,2,0,0,0,1|1,0,0]=4 18123 B13R1.42 CCOC(=O)CNc1ccccc1 34a_100000106764_100000188475 [0,2,0,0,0,1|1,0,0]=4 18124 B13R1.42 CCOC(=O)COc1ccccc1 34a_100000210340_100000188475 [0,2,0,0,0,1|1,0,0]=4 18125 B13R1.42 CCOC(=O)COc1ccccc1 7a_100000210340_100000188475 [0,2,0,0,0,1|1,0,0]=4 18126 B13R1.42 CCOC(=O)CSc1ccccc1 62a_100000188475_100000041952 [0,2,0,0,0,1|1,0,0]=4 18127 B13R1.42 CCOC(=O)CSc1ccccc1 62a_100000719477_100000188475 [0,2,0,0,0,1|1,0,0]=4 18128 B13R1.42 CN(CC=O)CCc1ccccc1 2230a_100000207497_200015260668 [0,2,0,0,0,1|1,0,0]=4 18129 B13R1.42 CN(CC=O)CCc1ccccc1 269982a_100000207497_200015260668 [0,2,0,0,0,1|1,0,0]=4 18130 B13R1.42 CNCC(=O)CCc1ccccc1 2230a_106832991635_100012361361 [0,2,0,0,0,1|1,0,0]=4 18131 B13R1.42 CNCC(=O)CCc1ccccc1 34a_100102657272_100012361361 [0,2,0,0,0,1|1,0,0]=4 18132 B13R1.42 CNCC(=O)CCc1ccccc1 7a_106832991635_100012361361 [0,2,0,0,0,1|1,0,0]=4 18133 B13R1.42 CNCC(=O)NCc1ccccc1 2230a_100000739245_200000210301 [0,2,0,0,0,1|1,0,0]=4 18134 B13R1.42 CNCC(=O)NCc1ccccc1 2230a_106832991635_100000183539 [0,2,0,0,0,1|1,0,0]=4 18135 B13R1.42 CNCC(=O)NCc1ccccc1 34a_100102657272_100000183539 [0,2,0,0,0,1|1,0,0]=4 18136 B13R1.42 CNCC(=O)NCc1ccccc1 7a_106832991635_100000183539 [0,2,0,0,0,1|1,0,0]=4 18137 B13R1.42 CNCC(=O)OCc1ccccc1 2230a_106832991635_100000753625 [0,2,0,0,0,1|1,0,0]=4 18138 B13R1.42 CNCC(=O)OCc1ccccc1 34a_100102657272_100000753625 [0,2,0,0,0,1|1,0,0]=4 18139 B13R1.42 CNCC(=O)OCc1ccccc1 7a_106832991635_100000753625 [0,2,0,0,0,1|1,0,0]=4 18140 B13R1.42 CNNC(=O)CCc1ccccc1 22a_100016993582_100000185753 [0,2,0,0,0,1|1,0,0]=4 18141 B13R1.42 CNNC(=O)COc1ccccc1 22a_100016993582_100000186222 [0,2,0,0,0,1|1,0,0]=4 18142 B13R1.42 CNNC(=O)CSc1ccccc1 22a_100016993582_100000211596 [0,2,0,0,0,1|1,0,0]=4 18143 B13R1.42 CNNC(=O)NCc1ccccc1 273464a_100015324214_100016993582 [0,2,0,0,0,1|1,0,0]=4 18144 B13R1.42 CNNC(=O)NCc1ccccc1 512a_100015324214_100016993582 [0,2,0,0,0,1|1,0,0]=4 18145 B13R1.42 CNNC(=O)NCc1ccccc1 512a_100016993582_100015324214 [0,2,0,0,0,1|1,0,0]=4 18146 B13R1.42 COCC(=O)CCc1ccccc1 1458a_100000210968_100000765856 [0,2,0,0,0,1|1,0,0]=4 18147 B13R1.42 COCC(=O)CCc1ccccc1 34a_100138415774_100012361361 [0,2,0,0,0,1|1,0,0]=4 18148 B13R1.42 COCC(=O)NCc1ccccc1 11a_100015324214_100000210968 [0,2,0,0,0,1|1,0,0]=4 18149 B13R1.42 COCC(=O)NCc1ccccc1 1626a_100015324214_100000210968 [0,2,0,0,0,1|1,0,0]=4 18150 B13R1.42 COCC(=O)NCc1ccccc1 240690a_100015324214_100000210968 [0,2,0,0,0,1|1,0,0]=4 18151 B13R1.42 COCC(=O)NCc1ccccc1 34a_100138415774_100000183539 [0,2,0,0,0,1|1,0,0]=4 18152 B13R1.42 COCC(=O)NCc1ccccc1 527a_100015324214_100000210968 [0,2,0,0,0,1|1,0,0]=4 18153 B13R1.42 COCC(=O)OCc1ccccc1 34a_100138415774_100000753625 [0,2,0,0,0,1|1,0,0]=4 18154 B13R1.42 CSCC(=O)CCc1ccccc1 1458a_100000184570_100000765856 [0,2,0,0,0,1|1,0,0]=4 18155 B13R1.42 CSCC(=O)CCc1ccccc1 62a_100012361361_200000210301 [0,2,0,0,0,1|1,0,0]=4 18156 B13R1.42 CSCC(=O)CCc1ccccc1 62a_200000210301_100012361361 [0,2,0,0,0,1|1,0,0]=4 18157 B13R1.42 CSCC(=O)NCc1ccccc1 11a_100015324214_100000184570 [0,2,0,0,0,1|1,0,0]=4 18158 B13R1.42 CSCC(=O)NCc1ccccc1 1626a_100015324214_100000184570 [0,2,0,0,0,1|1,0,0]=4 18159 B13R1.42 CSCC(=O)NCc1ccccc1 240690a_100015324214_100000184570 [0,2,0,0,0,1|1,0,0]=4 18160 B13R1.42 CSCC(=O)NCc1ccccc1 527a_100015324214_100000184570 [0,2,0,0,0,1|1,0,0]=4 18161 B13R1.42 CSCC(=O)NCc1ccccc1 62a_100000183539_200000210301 [0,2,0,0,0,1|1,0,0]=4 18162 B13R1.42 CSCC(=O)NCc1ccccc1 62a_200000210301_100000183539 [0,2,0,0,0,1|1,0,0]=4 18163 B13R1.42 CSCC(=O)OCc1ccccc1 62a_100000753625_200000210301 [0,2,0,0,0,1|1,0,0]=4 18164 B13R1.42 CSCC(=O)OCc1ccccc1 62a_200000210301_100000753625 [0,2,0,0,0,1|1,0,0]=4 18165 B13R1.42 N#CCC(=O)CCc1ccccc1 1458a_100000185753_100011214920 [0,2,0,0,0,1|1,0,0]=4 18166 B13R1.42 N#CCC(=O)CCc1ccccc1 1458a_100051588842_100000765856 [0,2,0,0,0,1|1,0,0]=4 18167 B13R1.42 N#CCC(=O)COc1ccccc1 1458a_100000186222_100011214920 [0,2,0,0,0,1|1,0,0]=4 18168 B13R1.42 N#CCC(=O)CSc1ccccc1 1458a_100000211596_100011214920 [0,2,0,0,0,1|1,0,0]=4 18169 B13R1.42 N#CCC(=O)NCc1ccccc1 1626a_100015324214_100051588842 [0,2,0,0,0,1|1,0,0]=4 18170 B13R1.42 N#CCC(=O)NCc1ccccc1 240690a_100015324214_100051588842 [0,2,0,0,0,1|1,0,0]=4 18171 B13R1.42 O=C(C=CBr)CCc1ccccc1 1458a_100016273825_100000765856 [0,2,0,0,0,1|1,0,0]=4 18172 B13R1.42 O=C(C=CBr)NCc1ccccc1 1626a_100015324214_100016273825 [0,2,0,0,0,1|1,0,0]=4 18173 B13R1.42 O=C(C=CBr)NCc1ccccc1 240690a_100015324214_100016273825 [0,2,0,0,0,1|1,0,0]=4 18174 B13R1.42 O=C(C=CCl)CCc1ccccc1 1458a_200016279998_100000765856 [0,2,0,0,0,1|1,0,0]=4 18175 B13R1.42 O=C(C=CCl)NCc1ccccc1 11a_100015324214_200016279998 [0,2,0,0,0,1|1,0,0]=4 18176 B13R1.42 O=C(C=CCl)NCc1ccccc1 1626a_100015324214_200016279998 [0,2,0,0,0,1|1,0,0]=4 18177 B13R1.42 O=C(C=CCl)NCc1ccccc1 240690a_100015324214_200016279998 [0,2,0,0,0,1|1,0,0]=4 18178 B13R1.42 O=C(C=CI)CCc1ccccc1 1458a_100016256311_100000765856 [0,2,0,0,0,1|1,0,0]=4 18179 B13R1.42 O=C(C=CI)NCc1ccccc1 1626a_100015324214_100016256311 [0,2,0,0,0,1|1,0,0]=4 18180 B13R1.42 O=C(CCF)CCc1ccccc1 1458a_100000185753_100011217306 [0,2,0,0,0,1|1,0,0]=4 18181 B13R1.42 O=C(CCF)COc1ccccc1 1458a_100000186222_100011217306 [0,2,0,0,0,1|1,0,0]=4 18182 B13R1.42 O=C(CCF)CSc1ccccc1 1458a_100000211596_100011217306 [0,2,0,0,0,1|1,0,0]=4 18183 B13R1.42 O=C(CCO)CCc1ccccc1 1458a_100000185753_100000211926 [0,2,0,0,0,1|1,0,0]=4 18184 B13R1.42 O=C(CCO)CCc1ccccc1 1458a_100011216618_100000765856 [0,2,0,0,0,1|1,0,0]=4 18185 B13R1.42 O=C(CCO)COc1ccccc1 1458a_100000186222_100000211926 [0,2,0,0,0,1|1,0,0]=4 18186 B13R1.42 O=C(CCO)CSc1ccccc1 1458a_100000211596_100000211926 [0,2,0,0,0,1|1,0,0]=4 18187 B13R1.42 O=C(CCO)NCc1ccccc1 240690a_100015324214_100011216618 [0,2,0,0,0,1|1,0,0]=4 18188 B13R1.42 O=C(CNc1ccccc1)NCO 34a_100000106764_100000185155 [0,2,0,0,0,1|1,0,0]=4 18189 B13R1.42 O=C(COc1ccccc1)NCO 34a_100000210340_100000185155 [0,2,0,0,0,1|1,0,0]=4 18190 B13R1.42 O=C(COc1ccccc1)NCO 7a_100000210340_100000185155 [0,2,0,0,0,1|1,0,0]=4 18191 B13R1.42 O=C(CSc1ccccc1)NCO 62a_100000185155_100000041952 [0,2,0,0,0,1|1,0,0]=4 18192 B13R1.42 O=C(CSc1ccccc1)NCO 62a_100000719477_100000185155 [0,2,0,0,0,1|1,0,0]=4 18193 B13R1.42 [13CH3]NCC(=O)NCc1ccccc1 2230a_100000739245_200025704644 [0,2,0,0,0,1|1,0,0]=4 18194 B13R1.42 [13CH3]SCC(=O)CCc1ccccc1 62a_100012361361_200025704644 [0,2,0,0,0,1|1,0,0]=4 18195 B13R1.42 [13CH3]SCC(=O)CCc1ccccc1 62a_200025704644_100012361361 [0,2,0,0,0,1|1,0,0]=4 18196 B13R1.42 [13CH3]SCC(=O)NCc1ccccc1 62a_100000183539_200025704644 [0,2,0,0,0,1|1,0,0]=4 18197 B13R1.42 [13CH3]SCC(=O)NCc1ccccc1 62a_200025704644_100000183539 [0,2,0,0,0,1|1,0,0]=4 18198 B13R1.42 [13CH3]SCC(=O)OCc1ccccc1 62a_100000753625_200025704644 [0,2,0,0,0,1|1,0,0]=4 18199 B13R1.42 [13CH3]SCC(=O)OCc1ccccc1 62a_200025704644_100000753625 [0,2,0,0,0,1|1,0,0]=4 18200 B13R1.135 C/C=C(\C)/C(=O)Cc1ccccc1 1458a_100020587367_100015291786 [0,2,0,0,0,1|0,0,0]=3 18201 B13R1.135 C/C=C(\C)/C(=O)Cc1ccccn1 1458a_100020587367_100000721315 [0,2,0,0,0,1|1,0,0]=4 18202 B13R1.135 C/C=C(\C)/C(=O)Cc1cccnc1 1458a_100020587367_100000733263 [0,2,0,0,0,1|1,0,0]=4 18203 B13R1.135 C/C=C(\C)/C(=O)Cc1ccncc1 1458a_100020587367_100000705612 [0,2,0,0,0,1|1,0,0]=4 18204 B13R1.135 C/C=C(\C)/C(=O)Nc1ccccc1 11a_100000106764_100020587367 [0,2,0,0,0,1|0,0,1]=4 18205 B13R1.135 C/C=C(\C)/C(=O)Nc1ccccc1 1626a_100000106764_100020587367 [0,2,0,0,0,1|0,0,1]=4 18206 B13R1.135 C/C=C(\C)/C(=O)Nc1ccccc1 22a_100000106764_100020587367 [0,2,0,0,0,1|0,0,1]=4 18207 B13R1.135 C=C(CO)C(=O)Nc1ccccc1 22a_100000106764_200000705526 [0,2,0,0,0,1|0,0,1]=4 18208 B13R1.135 C=C(Cc1ccccc1)C(=O)NC 11a_106832991635_100000066491 [0,2,0,0,0,1|1,0,0]=4 18209 B13R1.135 C=C(Cc1ccccc1)C(=O)NC 1626a_100102657272_100000066491 [0,2,0,0,0,1|1,0,0]=4 18210 B13R1.135 C=CC(=O)C(C)Cc1ccccc1 1458a_100000185746_200011218536 [0,2,0,0,0,1|1,0,0]=4 18211 B13R1.135 C=CC(=O)N(C)Cc1ccccc1 1626a_100000186898_100000185746 [0,2,0,0,0,1|1,0,0]=4 18212 B13R1.135 C=CC(=O)N(C)Cc1ccccc1 240690a_100000186898_200121576911 [0,2,0,0,0,1|1,0,0]=4 18213 B13R1.135 C=CC(C)C(=O)Cc1ccccc1 1458a_100011216780_100015291786 [0,2,0,0,0,1|0,0,1]=4 18214 B13R1.135 C=CC(C)N(C)Cc1ccccc1 269982a_100000186898_100011215867 [0,2,0,0,0,1|0,0,1]=4 18215 B13R1.135 CC(Cc1ccccc1)C(=O)CF 1458a_100000754839_100015361967 [0,2,0,0,0,1|1,0,0]=4 18216 B13R1.135 CC(Cc1ccccc1)C(=O)CO 1458a_100000210174_200011218536 [0,2,0,0,0,1|1,0,0]=4 18217 B13R1.135 CC(Oc1ccccc1)C(=O)CF 1458a_100000188414_100015361967 [0,2,0,0,0,1|1,0,0]=4 18218 B13R1.135 CC(Sc1ccccc1)C(=O)CF 1458a_100000199063_100015361967 [0,2,0,0,0,1|1,0,0]=4 18219 B13R1.135 CCC(=O)C(C)Cc1ccccc1 1458a_100000210414_200011218536 [0,2,0,0,0,1|1,0,0]=4 18220 B13R1.135 CCC(=O)C(C)Cc1ccccc1 1458a_100000754839_100000210202 [0,2,0,0,0,1|1,0,0]=4 18221 B13R1.135 CCC(=O)C(C)Oc1ccccc1 1458a_100000188414_100000210202 [0,2,0,0,0,1|1,0,0]=4 18222 B13R1.135 CCC(=O)C(C)Oc1ccccc1 7a_100000210340_100000742827 [0,2,0,0,0,1|1,0,0]=4 18223 B13R1.135 CCC(=O)C(C)Sc1ccccc1 1458a_100000199063_100000210202 [0,2,0,0,0,1|1,0,0]=4 18224 B13R1.135 CCC(=O)C(C)Sc1ccccc1 62a_100000719477_100000742827 [0,2,0,0,0,1|1,0,0]=4 18225 B13R1.135 CCC(=O)C(C)Sc1ccccc1 62a_100000742827_100000041952 [0,2,0,0,0,1|1,0,0]=4 18226 B13R1.135 CCC(=O)N(C)Cc1ccccc1 11a_100000186898_100000210414 [0,2,0,0,0,1|1,0,0]=4 18227 B13R1.135 CCC(=O)N(C)Cc1ccccc1 1626a_100000186898_100000210414 [0,2,0,0,0,1|1,0,0]=4 18228 B13R1.135 CCC(=O)N(C)Cc1ccccc1 240690a_100000186898_100000210414 [0,2,0,0,0,1|1,0,0]=4 18229 B13R1.135 CCC(=O)N(C)Cc1ccccc1 527a_100000186898_100000210414 [0,2,0,0,0,1|1,0,0]=4 18230 B13R1.135 CCC(=O)[C@H](O)Cc1ccccc1 1458a_100009816399_100000210202 [0,2,0,0,0,1|1,0,0]=4 18231 B13R1.135 CN(Cc1ccccc1)C(=O)CO 240690a_100000186898_100000210174 [0,2,0,0,0,1|1,0,0]=4 18232 B13R1.135 CN(Cc1ccccc1)C(=O)CO 527a_100000186898_100000210174 [0,2,0,0,0,1|1,0,0]=4 18233 B13R1.135 CNC(=O)C(=O)Cc1ccccc1 1458a_100011218921_100015291786 [0,2,0,0,0,1|1,0,0]=4 18234 B13R1.135 CNC(=O)C(C)Cc1ccccc1 11a_106832991635_100000754839 [0,2,0,0,0,1|1,0,0]=4 18235 B13R1.135 CNC(=O)C(C)Cc1ccccc1 1626a_100102657272_100000754839 [0,2,0,0,0,1|1,0,0]=4 18236 B13R1.135 CNC(=O)C(C)Cc1ccccc1 240690a_100102657272_100000754839 [0,2,0,0,0,1|1,0,0]=4 18237 B13R1.135 CNC(=O)C(C)Cc1ccccc1 527a_100102657272_100000754839 [0,2,0,0,0,1|1,0,0]=4 18238 B13R1.135 CNC(=O)C(C)Nc1ccccc1 34a_100000106764_100000731044 [0,2,0,0,0,1|1,0,0]=4 18239 B13R1.135 CNC(=O)C(C)Oc1ccccc1 11a_106832991635_100000188414 [0,2,0,0,0,1|1,0,0]=4 18240 B13R1.135 CNC(=O)C(C)Oc1ccccc1 1626a_100102657272_100000188414 [0,2,0,0,0,1|1,0,0]=4 18241 B13R1.135 CNC(=O)C(C)Oc1ccccc1 240690a_100102657272_100000188414 [0,2,0,0,0,1|1,0,0]=4 18242 B13R1.135 CNC(=O)C(C)Oc1ccccc1 34a_100000210340_100000731044 [0,2,0,0,0,1|1,0,0]=4 18243 B13R1.135 CNC(=O)C(C)Oc1ccccc1 527a_100102657272_100000188414 [0,2,0,0,0,1|1,0,0]=4 18244 B13R1.135 CNC(=O)C(C)Oc1ccccc1 7a_100000210340_100000209862 [0,2,0,0,0,1|1,0,0]=4 18245 B13R1.135 CNC(=O)C(C)Sc1ccccc1 11a_106832991635_100000199063 [0,2,0,0,0,1|1,0,0]=4 18246 B13R1.135 CNC(=O)C(C)Sc1ccccc1 1626a_100102657272_100000199063 [0,2,0,0,0,1|1,0,0]=4 18247 B13R1.135 CNC(=O)C(C)Sc1ccccc1 240690a_100102657272_100000199063 [0,2,0,0,0,1|1,0,0]=4 18248 B13R1.135 CNC(=O)C(C)Sc1ccccc1 527a_100102657272_100000199063 [0,2,0,0,0,1|1,0,0]=4 18249 B13R1.135 CNC(=O)C(C)Sc1ccccc1 62a_100000209862_100000041952 [0,2,0,0,0,1|1,0,0]=4 18250 B13R1.135 CNC(=O)C(C)Sc1ccccc1 62a_100000719477_100000731044 [0,2,0,0,0,1|1,0,0]=4 18251 B13R1.135 CNC(=O)C(F)Nc1ccccc1 34a_100000106764_100009813575 [0,2,0,0,0,1|1,0,0]=4 18252 B13R1.135 CNC(=O)C(F)Oc1ccccc1 34a_100000210340_100009813575 [0,2,0,0,0,1|1,0,0]=4 18253 B13R1.135 CNC(=O)C(F)Oc1ccccc1 7a_100000210340_100009813575 [0,2,0,0,0,1|1,0,0]=4 18254 B13R1.135 CNC(=O)C(F)Sc1ccccc1 62a_100000719477_100009813575 [0,2,0,0,0,1|1,0,0]=4 18255 B13R1.135 CNC(=O)C(F)Sc1ccccc1 62a_100009813575_100000041952 [0,2,0,0,0,1|1,0,0]=4 18256 B13R1.135 CNC(=O)N(C)Cc1ccccc1 2708a_100102657272_100000186898 [0,2,0,0,0,1|1,0,0]=4 18257 B13R1.135 CNC(=O)N(C)Cc1ccccc1 273464a_100102657272_100000186898 [0,2,0,0,0,1|1,0,0]=4 18258 B13R1.135 CNC(=O)[C@H](O)Cc1ccccc1 240690a_100102657272_100009816399 [0,2,0,0,0,1|1,0,0]=4 18259 B13R1.135 COC(=O)C(C)Nc1ccccc1 34a_100000106764_100000211248 [0,2,0,0,0,1|1,0,0]=4 18260 B13R1.135 COC(=O)C(C)Oc1ccccc1 34a_100000210340_100000211248 [0,2,0,0,0,1|1,0,0]=4 18261 B13R1.135 COC(=O)C(C)Oc1ccccc1 7a_100000210340_100000211248 [0,2,0,0,0,1|1,0,0]=4 18262 B13R1.135 COC(=O)C(C)Sc1ccccc1 62a_100000211248_100000041952 [0,2,0,0,0,1|1,0,0]=4 18263 B13R1.135 COC(=O)C(C)Sc1ccccc1 62a_100000719477_100000211248 [0,2,0,0,0,1|1,0,0]=4 18264 B13R1.135 O=C(CF)[C@H](O)Cc1ccccc1 1458a_100009816399_100015361967 [0,2,0,0,0,1|1,0,0]=4 18265 B13R1.254 C=CC(C)(C)OCc1ccccc1 34a_100011215311_100015291786 [0,2,0,0,0,1|0,0,1]=4 18266 B13R1.254 C=CC(C)(C)OCc1ccccc1 7a_100011215311_100000211182 [0,2,0,0,0,1|0,0,1]=4 18267 B13R1.254 C=C[Si](C)(C)CSc1ccccc1 62a_100000038793_100000041952 [0,2,0,0,0,1|0,1,0]=4 18268 B13R1.254 C=C[Si](C)(C)CSc1ccccc1 62a_100000719477_100000038793 [0,2,0,0,0,1|0,1,0]=4 18269 B13R1.417 C=CC(=NNc1ccccc1)CC 4a_100015195140_100000747743 [0,2,0,0,0,1|1,0,0]=4 18270 B13R1.417 C=CC(CC)OCc1ccccc1 34a_100000766422_100015291786 [0,2,0,0,0,1|0,0,1]=4 18271 B13R1.417 C=CC(CC)OCc1ccccc1 7a_100000766422_100000211182 [0,2,0,0,0,1|0,0,1]=4 18272 B13R1.417 C=C[C@@H](CO)NCc1ccccc1 2230a_100016989147_100015291786 [0,2,0,0,0,1|0,0,1]=4 18273 B13R1.417 C=C[C@@H](CO)NCc1ccccc1 270004a_100016989147_100015611070 [0,2,0,0,0,1|0,0,1]=4 18274 B13R1.417 C=C[C@@H](CO)NCc1ccccc1 34a_100016989147_100015291786 [0,2,0,0,0,1|0,0,1]=4 18275 B13R1.528 C=C(C#N)CNc1ccccc1Br 34a_100000210017_100000694840 [0,2,0,0,0,1|0,0,1]=4 18276 B13R1.528 C=C(C#N)CNc1ccccc1C 34a_100015192222_100000694840 [0,2,0,0,0,1|0,0,1]=4 18277 B13R1.528 C=C(C#N)CNc1ccccc1Cl 34a_100000185783_100000694840 [0,2,0,0,0,1|0,0,1]=4 18278 B13R1.528 C=C(C#N)CNc1ccccc1F 34a_100000210422_100000694840 [0,2,0,0,0,1|0,0,1]=4 18279 B13R1.528 C=C(C#N)CNc1ccccc1I 34a_100000210053_100000694840 [0,2,0,0,0,1|0,0,1]=4 18280 B13R1.528 C=C(C#N)CNc1ccccc1O 34a_100000185747_100000694840 [0,2,0,0,0,1|0,0,1]=4 18281 B13R1.528 C=C(C#N)COc1ccccc1Br 34a_100000181306_100000694840 [0,2,0,0,0,1|0,0,1]=4 18282 B13R1.528 C=C(C#N)COc1ccccc1C 34a_100000210338_100000694840 [0,2,0,0,0,1|0,0,1]=4 18283 B13R1.528 C=C(C#N)COc1ccccc1Cl 34a_100000210172_100000694840 [0,2,0,0,0,1|0,0,1]=4 18284 B13R1.528 C=C(C#N)COc1ccccc1F 34a_100000210171_100000694840 [0,2,0,0,0,1|0,0,1]=4 18285 B13R1.528 C=C(C#N)COc1ccccc1I 34a_100000739446_100000694840 [0,2,0,0,0,1|0,0,1]=4 18286 B13R1.528 C=C(C#N)COc1ccccc1N 34a_100000185747_100000694840 [0,2,0,0,0,1|0,0,1]=4 18287 B13R1.528 C=C(C#N)CSc1ccccc1Br 62a_100000695589_100000694840 [0,2,0,0,0,1|0,0,1]=4 18288 B13R1.528 C=C(C#N)CSc1ccccc1C 62a_100000210755_100000694840 [0,2,0,0,0,1|0,0,1]=4 18289 B13R1.528 C=C(C#N)CSc1ccccc1Cl 62a_100000764095_100000694840 [0,2,0,0,0,1|0,0,1]=4 18290 B13R1.528 C=C(C#N)CSc1ccccc1F 62a_100011215700_100000694840 [0,2,0,0,0,1|0,0,1]=4 18291 B13R1.528 C=C(C#N)CSc1ccccc1N 62a_100000210017_100000694840 [0,2,0,0,0,1|0,0,1]=4 18292 B13R1.528 C=C(C#N)CSc1ccccc1O 62a_100000739446_100000694840 [0,2,0,0,0,1|0,0,1]=4 18293 B13R1.528 C=CC(=NNc1ccccc1Br)C 4a_100000241748_200015361842 [0,2,0,0,0,1|1,0,0]=4 18294 B13R1.528 C=CC(=NNc1ccccc1C)C 4a_100000184220_200015361842 [0,2,0,0,0,1|1,0,0]=4 18295 B13R1.528 C=CC(=NNc1ccccc1Cl)C 4a_100000683529_200015361842 [0,2,0,0,0,1|1,0,0]=4 18296 B13R1.528 C=CC(=NNc1ccccc1F)C 4a_100000239246_200015361842 [0,2,0,0,0,1|1,0,0]=4 18297 B13R1.528 C=CC(=NNc1ccccc1I)C 4a_100011218156_200015361842 [0,2,0,0,0,1|1,0,0]=4 18298 B13R1.528 C=CC(=O)CCc1ccccc1Br 1458a_100000185746_100012161201 [0,2,0,0,0,1|1,0,0]=4 18299 B13R1.528 C=CC(=O)CCc1ccccc1C 1458a_100000185746_100011713688 [0,2,0,0,0,1|1,0,0]=4 18300 B13R1.528 C=CC(=O)CCc1ccccc1Cl 1458a_100000185746_100011713703 [0,2,0,0,0,1|1,0,0]=4 18301 B13R1.528 C=CC(=O)CCc1ccccc1F 1458a_100000185746_100000720011 [0,2,0,0,0,1|1,0,0]=4 18302 B13R1.528 C=CC(=O)CCc1ccccc1O 1458a_100000185746_100000722297 [0,2,0,0,0,1|1,0,0]=4 18303 B13R1.528 C=CC(=O)NCc1ccccc1Br 1626a_100000689332_100000185746 [0,2,0,0,0,1|1,0,0]=4 18304 B13R1.528 C=CC(=O)NCc1ccccc1Br 240690a_100000689332_200121576911 [0,2,0,0,0,1|1,0,0]=4 18305 B13R1.528 C=CC(=O)NCc1ccccc1C 1626a_100000174972_100000185746 [0,2,0,0,0,1|1,0,0]=4 18306 B13R1.528 C=CC(=O)NCc1ccccc1C 240690a_100000174972_200121576911 [0,2,0,0,0,1|1,0,0]=4 18307 B13R1.528 C=CC(=O)NCc1ccccc1Cl 1626a_100000174879_100000185746 [0,2,0,0,0,1|1,0,0]=4 18308 B13R1.528 C=CC(=O)NCc1ccccc1Cl 240690a_100000174879_200121576911 [0,2,0,0,0,1|1,0,0]=4 18309 B13R1.528 C=CC(=O)NCc1ccccc1F 1626a_100000174869_100000185746 [0,2,0,0,0,1|1,0,0]=4 18310 B13R1.528 C=CC(=O)NCc1ccccc1F 240690a_100000174869_200121576911 [0,2,0,0,0,1|1,0,0]=4 18311 B13R1.528 C=CC(=O)NCc1ccccc1I 1626a_100015347259_100000185746 [0,2,0,0,0,1|1,0,0]=4 18312 B13R1.528 C=CC(=O)NCc1ccccc1I 240690a_100015347259_200121576911 [0,2,0,0,0,1|1,0,0]=4 18313 B13R1.528 C=CC(=O)NCc1ccccc1O 240690a_100000185550_200121576911 [0,2,0,0,0,1|1,0,0]=4 18314 B13R1.528 C=CC(C)OCc1ccccc1Br 34a_100000695699_100000184730 [0,2,0,0,0,1|0,0,1]=4 18315 B13R1.528 C=CC(C)OCc1ccccc1C 34a_100000695699_100000211839 [0,2,0,0,0,1|0,0,1]=4 18316 B13R1.528 C=CC(C)OCc1ccccc1Cl 34a_100000695699_100000187162 [0,2,0,0,0,1|0,0,1]=4 18317 B13R1.528 C=CC(C)OCc1ccccc1F 34a_100000695699_100000211605 [0,2,0,0,0,1|0,0,1]=4 18318 B13R1.528 C=CC(C)OCc1ccccc1I 34a_100000695699_100011215278 [0,2,0,0,0,1|0,0,1]=4 18319 B13R1.528 C=CC(C)SCc1ccccc1Br 62a_100011215867_100000184730 [0,2,0,0,0,1|0,0,1]=4 18320 B13R1.528 C=CC(C)SCc1ccccc1C 62a_100011215867_100000211839 [0,2,0,0,0,1|0,0,1]=4 18321 B13R1.528 C=CC(C)SCc1ccccc1Cl 62a_100011215867_100000187162 [0,2,0,0,0,1|0,0,1]=4 18322 B13R1.528 C=CC(C)SCc1ccccc1F 62a_100011215867_100000211605 [0,2,0,0,0,1|0,0,1]=4 18323 B13R1.528 C=CC(C)SCc1ccccc1I 62a_100011215867_100011216222 [0,2,0,0,0,1|0,0,1]=4 18324 B13R1.528 CCC(=O)CCc1ccccc1Br 1458a_100000210414_100012161201 [0,2,0,0,0,1|1,0,0]=4 18325 B13R1.528 CCC(=O)CCc1ccccc1Br 1458a_100000740810_100000210202 [0,2,0,0,0,1|1,0,0]=4 18326 B13R1.528 CCC(=O)CCc1ccccc1C 1458a_100000210414_100011713688 [0,2,0,0,0,1|1,0,0]=4 18327 B13R1.528 CCC(=O)CCc1ccccc1C 1458a_100000748742_100000210202 [0,2,0,0,0,1|1,0,0]=4 18328 B13R1.528 CCC(=O)CCc1ccccc1Cl 1458a_100000184300_100000210202 [0,2,0,0,0,1|1,0,0]=4 18329 B13R1.528 CCC(=O)CCc1ccccc1Cl 1458a_100000210414_100011713703 [0,2,0,0,0,1|1,0,0]=4 18330 B13R1.528 CCC(=O)CCc1ccccc1F 1458a_100000189703_100000210202 [0,2,0,0,0,1|1,0,0]=4 18331 B13R1.528 CCC(=O)CCc1ccccc1F 1458a_100000210414_100000720011 [0,2,0,0,0,1|1,0,0]=4 18332 B13R1.528 CCC(=O)CCc1ccccc1I 1458a_100000037306_100000210202 [0,2,0,0,0,1|1,0,0]=4 18333 B13R1.528 CCC(=O)CCc1ccccc1O 1458a_100000181328_100000210202 [0,2,0,0,0,1|1,0,0]=4 18334 B13R1.528 CCC(=O)CCc1ccccc1O 1458a_100000210414_100000722297 [0,2,0,0,0,1|1,0,0]=4 18335 B13R1.528 CCC(=O)COc1ccccc1Br 1458a_100000216496_100000210202 [0,2,0,0,0,1|1,0,0]=4 18336 B13R1.528 CCC(=O)COc1ccccc1Br 7a_100000181306_100000747405 [0,2,0,0,0,1|1,0,0]=4 18337 B13R1.528 CCC(=O)COc1ccccc1C 1458a_100000182418_100000210202 [0,2,0,0,0,1|1,0,0]=4 18338 B13R1.528 CCC(=O)COc1ccccc1C 7a_100000210338_100000747405 [0,2,0,0,0,1|1,0,0]=4 18339 B13R1.528 CCC(=O)COc1ccccc1Cl 1458a_100000185159_100000210202 [0,2,0,0,0,1|1,0,0]=4 18340 B13R1.528 CCC(=O)COc1ccccc1Cl 7a_100000210172_100000747405 [0,2,0,0,0,1|1,0,0]=4 18341 B13R1.528 CCC(=O)COc1ccccc1F 1458a_100000182486_100000210202 [0,2,0,0,0,1|1,0,0]=4 18342 B13R1.528 CCC(=O)COc1ccccc1F 7a_100000210171_100000747405 [0,2,0,0,0,1|1,0,0]=4 18343 B13R1.528 CCC(=O)COc1ccccc1I 7a_100000739446_100000747405 [0,2,0,0,0,1|1,0,0]=4 18344 B13R1.528 CCC(=O)COc1ccccc1N 7a_100000185747_100000747405 [0,2,0,0,0,1|1,0,0]=4 18345 B13R1.528 CCC(=O)COc1ccccc1O 1458a_100000183020_100000210202 [0,2,0,0,0,1|1,0,0]=4 18346 B13R1.528 CCC(=O)CSc1ccccc1Br 62a_100000695589_100000747405 [0,2,0,0,0,1|1,0,0]=4 18347 B13R1.528 CCC(=O)CSc1ccccc1Br 62a_100000747405_100000695589 [0,2,0,0,0,1|1,0,0]=4 18348 B13R1.528 CCC(=O)CSc1ccccc1C 1458a_100000183026_100000210202 [0,2,0,0,0,1|1,0,0]=4 18349 B13R1.528 CCC(=O)CSc1ccccc1C 62a_100000210755_100000747405 [0,2,0,0,0,1|1,0,0]=4 18350 B13R1.528 CCC(=O)CSc1ccccc1C 62a_100000747405_100000210755 [0,2,0,0,0,1|1,0,0]=4 18351 B13R1.528 CCC(=O)CSc1ccccc1Cl 62a_100000747405_100000764095 [0,2,0,0,0,1|1,0,0]=4 18352 B13R1.528 CCC(=O)CSc1ccccc1Cl 62a_100000764095_100000747405 [0,2,0,0,0,1|1,0,0]=4 18353 B13R1.528 CCC(=O)CSc1ccccc1F 1458a_100000179528_100000210202 [0,2,0,0,0,1|1,0,0]=4 18354 B13R1.528 CCC(=O)CSc1ccccc1F 62a_100000747405_100011215700 [0,2,0,0,0,1|1,0,0]=4 18355 B13R1.528 CCC(=O)CSc1ccccc1F 62a_100011215700_100000747405 [0,2,0,0,0,1|1,0,0]=4 18356 B13R1.528 CCC(=O)CSc1ccccc1N 62a_100000210017_100000747405 [0,2,0,0,0,1|1,0,0]=4 18357 B13R1.528 CCC(=O)CSc1ccccc1N 62a_100000747405_100000210017 [0,2,0,0,0,1|1,0,0]=4 18358 B13R1.528 CCC(=O)CSc1ccccc1O 1458a_100000695322_100000210202 [0,2,0,0,0,1|1,0,0]=4 18359 B13R1.528 CCC(=O)CSc1ccccc1O 62a_100000739446_100000747405 [0,2,0,0,0,1|1,0,0]=4 18360 B13R1.528 CCC(=O)CSc1ccccc1O 62a_100000747405_100000739446 [0,2,0,0,0,1|1,0,0]=4 18361 B13R1.528 CCC(=O)NCc1ccccc1Br 11a_100000689332_100000210414 [0,2,0,0,0,1|1,0,0]=4 18362 B13R1.528 CCC(=O)NCc1ccccc1Br 1626a_100000689332_100000210414 [0,2,0,0,0,1|1,0,0]=4 18363 B13R1.528 CCC(=O)NCc1ccccc1Br 240690a_100000689332_100000210414 [0,2,0,0,0,1|1,0,0]=4 18364 B13R1.528 CCC(=O)NCc1ccccc1Br 527a_100000689332_100000210414 [0,2,0,0,0,1|1,0,0]=4 18365 B13R1.528 CCC(=O)NCc1ccccc1C 11a_100000174972_100000210414 [0,2,0,0,0,1|1,0,0]=4 18366 B13R1.528 CCC(=O)NCc1ccccc1C 1626a_100000174972_100000210414 [0,2,0,0,0,1|1,0,0]=4 18367 B13R1.528 CCC(=O)NCc1ccccc1C 240690a_100000174972_100000210414 [0,2,0,0,0,1|1,0,0]=4 18368 B13R1.528 CCC(=O)NCc1ccccc1C 527a_100000174972_100000210414 [0,2,0,0,0,1|1,0,0]=4 18369 B13R1.528 CCC(=O)NCc1ccccc1Cl 11a_100000174879_100000210414 [0,2,0,0,0,1|1,0,0]=4 18370 B13R1.528 CCC(=O)NCc1ccccc1Cl 1626a_100000174879_100000210414 [0,2,0,0,0,1|1,0,0]=4 18371 B13R1.528 CCC(=O)NCc1ccccc1Cl 240690a_100000174879_100000210414 [0,2,0,0,0,1|1,0,0]=4 18372 B13R1.528 CCC(=O)NCc1ccccc1Cl 527a_100000174879_100000210414 [0,2,0,0,0,1|1,0,0]=4 18373 B13R1.528 CCC(=O)NCc1ccccc1F 11a_100000174869_100000210414 [0,2,0,0,0,1|1,0,0]=4 18374 B13R1.528 CCC(=O)NCc1ccccc1F 1626a_100000174869_100000210414 [0,2,0,0,0,1|1,0,0]=4 18375 B13R1.528 CCC(=O)NCc1ccccc1F 240690a_100000174869_100000210414 [0,2,0,0,0,1|1,0,0]=4 18376 B13R1.528 CCC(=O)NCc1ccccc1F 527a_100000174869_100000210414 [0,2,0,0,0,1|1,0,0]=4 18377 B13R1.528 CCC(=O)NCc1ccccc1I 11a_100015347259_100000210414 [0,2,0,0,0,1|1,0,0]=4 18378 B13R1.528 CCC(=O)NCc1ccccc1I 1626a_100015347259_100000210414 [0,2,0,0,0,1|1,0,0]=4 18379 B13R1.528 CCC(=O)NCc1ccccc1I 240690a_100015347259_100000210414 [0,2,0,0,0,1|1,0,0]=4 18380 B13R1.528 CCC(=O)NCc1ccccc1I 527a_100015347259_100000210414 [0,2,0,0,0,1|1,0,0]=4 18381 B13R1.528 CCC(=O)NCc1ccccc1O 240690a_100000185550_100000210414 [0,2,0,0,0,1|1,0,0]=4 18382 B13R1.528 CCC(=O)NCc1ccccc1O 527a_100000185550_100000210414 [0,2,0,0,0,1|1,0,0]=4 18383 B13R1.528 CNC(=O)CCc1ccccc1Br 11a_106832991635_100000740810 [0,2,0,0,0,1|1,0,0]=4 18384 B13R1.528 CNC(=O)CCc1ccccc1Br 1626a_100102657272_100000740810 [0,2,0,0,0,1|1,0,0]=4 18385 B13R1.528 CNC(=O)CCc1ccccc1Br 240690a_100102657272_100000740810 [0,2,0,0,0,1|1,0,0]=4 18386 B13R1.528 CNC(=O)CCc1ccccc1Br 527a_100102657272_100000740810 [0,2,0,0,0,1|1,0,0]=4 18387 B13R1.528 CNC(=O)CCc1ccccc1C 11a_106832991635_100000748742 [0,2,0,0,0,1|1,0,0]=4 18388 B13R1.528 CNC(=O)CCc1ccccc1C 1626a_100102657272_100000748742 [0,2,0,0,0,1|1,0,0]=4 18389 B13R1.528 CNC(=O)CCc1ccccc1C 240690a_100102657272_100000748742 [0,2,0,0,0,1|1,0,0]=4 18390 B13R1.528 CNC(=O)CCc1ccccc1C 527a_100102657272_100000748742 [0,2,0,0,0,1|1,0,0]=4 18391 B13R1.528 CNC(=O)CCc1ccccc1Cl 11a_106832991635_100000184300 [0,2,0,0,0,1|1,0,0]=4 18392 B13R1.528 CNC(=O)CCc1ccccc1Cl 1626a_100102657272_100000184300 [0,2,0,0,0,1|1,0,0]=4 18393 B13R1.528 CNC(=O)CCc1ccccc1Cl 240690a_100102657272_100000184300 [0,2,0,0,0,1|1,0,0]=4 18394 B13R1.528 CNC(=O)CCc1ccccc1Cl 527a_100102657272_100000184300 [0,2,0,0,0,1|1,0,0]=4 18395 B13R1.528 CNC(=O)CCc1ccccc1F 11a_106832991635_100000189703 [0,2,0,0,0,1|1,0,0]=4 18396 B13R1.528 CNC(=O)CCc1ccccc1F 1626a_100102657272_100000189703 [0,2,0,0,0,1|1,0,0]=4 18397 B13R1.528 CNC(=O)CCc1ccccc1F 240690a_100102657272_100000189703 [0,2,0,0,0,1|1,0,0]=4 18398 B13R1.528 CNC(=O)CCc1ccccc1F 527a_100102657272_100000189703 [0,2,0,0,0,1|1,0,0]=4 18399 B13R1.528 CNC(=O)CCc1ccccc1I 11a_106832991635_100000037306 [0,2,0,0,0,1|1,0,0]=4 18400 B13R1.528 CNC(=O)CCc1ccccc1I 1626a_100102657272_100000037306 [0,2,0,0,0,1|1,0,0]=4 18401 B13R1.528 CNC(=O)CCc1ccccc1I 240690a_100102657272_100000037306 [0,2,0,0,0,1|1,0,0]=4 18402 B13R1.528 CNC(=O)CCc1ccccc1I 527a_100102657272_100000037306 [0,2,0,0,0,1|1,0,0]=4 18403 B13R1.528 CNC(=O)CCc1ccccc1O 11a_106832991635_100000181328 [0,2,0,0,0,1|1,0,0]=4 18404 B13R1.528 CNC(=O)CCc1ccccc1O 240690a_100102657272_100000181328 [0,2,0,0,0,1|1,0,0]=4 18405 B13R1.528 CNC(=O)CCc1ccccc1O 527a_100102657272_100000181328 [0,2,0,0,0,1|1,0,0]=4 18406 B13R1.528 CNC(=O)CNc1ccccc1Br 34a_100000210017_100000183359 [0,2,0,0,0,1|1,0,0]=4 18407 B13R1.528 CNC(=O)CNc1ccccc1C 34a_100015192222_100000183359 [0,2,0,0,0,1|1,0,0]=4 18408 B13R1.528 CNC(=O)CNc1ccccc1Cl 34a_100000185783_100000183359 [0,2,0,0,0,1|1,0,0]=4 18409 B13R1.528 CNC(=O)CNc1ccccc1F 34a_100000210422_100000183359 [0,2,0,0,0,1|1,0,0]=4 18410 B13R1.528 CNC(=O)CNc1ccccc1I 34a_100000210053_100000183359 [0,2,0,0,0,1|1,0,0]=4 18411 B13R1.528 CNC(=O)CNc1ccccc1O 34a_100000185747_100000183359 [0,2,0,0,0,1|1,0,0]=4 18412 B13R1.528 CNC(=O)COc1ccccc1Br 11a_106832991635_100000216496 [0,2,0,0,0,1|1,0,0]=4 18413 B13R1.528 CNC(=O)COc1ccccc1Br 1626a_100102657272_100000216496 [0,2,0,0,0,1|1,0,0]=4 18414 B13R1.528 CNC(=O)COc1ccccc1Br 240690a_100102657272_100000216496 [0,2,0,0,0,1|1,0,0]=4 18415 B13R1.528 CNC(=O)COc1ccccc1Br 34a_100000181306_100000183359 [0,2,0,0,0,1|1,0,0]=4 18416 B13R1.528 CNC(=O)COc1ccccc1Br 527a_100102657272_100000216496 [0,2,0,0,0,1|1,0,0]=4 18417 B13R1.528 CNC(=O)COc1ccccc1Br 7a_100000181306_100000183359 [0,2,0,0,0,1|1,0,0]=4 18418 B13R1.528 CNC(=O)COc1ccccc1C 11a_106832991635_100000182418 [0,2,0,0,0,1|1,0,0]=4 18419 B13R1.528 CNC(=O)COc1ccccc1C 1626a_100102657272_100000182418 [0,2,0,0,0,1|1,0,0]=4 18420 B13R1.528 CNC(=O)COc1ccccc1C 240690a_100102657272_100000182418 [0,2,0,0,0,1|1,0,0]=4 18421 B13R1.528 CNC(=O)COc1ccccc1C 34a_100000210338_100000183359 [0,2,0,0,0,1|1,0,0]=4 18422 B13R1.528 CNC(=O)COc1ccccc1C 527a_100102657272_100000182418 [0,2,0,0,0,1|1,0,0]=4 18423 B13R1.528 CNC(=O)COc1ccccc1C 7a_100000210338_100000183359 [0,2,0,0,0,1|1,0,0]=4 18424 B13R1.528 CNC(=O)COc1ccccc1Cl 11a_106832991635_100000185159 [0,2,0,0,0,1|1,0,0]=4 18425 B13R1.528 CNC(=O)COc1ccccc1Cl 1626a_100102657272_100000185159 [0,2,0,0,0,1|1,0,0]=4 18426 B13R1.528 CNC(=O)COc1ccccc1Cl 240690a_100102657272_100000185159 [0,2,0,0,0,1|1,0,0]=4 18427 B13R1.528 CNC(=O)COc1ccccc1Cl 34a_100000210172_100000183359 [0,2,0,0,0,1|1,0,0]=4 18428 B13R1.528 CNC(=O)COc1ccccc1Cl 527a_100102657272_100000185159 [0,2,0,0,0,1|1,0,0]=4 18429 B13R1.528 CNC(=O)COc1ccccc1Cl 7a_100000210172_100000183359 [0,2,0,0,0,1|1,0,0]=4 18430 B13R1.528 CNC(=O)COc1ccccc1F 11a_106832991635_100000182486 [0,2,0,0,0,1|1,0,0]=4 18431 B13R1.528 CNC(=O)COc1ccccc1F 1626a_100102657272_100000182486 [0,2,0,0,0,1|1,0,0]=4 18432 B13R1.528 CNC(=O)COc1ccccc1F 240690a_100102657272_100000182486 [0,2,0,0,0,1|1,0,0]=4 18433 B13R1.528 CNC(=O)COc1ccccc1F 34a_100000210171_100000183359 [0,2,0,0,0,1|1,0,0]=4 18434 B13R1.528 CNC(=O)COc1ccccc1F 527a_100102657272_100000182486 [0,2,0,0,0,1|1,0,0]=4 18435 B13R1.528 CNC(=O)COc1ccccc1F 7a_100000210171_100000183359 [0,2,0,0,0,1|1,0,0]=4 18436 B13R1.528 CNC(=O)COc1ccccc1I 34a_100000739446_100000183359 [0,2,0,0,0,1|1,0,0]=4 18437 B13R1.528 CNC(=O)COc1ccccc1I 7a_100000739446_100000183359 [0,2,0,0,0,1|1,0,0]=4 18438 B13R1.528 CNC(=O)COc1ccccc1N 34a_100000185747_100000183359 [0,2,0,0,0,1|1,0,0]=4 18439 B13R1.528 CNC(=O)COc1ccccc1N 7a_100000185747_100000183359 [0,2,0,0,0,1|1,0,0]=4 18440 B13R1.528 CNC(=O)COc1ccccc1O 240690a_100102657272_100000183020 [0,2,0,0,0,1|1,0,0]=4 18441 B13R1.528 CNC(=O)COc1ccccc1O 271570a_203496583355_200000148481 [0,2,0,0,0,1|1,0,0]=4 18442 B13R1.528 CNC(=O)COc1ccccc1O 527a_100102657272_100000183020 [0,2,0,0,0,1|1,0,0]=4 18443 B13R1.528 CNC(=O)CSc1ccccc1Br 62a_100000183359_100000695589 [0,2,0,0,0,1|1,0,0]=4 18444 B13R1.528 CNC(=O)CSc1ccccc1Br 62a_100000695589_100000183359 [0,2,0,0,0,1|1,0,0]=4 18445 B13R1.528 CNC(=O)CSc1ccccc1C 11a_106832991635_100000183026 [0,2,0,0,0,1|1,0,0]=4 18446 B13R1.528 CNC(=O)CSc1ccccc1C 1626a_100102657272_100000183026 [0,2,0,0,0,1|1,0,0]=4 18447 B13R1.528 CNC(=O)CSc1ccccc1C 240690a_100102657272_100000183026 [0,2,0,0,0,1|1,0,0]=4 18448 B13R1.528 CNC(=O)CSc1ccccc1C 527a_100102657272_100000183026 [0,2,0,0,0,1|1,0,0]=4 18449 B13R1.528 CNC(=O)CSc1ccccc1C 62a_100000183359_100000210755 [0,2,0,0,0,1|1,0,0]=4 18450 B13R1.528 CNC(=O)CSc1ccccc1C 62a_100000210755_100000183359 [0,2,0,0,0,1|1,0,0]=4 18451 B13R1.528 CNC(=O)CSc1ccccc1Cl 62a_100000183359_100000764095 [0,2,0,0,0,1|1,0,0]=4 18452 B13R1.528 CNC(=O)CSc1ccccc1Cl 62a_100000764095_100000183359 [0,2,0,0,0,1|1,0,0]=4 18453 B13R1.528 CNC(=O)CSc1ccccc1F 11a_106832991635_100000179528 [0,2,0,0,0,1|1,0,0]=4 18454 B13R1.528 CNC(=O)CSc1ccccc1F 1626a_100102657272_100000179528 [0,2,0,0,0,1|1,0,0]=4 18455 B13R1.528 CNC(=O)CSc1ccccc1F 240690a_100102657272_100000179528 [0,2,0,0,0,1|1,0,0]=4 18456 B13R1.528 CNC(=O)CSc1ccccc1F 62a_100000183359_100011215700 [0,2,0,0,0,1|1,0,0]=4 18457 B13R1.528 CNC(=O)CSc1ccccc1F 62a_100011215700_100000183359 [0,2,0,0,0,1|1,0,0]=4 18458 B13R1.528 CNC(=O)CSc1ccccc1N 62a_100000183359_100000210017 [0,2,0,0,0,1|1,0,0]=4 18459 B13R1.528 CNC(=O)CSc1ccccc1N 62a_100000210017_100000183359 [0,2,0,0,0,1|1,0,0]=4 18460 B13R1.528 CNC(=O)CSc1ccccc1O 240690a_100102657272_100000695322 [0,2,0,0,0,1|1,0,0]=4 18461 B13R1.528 CNC(=O)CSc1ccccc1O 527a_100102657272_100000695322 [0,2,0,0,0,1|1,0,0]=4 18462 B13R1.528 CNC(=O)CSc1ccccc1O 62a_100000183359_100000739446 [0,2,0,0,0,1|1,0,0]=4 18463 B13R1.528 CNC(=O)CSc1ccccc1O 62a_100000739446_100000183359 [0,2,0,0,0,1|1,0,0]=4 18464 B13R1.528 CNC(=O)NCc1ccccc1Br 2708a_100000689332_106832991635 [0,2,0,0,0,1|1,0,0]=4 18465 B13R1.528 CNC(=O)NCc1ccccc1Br 2708a_100102657272_100000689332 [0,2,0,0,0,1|1,0,0]=4 18466 B13R1.528 CNC(=O)NCc1ccccc1Br 273464a_100000689332_100102657272 [0,2,0,0,0,1|1,0,0]=4 18467 B13R1.528 CNC(=O)NCc1ccccc1Br 273464a_100102657272_100000689332 [0,2,0,0,0,1|1,0,0]=4 18468 B13R1.528 CNC(=O)NCc1ccccc1Br 512a_100000689332_100102657272 [0,2,0,0,0,1|1,0,0]=4 18469 B13R1.528 CNC(=O)NCc1ccccc1Br 512a_106832991638_100000689332 [0,2,0,0,0,1|1,0,0]=4 18470 B13R1.528 CNC(=O)NCc1ccccc1C 2708a_100000174972_106832991635 [0,2,0,0,0,1|1,0,0]=4 18471 B13R1.528 CNC(=O)NCc1ccccc1C 2708a_100102657272_100000174972 [0,2,0,0,0,1|1,0,0]=4 18472 B13R1.528 CNC(=O)NCc1ccccc1C 273464a_100000174972_100102657272 [0,2,0,0,0,1|1,0,0]=4 18473 B13R1.528 CNC(=O)NCc1ccccc1C 273464a_100102657272_100000174972 [0,2,0,0,0,1|1,0,0]=4 18474 B13R1.528 CNC(=O)NCc1ccccc1C 512a_100000174972_100102657272 [0,2,0,0,0,1|1,0,0]=4 18475 B13R1.528 CNC(=O)NCc1ccccc1C 512a_106832991638_100000174972 [0,2,0,0,0,1|1,0,0]=4 18476 B13R1.528 CNC(=O)NCc1ccccc1Cl 2708a_100000174879_106832991635 [0,2,0,0,0,1|1,0,0]=4 18477 B13R1.528 CNC(=O)NCc1ccccc1Cl 2708a_100102657272_100000174879 [0,2,0,0,0,1|1,0,0]=4 18478 B13R1.528 CNC(=O)NCc1ccccc1Cl 273464a_100000174879_100102657272 [0,2,0,0,0,1|1,0,0]=4 18479 B13R1.528 CNC(=O)NCc1ccccc1Cl 273464a_100102657272_100000174879 [0,2,0,0,0,1|1,0,0]=4 18480 B13R1.528 CNC(=O)NCc1ccccc1Cl 512a_106832991638_100000174879 [0,2,0,0,0,1|1,0,0]=4 18481 B13R1.528 CNC(=O)NCc1ccccc1F 2708a_100000174869_106832991635 [0,2,0,0,0,1|1,0,0]=4 18482 B13R1.528 CNC(=O)NCc1ccccc1F 2708a_100102657272_100000174869 [0,2,0,0,0,1|1,0,0]=4 18483 B13R1.528 CNC(=O)NCc1ccccc1F 273464a_100000174869_100102657272 [0,2,0,0,0,1|1,0,0]=4 18484 B13R1.528 CNC(=O)NCc1ccccc1F 273464a_100102657272_100000174869 [0,2,0,0,0,1|1,0,0]=4 18485 B13R1.528 CNC(=O)NCc1ccccc1F 512a_100000174869_100102657272 [0,2,0,0,0,1|1,0,0]=4 18486 B13R1.528 CNC(=O)NCc1ccccc1F 512a_106832991638_100000174869 [0,2,0,0,0,1|1,0,0]=4 18487 B13R1.528 CNC(=O)NCc1ccccc1I 2708a_100015347259_106832991635 [0,2,0,0,0,1|1,0,0]=4 18488 B13R1.528 CNC(=O)NCc1ccccc1I 2708a_100102657272_100015347259 [0,2,0,0,0,1|1,0,0]=4 18489 B13R1.528 CNC(=O)NCc1ccccc1I 273464a_100015347259_100102657272 [0,2,0,0,0,1|1,0,0]=4 18490 B13R1.528 CNC(=O)NCc1ccccc1I 273464a_100102657272_100015347259 [0,2,0,0,0,1|1,0,0]=4 18491 B13R1.528 CNC(=O)NCc1ccccc1I 512a_100015347259_100102657272 [0,2,0,0,0,1|1,0,0]=4 18492 B13R1.528 CNC(=O)NCc1ccccc1I 512a_106832991638_100015347259 [0,2,0,0,0,1|1,0,0]=4 18493 B13R1.528 CNC(=O)NCc1ccccc1O 2708a_100000185550_106832991635 [0,2,0,0,0,1|1,0,0]=4 18494 B13R1.528 CNC(=O)NCc1ccccc1O 2708a_100102657272_100000185550 [0,2,0,0,0,1|1,0,0]=4 18495 B13R1.528 CNC(=O)NCc1ccccc1O 273464a_100000185550_100102657272 [0,2,0,0,0,1|1,0,0]=4 18496 B13R1.528 CNC(=O)NCc1ccccc1O 273464a_100102657272_100000185550 [0,2,0,0,0,1|1,0,0]=4 18497 B13R1.528 CNC(=O)NCc1ccccc1O 512a_100000185550_100102657272 [0,2,0,0,0,1|1,0,0]=4 18498 B13R1.528 COC(=O)CCc1ccccc1O 271570a_203496583355_100009815308 [0,2,0,0,0,1|1,0,0]=4 18499 B13R1.528 COC(=O)CNc1ccccc1Br 34a_100000210017_100000747449 [0,2,0,0,0,1|1,0,0]=4 18500 B13R1.528 COC(=O)CNc1ccccc1C 34a_100015192222_100000747449 [0,2,0,0,0,1|1,0,0]=4 18501 B13R1.528 COC(=O)CNc1ccccc1Cl 34a_100000185783_100000747449 [0,2,0,0,0,1|1,0,0]=4 18502 B13R1.528 COC(=O)CNc1ccccc1F 34a_100000210422_100000747449 [0,2,0,0,0,1|1,0,0]=4 18503 B13R1.528 COC(=O)CNc1ccccc1I 34a_100000210053_100000747449 [0,2,0,0,0,1|1,0,0]=4 18504 B13R1.528 COC(=O)CNc1ccccc1O 34a_100000185747_100000747449 [0,2,0,0,0,1|1,0,0]=4 18505 B13R1.528 COC(=O)COc1ccccc1Br 34a_100000181306_100000747449 [0,2,0,0,0,1|1,0,0]=4 18506 B13R1.528 COC(=O)COc1ccccc1Br 7a_100000181306_100000747449 [0,2,0,0,0,1|1,0,0]=4 18507 B13R1.528 COC(=O)COc1ccccc1C 34a_100000210338_100000747449 [0,2,0,0,0,1|1,0,0]=4 18508 B13R1.528 COC(=O)COc1ccccc1C 7a_100000210338_100000747449 [0,2,0,0,0,1|1,0,0]=4 18509 B13R1.528 COC(=O)COc1ccccc1Cl 34a_100000210172_100000747449 [0,2,0,0,0,1|1,0,0]=4 18510 B13R1.528 COC(=O)COc1ccccc1Cl 7a_100000210172_100000747449 [0,2,0,0,0,1|1,0,0]=4 18511 B13R1.528 COC(=O)COc1ccccc1F 34a_100000210171_100000747449 [0,2,0,0,0,1|1,0,0]=4 18512 B13R1.528 COC(=O)COc1ccccc1F 7a_100000210171_100000747449 [0,2,0,0,0,1|1,0,0]=4 18513 B13R1.528 COC(=O)COc1ccccc1I 34a_100000739446_100000747449 [0,2,0,0,0,1|1,0,0]=4 18514 B13R1.528 COC(=O)COc1ccccc1I 7a_100000739446_100000747449 [0,2,0,0,0,1|1,0,0]=4 18515 B13R1.528 COC(=O)COc1ccccc1N 34a_100000185747_100000747449 [0,2,0,0,0,1|1,0,0]=4 18516 B13R1.528 COC(=O)COc1ccccc1N 7a_100000185747_100000747449 [0,2,0,0,0,1|1,0,0]=4 18517 B13R1.528 COC(=O)COc1ccccc1O 271570a_203496583355_200000173920 [0,2,0,0,0,1|1,0,0]=4 18518 B13R1.528 COC(=O)CSc1ccccc1Br 62a_100000695589_100000747449 [0,2,0,0,0,1|1,0,0]=4 18519 B13R1.528 COC(=O)CSc1ccccc1Br 62a_100000747449_100000695589 [0,2,0,0,0,1|1,0,0]=4 18520 B13R1.528 COC(=O)CSc1ccccc1C 62a_100000210755_100000747449 [0,2,0,0,0,1|1,0,0]=4 18521 B13R1.528 COC(=O)CSc1ccccc1C 62a_100000747449_100000210755 [0,2,0,0,0,1|1,0,0]=4 18522 B13R1.528 COC(=O)CSc1ccccc1Cl 62a_100000747449_100000764095 [0,2,0,0,0,1|1,0,0]=4 18523 B13R1.528 COC(=O)CSc1ccccc1Cl 62a_100000764095_100000747449 [0,2,0,0,0,1|1,0,0]=4 18524 B13R1.528 COC(=O)CSc1ccccc1F 62a_100000747449_100011215700 [0,2,0,0,0,1|1,0,0]=4 18525 B13R1.528 COC(=O)CSc1ccccc1F 62a_100011215700_100000747449 [0,2,0,0,0,1|1,0,0]=4 18526 B13R1.528 COC(=O)CSc1ccccc1N 62a_100000210017_100000747449 [0,2,0,0,0,1|1,0,0]=4 18527 B13R1.528 COC(=O)CSc1ccccc1N 62a_100000747449_100000210017 [0,2,0,0,0,1|1,0,0]=4 18528 B13R1.528 COC(=O)CSc1ccccc1O 62a_100000739446_100000747449 [0,2,0,0,0,1|1,0,0]=4 18529 B13R1.528 COC(=O)CSc1ccccc1O 62a_100000747449_100000739446 [0,2,0,0,0,1|1,0,0]=4 18530 B13R1.528 Cc1ccccc1CCC(=O)CF 1458a_100000748742_100015361967 [0,2,0,0,0,1|1,0,0]=4 18531 B13R1.528 Cc1ccccc1CCC(=O)CO 1458a_100000210174_100011713688 [0,2,0,0,0,1|1,0,0]=4 18532 B13R1.528 Cc1ccccc1CNC(=O)CO 240690a_100000174972_100000210174 [0,2,0,0,0,1|1,0,0]=4 18533 B13R1.528 Cc1ccccc1CNC(=O)CO 527a_100000174972_100000210174 [0,2,0,0,0,1|1,0,0]=4 18534 B13R1.528 Cc1ccccc1OCC(=O)CF 1458a_100000182418_100015361967 [0,2,0,0,0,1|1,0,0]=4 18535 B13R1.528 Cc1ccccc1SCC(=O)CF 1458a_100000183026_100015361967 [0,2,0,0,0,1|1,0,0]=4 18536 B13R1.528 O=C(CF)CCc1ccccc1Br 1458a_100000740810_100015361967 [0,2,0,0,0,1|1,0,0]=4 18537 B13R1.528 O=C(CF)CCc1ccccc1Cl 1458a_100000184300_100015361967 [0,2,0,0,0,1|1,0,0]=4 18538 B13R1.528 O=C(CF)CCc1ccccc1F 1458a_100000189703_100015361967 [0,2,0,0,0,1|1,0,0]=4 18539 B13R1.528 O=C(CF)CCc1ccccc1I 1458a_100000037306_100015361967 [0,2,0,0,0,1|1,0,0]=4 18540 B13R1.528 O=C(CF)CCc1ccccc1O 1458a_100000181328_100015361967 [0,2,0,0,0,1|1,0,0]=4 18541 B13R1.528 O=C(CF)COc1ccccc1Br 1458a_100000216496_100015361967 [0,2,0,0,0,1|1,0,0]=4 18542 B13R1.528 O=C(CF)COc1ccccc1Cl 1458a_100000185159_100015361967 [0,2,0,0,0,1|1,0,0]=4 18543 B13R1.528 O=C(CF)COc1ccccc1F 1458a_100000182486_100015361967 [0,2,0,0,0,1|1,0,0]=4 18544 B13R1.528 O=C(CF)COc1ccccc1O 1458a_100000183020_100015361967 [0,2,0,0,0,1|1,0,0]=4 18545 B13R1.528 O=C(CF)CSc1ccccc1F 1458a_100000179528_100015361967 [0,2,0,0,0,1|1,0,0]=4 18546 B13R1.528 O=C(CF)CSc1ccccc1O 1458a_100000695322_100015361967 [0,2,0,0,0,1|1,0,0]=4 18547 B13R1.528 O=C(CO)CCc1ccccc1Br 1458a_100000210174_100012161201 [0,2,0,0,0,1|1,0,0]=4 18548 B13R1.528 O=C(CO)CCc1ccccc1Cl 1458a_100000210174_100011713703 [0,2,0,0,0,1|1,0,0]=4 18549 B13R1.528 O=C(CO)CCc1ccccc1F 1458a_100000210174_100000720011 [0,2,0,0,0,1|1,0,0]=4 18550 B13R1.528 O=C(CO)CCc1ccccc1O 1458a_100000210174_100000722297 [0,2,0,0,0,1|1,0,0]=4 18551 B13R1.528 O=C(CO)NCc1ccccc1Br 240690a_100000689332_100000210174 [0,2,0,0,0,1|1,0,0]=4 18552 B13R1.528 O=C(CO)NCc1ccccc1Br 527a_100000689332_100000210174 [0,2,0,0,0,1|1,0,0]=4 18553 B13R1.528 O=C(CO)NCc1ccccc1Cl 240690a_100000174879_100000210174 [0,2,0,0,0,1|1,0,0]=4 18554 B13R1.528 O=C(CO)NCc1ccccc1Cl 527a_100000174879_100000210174 [0,2,0,0,0,1|1,0,0]=4 18555 B13R1.528 O=C(CO)NCc1ccccc1F 240690a_100000174869_100000210174 [0,2,0,0,0,1|1,0,0]=4 18556 B13R1.528 O=C(CO)NCc1ccccc1F 527a_100000174869_100000210174 [0,2,0,0,0,1|1,0,0]=4 18557 B13R1.528 O=C(CO)NCc1ccccc1I 240690a_100015347259_100000210174 [0,2,0,0,0,1|1,0,0]=4 18558 B13R1.528 O=C(CO)NCc1ccccc1I 527a_100015347259_100000210174 [0,2,0,0,0,1|1,0,0]=4 18559 B13R1.528 O=C(CO)NCc1ccccc1O 240690a_100000185550_100000210174 [0,2,0,0,0,1|1,0,0]=4 18560 B13R1.528 O=C(CO)NCc1ccccc1O 527a_100000185550_100000210174 [0,2,0,0,0,1|1,0,0]=4 18561 B13R1.148 C=C(C)C(=O)Cc1cc(ccn1)Br 1458a_100000185857_100010173614 [0,2,0,0,0,1|1,0,0]=4 18562 B13R1.148 C=C(C)C(=O)Cc1cc(ccn1)C 1458a_100000185857_100000718516 [0,2,0,0,0,1|1,0,0]=4 18563 B13R1.148 C=C(C)C(=O)Cc1cc(ccn1)Cl 1458a_100000185857_100016988179 [0,2,0,0,0,1|1,0,0]=4 18564 B13R1.148 C=C(C)C(=O)Cc1cccc(c1)Br 1458a_100000185857_100000211773 [0,2,0,0,0,1|0,0,0]=3 18565 B13R1.148 C=C(C)C(=O)Cc1cccc(c1)C 1458a_100000185857_100000211840 [0,2,0,0,0,1|0,0,0]=3 18566 B13R1.148 C=C(C)C(=O)Cc1cccc(c1)Cl 1458a_100000185857_100000181238 [0,2,0,0,0,1|0,0,0]=3 18567 B13R1.148 C=C(C)C(=O)Cc1cccc(c1)F 1458a_100000185857_100000230114 [0,2,0,0,0,1|0,0,0]=3 18568 B13R1.148 C=C(C)C(=O)Cc1cccc(c1)I 1458a_100000185857_100011218688 [0,2,0,0,0,1|0,0,0]=3 18569 B13R1.148 C=C(C)C(=O)Cc1cccc(c1)O 1458a_100000185857_100011660834 [0,2,0,0,0,1|0,0,0]=3 18570 B13R1.148 C=C(C)C(=O)Cc1cccc(n1)Br 1458a_100000185857_100009889011 [0,2,0,0,0,1|1,0,0]=4 18571 B13R1.148 C=C(C)C(=O)Cc1cccc(n1)C 1458a_100000185857_100000757606 [0,2,0,0,0,1|1,0,0]=4 18572 B13R1.148 C=C(C)C(=O)Cc1cccc(n1)Cl 1458a_100000185857_100000086093 [0,2,0,0,0,1|1,0,0]=4 18573 B13R1.148 C=C(C)C(=O)Cc1cccc(n1)F 1458a_100000185857_100009819644 [0,2,0,0,0,1|1,0,0]=4 18574 B13R1.148 C=C(C)C(=O)Cc1ccnc(c1)Br 1458a_100000185857_100010243470 [0,2,0,0,0,1|1,0,0]=4 18575 B13R1.148 C=C(C)C(=O)Cc1ccnc(c1)C 1458a_100000185857_200020672517 [0,2,0,0,0,1|1,0,0]=4 18576 B13R1.148 C=C(C)C(=O)Cc1ccnc(c1)Cl 1458a_100000185857_100000764220 [0,2,0,0,0,1|1,0,0]=4 18577 B13R1.148 C=C(C)C(=O)Cc1cncc(c1)Br 1458a_100000185857_100011740620 [0,2,0,0,0,1|1,0,0]=4 18578 B13R1.148 C=C(C)C(=O)Cc1cncc(c1)C 1458a_100000185857_100000716715 [0,2,0,0,0,1|1,0,0]=4 18579 B13R1.148 C=C(C)C(=O)Cc1cncc(c1)Cl 1458a_100000185857_100016992070 [0,2,0,0,0,1|1,0,0]=4 18580 B13R1.148 C=C(C)C(=O)Cc1cncc(c1)F 1458a_100000185857_100000725299 [0,2,0,0,0,1|1,0,0]=4 18581 B13R1.148 C=C(C)C(=O)Nc1cccc(c1)Br 11a_100000210019_100000185857 [0,2,0,0,0,1|0,0,1]=4 18582 B13R1.148 C=C(C)C(=O)Nc1cccc(c1)Br 1626a_100000210019_100000185857 [0,2,0,0,0,1|0,0,1]=4 18583 B13R1.148 C=C(C)C(=O)Nc1cccc(c1)Br 22a_100000210019_100000185857 [0,2,0,0,0,1|0,0,1]=4 18584 B13R1.148 C=C(C)C(=O)Nc1cccc(c1)C 11a_100000188690_100000185857 [0,2,0,0,0,1|0,0,1]=4 18585 B13R1.148 C=C(C)C(=O)Nc1cccc(c1)C 1626a_100000188690_100000185857 [0,2,0,0,0,1|0,0,1]=4 18586 B13R1.148 C=C(C)C(=O)Nc1cccc(c1)C 22a_100000188690_100000185857 [0,2,0,0,0,1|0,0,1]=4 18587 B13R1.148 C=C(C)C(=O)Nc1cccc(c1)Cl 11a_100000185859_100000185857 [0,2,0,0,0,1|0,0,1]=4 18588 B13R1.148 C=C(C)C(=O)Nc1cccc(c1)Cl 1626a_100000185859_100000185857 [0,2,0,0,0,1|0,0,1]=4 18589 B13R1.148 C=C(C)C(=O)Nc1cccc(c1)Cl 22a_100000185859_100000185857 [0,2,0,0,0,1|0,0,1]=4 18590 B13R1.148 C=C(C)C(=O)Nc1cccc(c1)F 11a_100000210047_100000185857 [0,2,0,0,0,1|0,0,1]=4 18591 B13R1.148 C=C(C)C(=O)Nc1cccc(c1)F 1626a_100000210047_100000185857 [0,2,0,0,0,1|0,0,1]=4 18592 B13R1.148 C=C(C)C(=O)Nc1cccc(c1)F 22a_100000210047_100000185857 [0,2,0,0,0,1|0,0,1]=4 18593 B13R1.148 C=C(C)C(=O)Nc1cccc(c1)I 11a_100000211102_100000185857 [0,2,0,0,0,1|0,0,1]=4 18594 B13R1.148 C=C(C)C(=O)Nc1cccc(c1)I 1626a_100000211102_100000185857 [0,2,0,0,0,1|0,0,1]=4 18595 B13R1.148 C=C(C)C(=O)Nc1cccc(c1)I 22a_100000211102_100000185857 [0,2,0,0,0,1|0,0,1]=4 18596 B13R1.148 C=C(C)C(=O)Nc1cccc(c1)O 1626a_100000210217_100000185857 [0,2,0,0,0,1|0,0,1]=4 18597 B13R1.148 C=C(C)C(=O)Nc1cccc(c1)O 22a_100000210217_100000185857 [0,2,0,0,0,1|0,0,1]=4 18598 B13R1.148 CC(=O)C(C)Nc1cccc(c1)C 2230a_100000188690_100009814033 [0,2,0,0,0,1|1,0,0]=4 18599 B13R1.148 CC(=O)C(C)Oc1cccc(c1)Br 1458a_100000246016_200000210301 [0,2,0,0,0,1|1,0,0]=4 18600 B13R1.148 CC(=O)C(C)Oc1cccc(c1)Br 7a_100000210342_100000179758 [0,2,0,0,0,1|1,0,0]=4 18601 B13R1.148 CC(=O)C(C)Oc1cccc(c1)C 1458a_100000183885_200000210301 [0,2,0,0,0,1|1,0,0]=4 18602 B13R1.148 CC(=O)C(C)Oc1cccc(c1)C 7a_100000210337_100000179758 [0,2,0,0,0,1|1,0,0]=4 18603 B13R1.148 CC(=O)C(C)Oc1cccc(c1)Cl 1458a_100000185161_200000210301 [0,2,0,0,0,1|1,0,0]=4 18604 B13R1.148 CC(=O)C(C)Oc1cccc(c1)Cl 7a_100000210295_100000179758 [0,2,0,0,0,1|1,0,0]=4 18605 B13R1.148 CC(=O)C(C)Oc1cccc(c1)F 7a_100000210426_100000179758 [0,2,0,0,0,1|1,0,0]=4 18606 B13R1.148 CC(=O)C(C)Oc1cccc(c1)I 7a_100000211634_100000179758 [0,2,0,0,0,1|1,0,0]=4 18607 B13R1.148 CC(=O)C(C)Sc1cccc(c1)Br 62a_100000691529_100009814033 [0,2,0,0,0,1|1,0,0]=4 18608 B13R1.148 CC(=O)C(C)Sc1cccc(c1)Br 62a_100009814033_100000691529 [0,2,0,0,0,1|1,0,0]=4 18609 B13R1.148 CC(=O)C(C)Sc1cccc(c1)C 62a_100009814033_100011215228 [0,2,0,0,0,1|1,0,0]=4 18610 B13R1.148 CC(=O)C(C)Sc1cccc(c1)C 62a_100011215228_100009814033 [0,2,0,0,0,1|1,0,0]=4 18611 B13R1.148 CC(=O)C(C)Sc1cccc(c1)Cl 62a_100000699651_100009814033 [0,2,0,0,0,1|1,0,0]=4 18612 B13R1.148 CC(=O)C(C)Sc1cccc(c1)Cl 62a_100009814033_100000699651 [0,2,0,0,0,1|1,0,0]=4 18613 B13R1.148 CC(=O)C(C)Sc1cccc(c1)F 62a_100000685547_100009814033 [0,2,0,0,0,1|1,0,0]=4 18614 B13R1.148 CC(=O)C(C)Sc1cccc(c1)F 62a_100009814033_100000685547 [0,2,0,0,0,1|1,0,0]=4 18615 B13R1.148 CC(=O)C(C)Sc1cccc(c1)N 62a_100000210019_100009814033 [0,2,0,0,0,1|1,0,0]=4 18616 B13R1.148 CC(=O)C(C)Sc1cccc(c1)N 62a_100009814033_100000210019 [0,2,0,0,0,1|1,0,0]=4 18617 B13R1.148 CC(=O)C(C)Sc1cccc(c1)O 62a_100009814033_100000211634 [0,2,0,0,0,1|1,0,0]=4 18618 B13R1.148 CC(=O)C(C)Sc1cccc(c1)[S] 62a_100009814033_114929384022 [0,2,0,0,0,1|1,0,0]=4 18619 B13R1.148 CC(=O)C(C)Sc1cccc(c1)[S] 62a_114929384022_100009814033 [0,2,0,0,0,1|1,0,0]=4 18620 B13R1.148 CC(=O)C(O)Cc1cccc(c1)Br 1458a_100012362086_200000210301 [0,2,0,0,0,1|1,0,0]=4 18621 B13R1.148 CC(=O)N(C)Cc1cccc(c1)Br 11a_100000187585_100015343762 [0,2,0,0,0,1|1,0,0]=4 18622 B13R1.148 CC(=O)N(C)Cc1cccc(c1)Br 1626a_100000187585_100015343762 [0,2,0,0,0,1|1,0,0]=4 18623 B13R1.148 CC(=O)N(C)Cc1cccc(c1)Br 240690a_100000187585_100015343762 [0,2,0,0,0,1|1,0,0]=4 18624 B13R1.148 CC(=O)N(C)Cc1cccc(c1)Br 527a_100000187585_100103153847 [0,2,0,0,0,1|1,0,0]=4 18625 B13R1.148 CC(=O)N(C)Cc1cccc(c1)C 11a_102495364743_100015343762 [0,2,0,0,0,1|1,0,0]=4 18626 B13R1.148 CC(=O)N(C)Cc1cccc(c1)C 1626a_102495364743_100015343762 [0,2,0,0,0,1|1,0,0]=4 18627 B13R1.148 CC(=O)N(C)Cc1cccc(c1)C 240690a_102495364743_100015343762 [0,2,0,0,0,1|1,0,0]=4 18628 B13R1.148 CC(=O)N(C)Cc1cccc(c1)C 527a_102495364743_100103153847 [0,2,0,0,0,1|1,0,0]=4 18629 B13R1.148 CC(=O)N(C)Cc1cccc(c1)Cl 11a_100020629429_100015343762 [0,2,0,0,0,1|1,0,0]=4 18630 B13R1.148 CC(=O)N(C)Cc1cccc(c1)Cl 1626a_100020629429_100015343762 [0,2,0,0,0,1|1,0,0]=4 18631 B13R1.148 CC(=O)N(C)Cc1cccc(c1)Cl 240690a_100020629429_100015343762 [0,2,0,0,0,1|1,0,0]=4 18632 B13R1.148 CC(=O)N(C)Cc1cccc(c1)Cl 527a_100020629429_100103153847 [0,2,0,0,0,1|1,0,0]=4 18633 B13R1.148 CC(=O)N(C)Cc1cccc(c1)F 11a_100000184398_100015343762 [0,2,0,0,0,1|1,0,0]=4 18634 B13R1.148 CC(=O)N(C)Cc1cccc(c1)F 1626a_100000184398_100015343762 [0,2,0,0,0,1|1,0,0]=4 18635 B13R1.148 CC(=O)N(C)Cc1cccc(c1)F 240690a_100000184398_100015343762 [0,2,0,0,0,1|1,0,0]=4 18636 B13R1.148 CC(=O)N(C)Cc1cccc(c1)F 527a_100000184398_100103153847 [0,2,0,0,0,1|1,0,0]=4 18637 B13R1.148 CC(=O)N(C)Cc1cccc(c1)O 240690a_100000207540_100015343762 [0,2,0,0,0,1|1,0,0]=4 18638 B13R1.148 CC(=O)N(C)Cc1cccc(c1)O 527a_100000207540_100103153847 [0,2,0,0,0,1|1,0,0]=4 18639 B13R1.148 CC(=O)[C@@H](O)Cc1cccc(c1)F 1458a_200016142683_200000210301 [0,2,0,0,0,1|1,0,0]=4 18640 B13R1.148 CC(Oc1cccc(c1)Br)C(=O)[13CH3] 1458a_100000246016_200025704644 [0,2,0,0,0,1|1,0,0]=4 18641 B13R1.148 CC(Oc1cccc(c1)Cl)C(=O)[13CH3] 1458a_100000185161_200025704644 [0,2,0,0,0,1|1,0,0]=4 18642 B13R1.148 Cc1cccc(c1)OC(C)C(=O)[13CH3] 1458a_100000183885_200025704644 [0,2,0,0,0,1|1,0,0]=4 18643 B13R1.148 [13CH3]C(=O)C(O)Cc1cccc(c1)Br 1458a_100012362086_200025704644 [0,2,0,0,0,1|1,0,0]=4 18644 B13R1.148 [13CH3]C(=O)[C@@H](O)Cc1cccc(c1)F 1458a_200016142683_200025704644 [0,2,0,0,0,1|1,0,0]=4 18645 B13R1.152 C=C(C)C(=O)C(C)c1ccccc1 1458a_100000185857_100000230085 [0,2,0,0,0,1|0,0,0]=3 18646 B13R1.152 C=C(C)C(=O)N(C)c1ccccc1 11a_100000210012_100000185857 [0,2,0,0,0,1|0,0,1]=4 18647 B13R1.152 C=C(C)C(=O)N(C)c1ccccc1 1626a_100000210012_100000185857 [0,2,0,0,0,1|0,0,1]=4 18648 B13R1.152 C=C(C)C(=O)N(C)c1ccccc1 22a_100000210012_100000185857 [0,2,0,0,0,1|0,0,1]=4 18649 B13R1.152 CC(=O)C(C)C(=O)c1ccccc1 1458a_100000070787_100000239700 [0,2,0,0,0,1|1,0,0]=4 18650 B13R1.152 CC(=O)C(C)C(=O)c1ccccc1 1458a_100000185807_100000179758 [0,2,0,0,0,1|1,0,0]=4 18651 B13R1.152 CC(=O)C(C)N(C)c1ccccc1 2230a_100000210012_100009814033 [0,2,0,0,0,1|1,0,0]=4 18652 B13R1.152 CC(=O)C(C)N(C)c1ccccc1 269982a_100000210012_100009814033 [0,2,0,0,0,1|1,0,0]=4 18653 B13R1.152 CC(=O)N(C)C(C)c1ccccc1 11a_100000195388_100015343762 [0,2,0,0,0,1|1,0,0]=4 18654 B13R1.152 CC(=O)N(C)C(C)c1ccccc1 1626a_100000195388_100015343762 [0,2,0,0,0,1|1,0,0]=4 18655 B13R1.152 CC(=O)N(C)C(C)c1ccccc1 240690a_100000195388_100015343762 [0,2,0,0,0,1|1,0,0]=4 18656 B13R1.152 CC(=O)N(C)C(C)c1ccccc1 527a_100000195388_100103153847 [0,2,0,0,0,1|1,0,0]=4 18657 B13R1.202 C=C(C)C(=O)Cc1ccccc1Br 1458a_100000185857_100000184730 [0,2,0,0,0,1|0,0,0]=3 18658 B13R1.202 C=C(C)C(=O)Cc1ccccc1C 1458a_100000185857_100000211839 [0,2,0,0,0,1|0,0,0]=3 18659 B13R1.202 C=C(C)C(=O)Cc1ccccc1Cl 1458a_100000185857_100000187162 [0,2,0,0,0,1|0,0,0]=3 18660 B13R1.202 C=C(C)C(=O)Cc1ccccc1F 1458a_100000185857_100000187165 [0,2,0,0,0,1|0,0,0]=3 18661 B13R1.202 C=C(C)C(=O)Cc1ccccc1I 1458a_100000185857_100011216222 [0,2,0,0,0,1|0,0,0]=3 18662 B13R1.202 C=C(C)C(=O)Cc1cccnc1Br 1458a_100000185857_100010140945 [0,2,0,0,0,1|1,0,0]=4 18663 B13R1.202 C=C(C)C(=O)Cc1cccnc1C 1458a_100000185857_100000732876 [0,2,0,0,0,1|1,0,0]=4 18664 B13R1.202 C=C(C)C(=O)Cc1cccnc1Cl 1458a_100000185857_100000045678 [0,2,0,0,0,1|1,0,0]=4 18665 B13R1.202 C=C(C)C(=O)Cc1cccnc1F 1458a_100000185857_100000099810 [0,2,0,0,0,1|1,0,0]=4 18666 B13R1.202 C=C(C)C(=O)Cc1ccncc1C 1458a_100000185857_100020672808 [0,2,0,0,0,1|1,0,0]=4 18667 B13R1.202 C=C(C)C(=O)Cc1ccncc1Cl 1458a_100000185857_100000763264 [0,2,0,0,0,1|1,0,0]=4 18668 B13R1.202 C=C(C)C(=O)Cc1cnccc1C 1458a_100000185857_100000690890 [0,2,0,0,0,1|1,0,0]=4 18669 B13R1.202 C=C(C)C(=O)Cc1ncccc1Br 1458a_100000185857_100025702911 [0,2,0,0,0,1|1,0,0]=4 18670 B13R1.202 C=C(C)C(=O)Cc1ncccc1C 1458a_100000185857_100000696600 [0,2,0,0,0,1|1,0,0]=4 18671 B13R1.202 C=C(C)C(=O)Cc1ncccc1Cl 1458a_100000185857_100000099807 [0,2,0,0,0,1|1,0,0]=4 18672 B13R1.202 C=C(C)C(=O)Cc1ncccc1F 1458a_100000185857_100000104219 [0,2,0,0,0,1|1,0,0]=4 18673 B13R1.202 C=C(C)C(=O)Cc1ncccc1O 1458a_100000185857_200020655725 [0,2,0,0,0,1|1,0,0]=4 18674 B13R1.202 C=C(C)C(=O)Nc1ccccc1Br 11a_100000210017_100000185857 [0,2,0,0,0,1|0,0,1]=4 18675 B13R1.202 C=C(C)C(=O)Nc1ccccc1Br 1626a_100000210017_100000185857 [0,2,0,0,0,1|0,0,1]=4 18676 B13R1.202 C=C(C)C(=O)Nc1ccccc1C 11a_100015192222_100000185857 [0,2,0,0,0,1|0,0,1]=4 18677 B13R1.202 C=C(C)C(=O)Nc1ccccc1C 1626a_100015192222_100000185857 [0,2,0,0,0,1|0,0,1]=4 18678 B13R1.202 C=C(C)C(=O)Nc1ccccc1C 22a_100015192222_100000185857 [0,2,0,0,0,1|0,0,1]=4 18679 B13R1.202 C=C(C)C(=O)Nc1ccccc1Cl 11a_100000185783_100000185857 [0,2,0,0,0,1|0,0,1]=4 18680 B13R1.202 C=C(C)C(=O)Nc1ccccc1Cl 1626a_100000185783_100000185857 [0,2,0,0,0,1|0,0,1]=4 18681 B13R1.202 C=C(C)C(=O)Nc1ccccc1Cl 22a_100000185783_100000185857 [0,2,0,0,0,1|0,0,1]=4 18682 B13R1.202 C=C(C)C(=O)Nc1ccccc1F 11a_100000210422_100000185857 [0,2,0,0,0,1|0,0,1]=4 18683 B13R1.202 C=C(C)C(=O)Nc1ccccc1F 1626a_100000210422_100000185857 [0,2,0,0,0,1|0,0,1]=4 18684 B13R1.202 C=C(C)C(=O)Nc1ccccc1F 22a_100000210422_100000185857 [0,2,0,0,0,1|0,0,1]=4 18685 B13R1.202 C=C(C)C(=O)Nc1ccccc1I 11a_100000210053_100000185857 [0,2,0,0,0,1|0,0,1]=4 18686 B13R1.202 C=C(C)C(=O)Nc1ccccc1I 1626a_100000210053_100000185857 [0,2,0,0,0,1|0,0,1]=4 18687 B13R1.202 C=C(C)C(=O)Nc1ccccc1O 22a_100000185747_100000185857 [0,2,0,0,0,1|0,0,1]=4 18688 B13R1.202 CC(=O)C(C)Oc1ccccc1Br 1458a_100000246065_200000210301 [0,2,0,0,0,1|1,0,0]=4 18689 B13R1.202 CC(=O)C(C)Oc1ccccc1Br 7a_100000181306_100000179758 [0,2,0,0,0,1|1,0,0]=4 18690 B13R1.202 CC(=O)C(C)Oc1ccccc1C 1458a_100000189243_200000210301 [0,2,0,0,0,1|1,0,0]=4 18691 B13R1.202 CC(=O)C(C)Oc1ccccc1C 7a_100000210338_100000179758 [0,2,0,0,0,1|1,0,0]=4 18692 B13R1.202 CC(=O)C(C)Oc1ccccc1Cl 1458a_100000191201_200000210301 [0,2,0,0,0,1|1,0,0]=4 18693 B13R1.202 CC(=O)C(C)Oc1ccccc1Cl 7a_100000210172_100000179758 [0,2,0,0,0,1|1,0,0]=4 18694 B13R1.202 CC(=O)C(C)Oc1ccccc1F 1458a_100000191191_200000210301 [0,2,0,0,0,1|1,0,0]=4 18695 B13R1.202 CC(=O)C(C)Oc1ccccc1F 7a_100000210171_100000179758 [0,2,0,0,0,1|1,0,0]=4 18696 B13R1.202 CC(=O)C(C)Oc1ccccc1I 7a_100000739446_100000179758 [0,2,0,0,0,1|1,0,0]=4 18697 B13R1.202 CC(=O)C(C)Oc1ccccc1N 7a_100000185747_100000179758 [0,2,0,0,0,1|1,0,0]=4 18698 B13R1.202 CC(=O)C(C)Sc1ccccc1Br 62a_100000695589_100009814033 [0,2,0,0,0,1|1,0,0]=4 18699 B13R1.202 CC(=O)C(C)Sc1ccccc1Br 62a_100009814033_100000695589 [0,2,0,0,0,1|1,0,0]=4 18700 B13R1.202 CC(=O)C(C)Sc1ccccc1C 62a_100000210755_100009814033 [0,2,0,0,0,1|1,0,0]=4 18701 B13R1.202 CC(=O)C(C)Sc1ccccc1C 62a_100009814033_100000210755 [0,2,0,0,0,1|1,0,0]=4 18702 B13R1.202 CC(=O)C(C)Sc1ccccc1Cl 1458a_100000181065_200000210301 [0,2,0,0,0,1|1,0,0]=4 18703 B13R1.202 CC(=O)C(C)Sc1ccccc1Cl 62a_100000764095_100009814033 [0,2,0,0,0,1|1,0,0]=4 18704 B13R1.202 CC(=O)C(C)Sc1ccccc1Cl 62a_100009814033_100000764095 [0,2,0,0,0,1|1,0,0]=4 18705 B13R1.202 CC(=O)C(C)Sc1ccccc1F 62a_100009814033_100011215700 [0,2,0,0,0,1|1,0,0]=4 18706 B13R1.202 CC(=O)C(C)Sc1ccccc1F 62a_100011215700_100009814033 [0,2,0,0,0,1|1,0,0]=4 18707 B13R1.202 CC(=O)C(C)Sc1ccccc1N 62a_100000210017_100009814033 [0,2,0,0,0,1|1,0,0]=4 18708 B13R1.202 CC(=O)C(C)Sc1ccccc1N 62a_100009814033_100000210017 [0,2,0,0,0,1|1,0,0]=4 18709 B13R1.202 CC(=O)C(C)Sc1ccccc1O 62a_100000739446_100009814033 [0,2,0,0,0,1|1,0,0]=4 18710 B13R1.202 CC(=O)C(C)Sc1ccccc1O 62a_100009814033_100000739446 [0,2,0,0,0,1|1,0,0]=4 18711 B13R1.202 CC(=O)C(O)Cc1ccccc1Br 1458a_100012382637_200000210301 [0,2,0,0,0,1|1,0,0]=4 18712 B13R1.202 CC(=O)C(O)Cc1ccccc1Cl 1458a_100000703902_200000210301 [0,2,0,0,0,1|1,0,0]=4 18713 B13R1.202 CC(=O)N(C)Cc1ccccc1Br 11a_100000184654_100015343762 [0,2,0,0,0,1|1,0,0]=4 18714 B13R1.202 CC(=O)N(C)Cc1ccccc1Br 1626a_100000184654_100015343762 [0,2,0,0,0,1|1,0,0]=4 18715 B13R1.202 CC(=O)N(C)Cc1ccccc1Br 240690a_100000184654_100015343762 [0,2,0,0,0,1|1,0,0]=4 18716 B13R1.202 CC(=O)N(C)Cc1ccccc1Br 527a_100000184654_100103153847 [0,2,0,0,0,1|1,0,0]=4 18717 B13R1.202 CC(=O)N(C)Cc1ccccc1C 1626a_100000184421_100015343762 [0,2,0,0,0,1|1,0,0]=4 18718 B13R1.202 CC(=O)N(C)Cc1ccccc1C 240690a_100000184421_100015343762 [0,2,0,0,0,1|1,0,0]=4 18719 B13R1.202 CC(=O)N(C)Cc1ccccc1C 527a_100000184421_100103153847 [0,2,0,0,0,1|1,0,0]=4 18720 B13R1.202 CC(=O)N(C)Cc1ccccc1Cl 11a_100000184507_100015343762 [0,2,0,0,0,1|1,0,0]=4 18721 B13R1.202 CC(=O)N(C)Cc1ccccc1Cl 1626a_100000184507_100015343762 [0,2,0,0,0,1|1,0,0]=4 18722 B13R1.202 CC(=O)N(C)Cc1ccccc1Cl 240690a_100000184507_100015343762 [0,2,0,0,0,1|1,0,0]=4 18723 B13R1.202 CC(=O)N(C)Cc1ccccc1Cl 527a_100000184507_100103153847 [0,2,0,0,0,1|1,0,0]=4 18724 B13R1.202 CC(=O)N(C)Cc1ccccc1F 11a_100000742528_100015343762 [0,2,0,0,0,1|1,0,0]=4 18725 B13R1.202 CC(=O)N(C)Cc1ccccc1F 1626a_100000742528_100015343762 [0,2,0,0,0,1|1,0,0]=4 18726 B13R1.202 CC(=O)N(C)Cc1ccccc1F 240690a_100000742528_100015343762 [0,2,0,0,0,1|1,0,0]=4 18727 B13R1.202 CC(=O)N(C)Cc1ccccc1F 527a_100000742528_100103153847 [0,2,0,0,0,1|1,0,0]=4 18728 B13R1.202 CC(=O)N(C)Cc1ccccc1O 240690a_100015189988_100015343762 [0,2,0,0,0,1|1,0,0]=4 18729 B13R1.202 CC(=O)N(C)Cc1ccccc1O 527a_100015189988_100103153847 [0,2,0,0,0,1|1,0,0]=4 18730 B13R1.202 CC(Oc1ccccc1Br)C(=O)[13CH3] 1458a_100000246065_200025704644 [0,2,0,0,0,1|1,0,0]=4 18731 B13R1.202 CC(Oc1ccccc1Cl)C(=O)[13CH3] 1458a_100000191201_200025704644 [0,2,0,0,0,1|1,0,0]=4 18732 B13R1.202 CC(Oc1ccccc1F)C(=O)[13CH3] 1458a_100000191191_200025704644 [0,2,0,0,0,1|1,0,0]=4 18733 B13R1.202 CC(Sc1ccccc1Cl)C(=O)[13CH3] 1458a_100000181065_200025704644 [0,2,0,0,0,1|1,0,0]=4 18734 B13R1.202 Cc1ccccc1OC(C)C(=O)[13CH3] 1458a_100000189243_200025704644 [0,2,0,0,0,1|1,0,0]=4 18735 B13R1.202 [13CH3]C(=O)C(O)Cc1ccccc1Br 1458a_100012382637_200025704644 [0,2,0,0,0,1|1,0,0]=4 18736 B13R1.202 [13CH3]C(=O)C(O)Cc1ccccc1Cl 1458a_100000703902_200025704644 [0,2,0,0,0,1|1,0,0]=4 18737 B13R1.418 CC(=O)C(C#N)Cc1ccccc1 1458a_100000070787_100000183401 [0,2,0,0,0,1|1,0,0]=4 18738 B13R1.418 CC(=O)C(C#N)Cc1ccccc1 1458a_100000075392_200000210301 [0,2,0,0,0,1|1,0,0]=4 18739 B13R1.418 CCC(Oc1ccccc1)C(=O)C 1458a_100000211556_200000210301 [0,2,0,0,0,1|1,0,0]=4 18740 B13R1.418 CCC(Oc1ccccc1)C(=O)[13CH3] 1458a_100000211556_200025704644 [0,2,0,0,0,1|1,0,0]=4 18741 B13R1.418 CCC(Sc1ccccc1)C(=O)C 1458a_100000230495_200000210301 [0,2,0,0,0,1|1,0,0]=4 18742 B13R1.418 CCC(Sc1ccccc1)C(=O)[13CH3] 1458a_100000230495_200025704644 [0,2,0,0,0,1|1,0,0]=4 18743 B13R1.418 CCN(Cc1ccccc1)C(=O)C 11a_100000186914_100015343762 [0,2,0,0,0,1|1,0,0]=4 18744 B13R1.418 CCN(Cc1ccccc1)C(=O)C 1626a_100000186914_100015343762 [0,2,0,0,0,1|1,0,0]=4 18745 B13R1.418 CCN(Cc1ccccc1)C(=O)C 240690a_100000186914_100015343762 [0,2,0,0,0,1|1,0,0]=4 18746 B13R1.418 CCN(Cc1ccccc1)C(=O)C 527a_100000186914_100103153847 [0,2,0,0,0,1|1,0,0]=4 18747 B13R1.418 [13CH3]C(=O)C(C#N)Cc1ccccc1 1458a_100000075392_200025704644 [0,2,0,0,0,1|1,0,0]=4 18748 B13R1.1073 CC(=O)C(C)(C)Cc1ccccc1 1458a_100000757416_200000210301 [0,2,0,0,0,1|1,0,0]=4 18749 B13R1.1073 CC(=O)C(C)(C)Oc1ccccc1 1458a_100000743201_200000210301 [0,2,0,0,0,1|1,0,0]=4 18750 B13R1.1073 CC(=O)C(C)(C)Oc1ccccc1 7a_100000210340_100000075568 [0,2,0,0,0,1|1,0,0]=4 18751 B13R1.1073 CC(=O)C(C)(C)Sc1ccccc1 62a_100000075568_100000041952 [0,2,0,0,0,1|1,0,0]=4 18752 B13R1.1073 CC(=O)C(C)(C)Sc1ccccc1 62a_100000719477_100000075568 [0,2,0,0,0,1|1,0,0]=4 18753 B13R1.1073 CC(=O)C(F)(F)Oc1ccccc1 1458a_100000070787_200000057402 [0,2,0,0,0,1|1,0,0]=4 18754 B13R1.1073 CC(C)(Cc1ccccc1)C(=O)[13CH3] 1458a_100000757416_200025704644 [0,2,0,0,0,1|1,0,0]=4 18755 B13R1.1073 CC(C)(Oc1ccccc1)C(=O)[13CH3] 1458a_100000743201_200025704644 [0,2,0,0,0,1|1,0,0]=4 18756 B13R1.147 C=C(C)CC(=O)c1cccc(c1)Br 1458a_100000210664_100000748629 [0,2,0,0,0,1|0,0,0]=3 18757 B13R1.147 C=C(C)CC(=O)c1cccc(c1)C 1458a_100000189346_100000748629 [0,2,0,0,0,1|0,0,0]=3 18758 B13R1.147 C=C(C)CC(=O)c1cccc(c1)Cl 1458a_100000210390_100000748629 [0,2,0,0,0,1|0,0,0]=3 18759 B13R1.147 C=C(C)CC(=O)c1cccc(c1)F 1458a_100000210950_100000748629 [0,2,0,0,0,1|0,0,0]=3 18760 B13R1.147 C=C(C)CC(=O)c1cccc(c1)I 1458a_100000184098_100000748629 [0,2,0,0,0,1|0,0,0]=3 18761 B13R1.147 C=C(C)CC(=O)c1cccc(c1)O 1458a_100000183914_100000748629 [0,2,0,0,0,1|0,0,0]=3 18762 B13R1.147 C=C(C)CN(C)c1cc(ccn1)F 27a_100000225649_100000764206 [0,2,0,0,0,1|1,0,0]=4 18763 B13R1.147 C=C(C)CN(C)c1cc[nH]c(=O)c1 27a_100000225649_100000061649 [0,2,0,0,0,1|1,0,0]=4 18764 B13R1.147 C=C(C)CN(C)c1cccc(c1)Br 2230a_100000219648_100000748629 [0,2,0,0,0,1|0,0,0]=3 18765 B13R1.147 C=C(C)CN(C)c1cccc(c1)Br 269982a_100000219648_100000748629 [0,2,0,0,0,1|0,0,0]=3 18766 B13R1.147 C=C(C)CN(C)c1cccc(c1)Br 34a_100000219648_100000748629 [0,2,0,0,0,1|0,0,0]=3 18767 B13R1.147 C=C(C)CN(C)c1cccc(c1)C 2230a_100000219674_100000748629 [0,2,0,0,0,1|0,0,0]=3 18768 B13R1.147 C=C(C)CN(C)c1cccc(c1)C 269982a_100000219674_100000748629 [0,2,0,0,0,1|0,0,0]=3 18769 B13R1.147 C=C(C)CN(C)c1cccc(c1)C 34a_100000219674_100000748629 [0,2,0,0,0,1|0,0,0]=3 18770 B13R1.147 C=C(C)CN(C)c1cccc(c1)Cl 2230a_100000220044_100000748629 [0,2,0,0,0,1|0,0,0]=3 18771 B13R1.147 C=C(C)CN(C)c1cccc(c1)Cl 269982a_100000220044_100000748629 [0,2,0,0,0,1|0,0,0]=3 18772 B13R1.147 C=C(C)CN(C)c1cccc(c1)Cl 34a_100000220044_100000748629 [0,2,0,0,0,1|0,0,0]=3 18773 B13R1.147 C=C(C)CN(C)c1cccc(c1)F 2230a_100020633736_100000748629 [0,2,0,0,0,1|0,0,0]=3 18774 B13R1.147 C=C(C)CN(C)c1cccc(c1)F 269982a_100020633736_100000748629 [0,2,0,0,0,1|0,0,0]=3 18775 B13R1.147 C=C(C)CN(C)c1cccc(c1)F 34a_100020633736_100000748629 [0,2,0,0,0,1|0,0,0]=3 18776 B13R1.147 C=C(C)CN(C)c1cccc(c1)I 2230a_100000221217_100000748629 [0,2,0,0,0,1|0,0,0]=3 18777 B13R1.147 C=C(C)CN(C)c1cccc(c1)I 269982a_100000221217_100000748629 [0,2,0,0,0,1|0,0,0]=3 18778 B13R1.147 C=C(C)CN(C)c1cccc(c1)I 34a_100000221217_100000748629 [0,2,0,0,0,1|0,0,0]=3 18779 B13R1.147 C=C(C)CN(C)c1cccc(c1)O 2230a_100000756613_100000748629 [0,2,0,0,0,1|0,0,0]=3 18780 B13R1.147 C=C(C)CN(C)c1cccc(c1)O 269982a_100000756613_100000748629 [0,2,0,0,0,1|0,0,0]=3 18781 B13R1.147 C=C(C)CN(C)c1cccc(c1)O 34a_100000756613_100000748629 [0,2,0,0,0,1|0,0,0]=3 18782 B13R1.147 C=C(C)CN(C)c1cccc(n1)F 27a_100000225649_100009815982 [0,2,0,0,0,1|1,0,0]=4 18783 B13R1.147 C=C(C)CN(C)c1ccnc(c1)C 27a_100000225649_100000758586 [0,2,0,0,0,1|1,0,0]=4 18784 B13R1.147 C=C(C)CN(C)c1ccnc(c1)F 27a_100000225649_100009816116 [0,2,0,0,0,1|1,0,0]=4 18785 B13R1.147 C=C(F)CC(=O)c1cccc(c1)Br 1458a_100000210664_100009893438 [0,2,0,0,0,1|1,0,0]=4 18786 B13R1.147 C=C(F)CC(=O)c1cccc(c1)C 1458a_100000189346_100009893438 [0,2,0,0,0,1|1,0,0]=4 18787 B13R1.147 C=C(F)CC(=O)c1cccc(c1)Cl 1458a_100000210390_100009893438 [0,2,0,0,0,1|1,0,0]=4 18788 B13R1.147 C=C(F)CC(=O)c1cccc(c1)F 1458a_100000210950_100009893438 [0,2,0,0,0,1|1,0,0]=4 18789 B13R1.147 C=C(F)CC(=O)c1cccc(c1)I 1458a_100000184098_100009893438 [0,2,0,0,0,1|1,0,0]=4 18790 B13R1.147 C=C(F)CC(=O)c1cccc(c1)O 1458a_100000183914_100009893438 [0,2,0,0,0,1|1,0,0]=4 18791 B13R1.147 C=C(F)CN(C)c1cccc(c1)Br 2230a_100000219648_100009893438 [0,2,0,0,0,1|1,0,0]=4 18792 B13R1.147 C=C(F)CN(C)c1cccc(c1)Br 269982a_100000219648_100009893438 [0,2,0,0,0,1|1,0,0]=4 18793 B13R1.147 C=C(F)CN(C)c1cccc(c1)Br 34a_100000219648_100009893438 [0,2,0,0,0,1|1,0,0]=4 18794 B13R1.147 C=C(F)CN(C)c1cccc(c1)C 2230a_100000219674_100009893438 [0,2,0,0,0,1|1,0,0]=4 18795 B13R1.147 C=C(F)CN(C)c1cccc(c1)C 269982a_100000219674_100009893438 [0,2,0,0,0,1|1,0,0]=4 18796 B13R1.147 C=C(F)CN(C)c1cccc(c1)C 34a_100000219674_100009893438 [0,2,0,0,0,1|1,0,0]=4 18797 B13R1.147 C=C(F)CN(C)c1cccc(c1)Cl 2230a_100000220044_100009893438 [0,2,0,0,0,1|1,0,0]=4 18798 B13R1.147 C=C(F)CN(C)c1cccc(c1)Cl 269982a_100000220044_100009893438 [0,2,0,0,0,1|1,0,0]=4 18799 B13R1.147 C=C(F)CN(C)c1cccc(c1)Cl 34a_100000220044_100009893438 [0,2,0,0,0,1|1,0,0]=4 18800 B13R1.147 C=C(F)CN(C)c1cccc(c1)F 2230a_100020633736_100009893438 [0,2,0,0,0,1|1,0,0]=4 18801 B13R1.147 C=C(F)CN(C)c1cccc(c1)F 269982a_100020633736_100009893438 [0,2,0,0,0,1|1,0,0]=4 18802 B13R1.147 C=C(F)CN(C)c1cccc(c1)F 34a_100020633736_100009893438 [0,2,0,0,0,1|1,0,0]=4 18803 B13R1.147 C=C(F)CN(C)c1cccc(c1)I 2230a_100000221217_100009893438 [0,2,0,0,0,1|1,0,0]=4 18804 B13R1.147 C=C(F)CN(C)c1cccc(c1)I 269982a_100000221217_100009893438 [0,2,0,0,0,1|1,0,0]=4 18805 B13R1.147 C=C(F)CN(C)c1cccc(c1)I 34a_100000221217_100009893438 [0,2,0,0,0,1|1,0,0]=4 18806 B13R1.147 C=C(F)CN(C)c1cccc(c1)O 2230a_100000756613_100009893438 [0,2,0,0,0,1|1,0,0]=4 18807 B13R1.147 C=C(F)CN(C)c1cccc(c1)O 269982a_100000756613_100009893438 [0,2,0,0,0,1|1,0,0]=4 18808 B13R1.147 C=C(F)CN(C)c1cccc(c1)O 34a_100000756613_100009893438 [0,2,0,0,0,1|1,0,0]=4 18809 B13R1.147 CC(=O)CC(=O)c1cccc(c1)Br 1458a_100000070787_100000212080 [0,2,0,0,0,1|1,0,0]=4 18810 B13R1.147 CC(=O)CC(=O)c1cccc(c1)C 1458a_100000070787_100000739480 [0,2,0,0,0,1|1,0,0]=4 18811 B13R1.147 CC(=O)CC(=O)c1cccc(c1)Cl 1458a_100000070787_100000211444 [0,2,0,0,0,1|1,0,0]=4 18812 B13R1.147 CC(=O)CC(=O)c1cccc(c1)F 1458a_100000070787_100000215616 [0,2,0,0,0,1|1,0,0]=4 18813 B13R1.147 CC(=O)CC(=O)c1cccc(c1)O 1458a_100000070787_100009813753 [0,2,0,0,0,1|1,0,0]=4 18814 B13R1.147 CC(=O)C[C@H](O)c1cccc(c1)Cl 1458a_100010423400_200000210301 [0,2,0,0,0,1|1,0,0]=4 18815 B13R1.147 CC(=O)NC(C)c1cccc(c1)Br 11a_100020642005_100015343762 [0,2,0,0,0,1|1,0,0]=4 18816 B13R1.147 CC(=O)NC(C)c1cccc(c1)Br 1626a_100020642005_100015343762 [0,2,0,0,0,1|1,0,0]=4 18817 B13R1.147 CC(=O)NC(C)c1cccc(c1)Br 240690a_100020642005_100015343762 [0,2,0,0,0,1|1,0,0]=4 18818 B13R1.147 CC(=O)NC(C)c1cccc(c1)Br 527a_100020642005_100103153847 [0,2,0,0,0,1|1,0,0]=4 18819 B13R1.147 CC(=O)NC(C)c1cccc(c1)Cl 11a_100102723534_100015343762 [0,2,0,0,0,1|1,0,0]=4 18820 B13R1.147 CC(=O)NC(C)c1cccc(c1)Cl 1626a_100102723534_100015343762 [0,2,0,0,0,1|1,0,0]=4 18821 B13R1.147 CC(=O)NC(C)c1cccc(c1)Cl 240690a_100102723534_100015343762 [0,2,0,0,0,1|1,0,0]=4 18822 B13R1.147 CC(=O)NC(C)c1cccc(c1)Cl 527a_100102723534_100103153847 [0,2,0,0,0,1|1,0,0]=4 18823 B13R1.147 CC(=O)NC(C)c1cccc(c1)O 240690a_100000740644_100015343762 [0,2,0,0,0,1|1,0,0]=4 18824 B13R1.147 CC(=O)NC(C)c1cccc(c1)O 527a_100000740644_100103153847 [0,2,0,0,0,1|1,0,0]=4 18825 B13R1.147 CC(=O)N[C@H](C)c1cccc(c1)C 11a_100000698126_100015343762 [0,2,0,0,0,1|1,0,0]=4 18826 B13R1.147 CC(=O)N[C@H](C)c1cccc(c1)C 1626a_100000698126_100015343762 [0,2,0,0,0,1|1,0,0]=4 18827 B13R1.147 CC(=O)N[C@H](C)c1cccc(c1)C 240690a_100000698126_100015343762 [0,2,0,0,0,1|1,0,0]=4 18828 B13R1.147 CC(=O)N[C@H](C)c1cccc(c1)C 527a_100000698126_100103153847 [0,2,0,0,0,1|1,0,0]=4 18829 B13R1.147 CC(=O)N[C@H](C)c1cccc(c1)F 11a_100015193778_100015343762 [0,2,0,0,0,1|1,0,0]=4 18830 B13R1.147 CC(=O)N[C@H](C)c1cccc(c1)F 1626a_100015193778_100015343762 [0,2,0,0,0,1|1,0,0]=4 18831 B13R1.147 CC(=O)N[C@H](C)c1cccc(c1)F 240690a_100015193778_100015343762 [0,2,0,0,0,1|1,0,0]=4 18832 B13R1.147 CC(=O)N[C@H](C)c1cccc(c1)F 527a_100015193778_100103153847 [0,2,0,0,0,1|1,0,0]=4 18833 B13R1.147 [13CH3]C(=O)C[C@H](O)c1cccc(c1)Cl 1458a_100010423400_200025704644 [0,2,0,0,0,1|1,0,0]=4 18834 B13R1.201 C=C(C)CC(=O)c1ccccc1Br 1458a_100000188424_100000748629 [0,2,0,0,0,1|0,0,0]=3 18835 B13R1.201 C=C(C)CC(=O)c1ccccc1C 1458a_100000212026_100000748629 [0,2,0,0,0,1|0,0,0]=3 18836 B13R1.201 C=C(C)CC(=O)c1ccccc1Cl 1458a_100000185844_100000748629 [0,2,0,0,0,1|0,0,0]=3 18837 B13R1.201 C=C(C)CC(=O)c1ccccc1F 1458a_100000188656_100000748629 [0,2,0,0,0,1|0,0,0]=3 18838 B13R1.201 C=C(C)CC(=O)c1ccccc1I 1458a_100000187884_100000748629 [0,2,0,0,0,1|0,0,0]=3 18839 B13R1.201 C=C(C)CC(=O)c1ccccc1O 1458a_100015234032_100000748629 [0,2,0,0,0,1|0,0,0]=3 18840 B13R1.201 C=C(C)CC(=O)c1ccccc1[O-] 1458a_100009911694_100000748629 [0,2,0,0,0,1|0,0,0]=3 18841 B13R1.201 C=C(C)CN(C)c1ccccc1Br 2230a_100020606079_100000748629 [0,2,0,0,0,1|0,0,0]=3 18842 B13R1.201 C=C(C)CN(C)c1ccccc1Br 269982a_100020606079_100000748629 [0,2,0,0,0,1|0,0,0]=3 18843 B13R1.201 C=C(C)CN(C)c1ccccc1Br 34a_100020606079_100000748629 [0,2,0,0,0,1|0,0,0]=3 18844 B13R1.201 C=C(C)CN(C)c1ccccc1C 2230a_100000219699_100000748629 [0,2,0,0,0,1|0,0,0]=3 18845 B13R1.201 C=C(C)CN(C)c1ccccc1C 269982a_100000219699_100000748629 [0,2,0,0,0,1|0,0,0]=3 18846 B13R1.201 C=C(C)CN(C)c1ccccc1C 34a_100000219699_100000748629 [0,2,0,0,0,1|0,0,0]=3 18847 B13R1.201 C=C(C)CN(C)c1ccccc1Cl 2230a_100000219374_100000748629 [0,2,0,0,0,1|0,0,0]=3 18848 B13R1.201 C=C(C)CN(C)c1ccccc1Cl 269982a_100000219374_100000748629 [0,2,0,0,0,1|0,0,0]=3 18849 B13R1.201 C=C(C)CN(C)c1ccccc1Cl 34a_100000219374_100000748629 [0,2,0,0,0,1|0,0,0]=3 18850 B13R1.201 C=C(C)CN(C)c1ccccc1F 2230a_100000220357_100000748629 [0,2,0,0,0,1|0,0,0]=3 18851 B13R1.201 C=C(C)CN(C)c1ccccc1F 269982a_100000220357_100000748629 [0,2,0,0,0,1|0,0,0]=3 18852 B13R1.201 C=C(C)CN(C)c1ccccc1F 34a_100000220357_100000748629 [0,2,0,0,0,1|0,0,0]=3 18853 B13R1.201 C=C(C)CN(C)c1ccccc1F 38a_100000220357_100000748629 [0,2,0,0,0,1|0,0,0]=3 18854 B13R1.201 C=C(C)CN(C)c1ccccc1O 269982a_100000033821_100000748629 [0,2,0,0,0,1|0,0,0]=3 18855 B13R1.201 C=C(C)CN(C)c1ccncc1Br 27a_100000225649_100000726257 [0,2,0,0,0,1|1,0,0]=4 18856 B13R1.201 C=C(C)CN(C)c1ccncc1C 27a_100000225649_100000765111 [0,2,0,0,0,1|1,0,0]=4 18857 B13R1.201 C=C(C)CN(C)c1ccncc1F 27a_100000225649_100000035921 [0,2,0,0,0,1|1,0,0]=4 18858 B13R1.201 C=C(C)CN(C)c1ncccc1Br 27a_100000225649_100000696092 [0,2,0,0,0,1|1,0,0]=4 18859 B13R1.201 C=C(F)CC(=O)c1ccccc1Br 1458a_100000188424_100009893438 [0,2,0,0,0,1|1,0,0]=4 18860 B13R1.201 C=C(F)CC(=O)c1ccccc1C 1458a_100000212026_100009893438 [0,2,0,0,0,1|1,0,0]=4 18861 B13R1.201 C=C(F)CC(=O)c1ccccc1Cl 1458a_100000185844_100009893438 [0,2,0,0,0,1|1,0,0]=4 18862 B13R1.201 C=C(F)CC(=O)c1ccccc1F 1458a_100000188656_100009893438 [0,2,0,0,0,1|1,0,0]=4 18863 B13R1.201 C=C(F)CC(=O)c1ccccc1I 1458a_100000187884_100009893438 [0,2,0,0,0,1|1,0,0]=4 18864 B13R1.201 C=C(F)CC(=O)c1ccccc1O 1458a_100015234032_100009893438 [0,2,0,0,0,1|1,0,0]=4 18865 B13R1.201 C=C(F)CC(=O)c1ccccc1[O-] 1458a_100009911694_100009893438 [0,2,0,0,0,1|1,0,0]=4 18866 B13R1.201 C=C(F)CN(C)c1ccccc1Br 2230a_100020606079_100009893438 [0,2,0,0,0,1|1,0,0]=4 18867 B13R1.201 C=C(F)CN(C)c1ccccc1Br 269982a_100020606079_100009893438 [0,2,0,0,0,1|1,0,0]=4 18868 B13R1.201 C=C(F)CN(C)c1ccccc1Br 34a_100020606079_100009893438 [0,2,0,0,0,1|1,0,0]=4 18869 B13R1.201 C=C(F)CN(C)c1ccccc1C 2230a_100000219699_100009893438 [0,2,0,0,0,1|1,0,0]=4 18870 B13R1.201 C=C(F)CN(C)c1ccccc1C 269982a_100000219699_100009893438 [0,2,0,0,0,1|1,0,0]=4 18871 B13R1.201 C=C(F)CN(C)c1ccccc1C 34a_100000219699_100009893438 [0,2,0,0,0,1|1,0,0]=4 18872 B13R1.201 C=C(F)CN(C)c1ccccc1Cl 2230a_100000219374_100009893438 [0,2,0,0,0,1|1,0,0]=4 18873 B13R1.201 C=C(F)CN(C)c1ccccc1Cl 269982a_100000219374_100009893438 [0,2,0,0,0,1|1,0,0]=4 18874 B13R1.201 C=C(F)CN(C)c1ccccc1Cl 34a_100000219374_100009893438 [0,2,0,0,0,1|1,0,0]=4 18875 B13R1.201 C=C(F)CN(C)c1ccccc1F 2230a_100000220357_100009893438 [0,2,0,0,0,1|1,0,0]=4 18876 B13R1.201 C=C(F)CN(C)c1ccccc1F 269982a_100000220357_100009893438 [0,2,0,0,0,1|1,0,0]=4 18877 B13R1.201 C=C(F)CN(C)c1ccccc1F 34a_100000220357_100009893438 [0,2,0,0,0,1|1,0,0]=4 18878 B13R1.201 C=C(F)CN(C)c1ccccc1F 38a_100000220357_100009893438 [0,2,0,0,0,1|1,0,0]=4 18879 B13R1.201 C=C(F)CN(C)c1ccccc1O 269982a_100000033821_100009893438 [0,2,0,0,0,1|1,0,0]=4 18880 B13R1.201 CC(=O)CC(=O)c1ccccc1Br 1458a_100000070787_100000199116 [0,2,0,0,0,1|1,0,0]=4 18881 B13R1.201 CC(=O)CC(=O)c1ccccc1C 1458a_100000070787_100000741374 [0,2,0,0,0,1|1,0,0]=4 18882 B13R1.201 CC(=O)CC(=O)c1ccccc1Cl 1458a_100000070787_100000211432 [0,2,0,0,0,1|1,0,0]=4 18883 B13R1.201 CC(=O)CC(=O)c1ccccc1F 1458a_100000070787_100000204681 [0,2,0,0,0,1|1,0,0]=4 18884 B13R1.201 CC(=O)CC(=O)c1ccccc1O 1458a_100000070787_100000188908 [0,2,0,0,0,1|1,0,0]=4 18885 B13R1.201 CC(=O)CC(=O)c1ccccc1O 271570a_203496583355_200011243946 [0,2,0,0,0,1|1,0,0]=4 18886 B13R1.201 CC(=O)CC(C)c1ccccc1Br 1458a_100000743458_200000210301 [0,2,0,0,0,1|1,0,0]=4 18887 B13R1.201 CC(=O)CC(C)c1ccccc1Cl 1458a_100012184337_200000210301 [0,2,0,0,0,1|1,0,0]=4 18888 B13R1.201 CC(=O)NC(C)c1ccccc1Br 11a_100000181357_100015343762 [0,2,0,0,0,1|1,0,0]=4 18889 B13R1.201 CC(=O)NC(C)c1ccccc1Br 1626a_100000181357_100015343762 [0,2,0,0,0,1|1,0,0]=4 18890 B13R1.201 CC(=O)NC(C)c1ccccc1Br 240690a_100000181357_100015343762 [0,2,0,0,0,1|1,0,0]=4 18891 B13R1.201 CC(=O)NC(C)c1ccccc1Br 527a_100000181357_100103153847 [0,2,0,0,0,1|1,0,0]=4 18892 B13R1.201 CC(=O)NC(C)c1ccccc1C 11a_100000181355_100015343762 [0,2,0,0,0,1|1,0,0]=4 18893 B13R1.201 CC(=O)NC(C)c1ccccc1C 1626a_100000181355_100015343762 [0,2,0,0,0,1|1,0,0]=4 18894 B13R1.201 CC(=O)NC(C)c1ccccc1C 240690a_100000181355_100015343762 [0,2,0,0,0,1|1,0,0]=4 18895 B13R1.201 CC(=O)NC(C)c1ccccc1C 527a_100000181355_100103153847 [0,2,0,0,0,1|1,0,0]=4 18896 B13R1.201 CC(=O)NC(C)c1ccccc1Cl 11a_100000174978_100015343762 [0,2,0,0,0,1|1,0,0]=4 18897 B13R1.201 CC(=O)NC(C)c1ccccc1Cl 1626a_100000174978_100015343762 [0,2,0,0,0,1|1,0,0]=4 18898 B13R1.201 CC(=O)NC(C)c1ccccc1Cl 240690a_100000174978_100015343762 [0,2,0,0,0,1|1,0,0]=4 18899 B13R1.201 CC(=O)NC(C)c1ccccc1Cl 527a_100000174978_100103153847 [0,2,0,0,0,1|1,0,0]=4 18900 B13R1.201 CC(=O)NC(C)c1ccccc1F 11a_100000181408_100015343762 [0,2,0,0,0,1|1,0,0]=4 18901 B13R1.201 CC(=O)NC(C)c1ccccc1F 1626a_100000181408_100015343762 [0,2,0,0,0,1|1,0,0]=4 18902 B13R1.201 CC(=O)NC(C)c1ccccc1F 240690a_100000181408_100015343762 [0,2,0,0,0,1|1,0,0]=4 18903 B13R1.201 CC(=O)NC(C)c1ccccc1F 527a_100000181408_100103153847 [0,2,0,0,0,1|1,0,0]=4 18904 B13R1.201 CC(=O)N[C@H](C)c1ccccc1O 240690a_100025703389_100015343762 [0,2,0,0,0,1|1,0,0]=4 18905 B13R1.201 CC(=O)N[C@H](C)c1ccccc1O 527a_100025703389_100103153847 [0,2,0,0,0,1|1,0,0]=4 18906 B13R1.201 CC(CC(=O)[13CH3])c1ccccc1Br 1458a_100000743458_200025704644 [0,2,0,0,0,1|1,0,0]=4 18907 B13R1.201 CC(CC(=O)[13CH3])c1ccccc1Cl 1458a_100012184337_200025704644 [0,2,0,0,0,1|1,0,0]=4 18908 B13R1.347 CC(=O)CC(C)(C)c1ccccc1 1458a_100011409233_200000210301 [0,2,0,0,0,1|1,0,0]=4 18909 B13R1.347 CC(=O)CS(=O)(=O)c1ccccc1 1458a_100000070787_100000240042 [0,2,0,0,0,1|1,0,0]=4 18910 B13R1.347 CC(=O)CS(=O)(=O)c1ccccc1 1458a_100000187771_200000210301 [0,2,0,0,0,1|1,0,0]=4 18911 B13R1.347 CC(=O)C[Si](C)(C)c1ccccc1 1458a_100000070787_100000038972 [0,2,0,0,0,1|1,0,0]=4 18912 B13R1.347 CC(=O)NC(C)(C)c1ccccc1 11a_100011218174_100015343762 [0,2,0,0,0,1|1,0,0]=4 18913 B13R1.347 CC(=O)NC(C)(C)c1ccccc1 1626a_100011218174_100015343762 [0,2,0,0,0,1|1,0,0]=4 18914 B13R1.347 CC(=O)NC(C)(C)c1ccccc1 240690a_100011218174_100015343762 [0,2,0,0,0,1|1,0,0]=4 18915 B13R1.347 CC(=O)NC(C)(C)c1ccccc1 527a_100011218174_100103153847 [0,2,0,0,0,1|1,0,0]=4 18916 B13R1.347 CC(C)(CC(=O)[13CH3])c1ccccc1 1458a_100011409233_200025704644 [0,2,0,0,0,1|1,0,0]=4 18917 B13R1.347 [13CH3]C(=O)CS(=O)(=O)c1ccccc1 1458a_100000187771_200025704644 [0,2,0,0,0,1|1,0,0]=4 18918 B13R1.713 C=C(C)CN(CC)c1ccccc1 2230a_100000210013_100000748629 [0,2,0,0,0,1|0,0,0]=3 18919 B13R1.713 C=C(C)CN(CC)c1ccccc1 269982a_100000210013_100000748629 [0,2,0,0,0,1|0,0,0]=3 18920 B13R1.713 C=C(C)CN(CC)c1ccccc1 34a_100000210013_100000748629 [0,2,0,0,0,1|0,0,0]=3 18921 B13R1.713 C=C(F)CN(CC)c1ccccc1 2230a_100000210013_100009893438 [0,2,0,0,0,1|1,0,0]=4 18922 B13R1.713 C=C(F)CN(CC)c1ccccc1 269982a_100000210013_100009893438 [0,2,0,0,0,1|1,0,0]=4 18923 B13R1.713 C=C(F)CN(CC)c1ccccc1 34a_100000210013_100009893438 [0,2,0,0,0,1|1,0,0]=4 18924 B13R1.713 CC(=O)CC(C#N)c1ccccc1 1458a_200000079825_200000210301 [0,2,0,0,0,1|1,0,0]=4 18925 B13R1.713 CC(=O)CC(CO)c1ccccc1 1458a_106726389045_200000210301 [0,2,0,0,0,1|1,0,0]=4 18926 B13R1.713 CC(=O)NC(C#N)c1ccccc1 1626a_100020627052_100015343762 [0,2,0,0,0,1|1,0,0]=4 18927 B13R1.713 CC(=O)NC(C#N)c1ccccc1 240690a_100020627052_100015343762 [0,2,0,0,0,1|1,0,0]=4 18928 B13R1.713 CC(=O)N[C@H](CO)c1ccccc1 240690a_100000751927_100015343762 [0,2,0,0,0,1|1,0,0]=4 18929 B13R1.713 CC(=O)N[C@H](CO)c1ccccc1 527a_100000751927_100103153847 [0,2,0,0,0,1|1,0,0]=4 18930 B13R1.713 CCC(NC(=O)C)c1ccccc1 11a_100000737752_100015343762 [0,2,0,0,0,1|1,0,0]=4 18931 B13R1.713 CCC(NC(=O)C)c1ccccc1 1626a_100000737752_100015343762 [0,2,0,0,0,1|1,0,0]=4 18932 B13R1.713 CCC(NC(=O)C)c1ccccc1 240690a_100000737752_100015343762 [0,2,0,0,0,1|1,0,0]=4 18933 B13R1.713 CCC(NC(=O)C)c1ccccc1 527a_100000737752_100103153847 [0,2,0,0,0,1|1,0,0]=4 18934 B13R1.713 [13CH3]C(=O)CC(C#N)c1ccccc1 1458a_200000079825_200025704644 [0,2,0,0,0,1|1,0,0]=4 18935 B13R1.713 [13CH3]C(=O)CC(CO)c1ccccc1 1458a_106726389045_200025704644 [0,2,0,0,0,1|1,0,0]=4 18936 B13R1.90 C#Cc1ccccc1CNC(=O)C 11a_100020634229_100015343762 [0,2,0,0,0,1|1,0,0]=4 18937 B13R1.90 C#Cc1ccccc1CNC(=O)C 1626a_100020634229_100015343762 [0,2,0,0,0,1|1,0,0]=4 18938 B13R1.90 C#Cc1ccccc1CNC(=O)C 240690a_100020634229_100015343762 [0,2,0,0,0,1|1,0,0]=4 18939 B13R1.90 C#Cc1ccccc1CNC(=O)C 527a_100020634229_100103153847 [0,2,0,0,0,1|1,0,0]=4 18940 B13R1.90 C#Cc1ccccc1NCC(=C)C 34a_100011470550_100000748629 [0,2,0,0,0,1|0,0,0]=3 18941 B13R1.90 C#Cc1ccccc1NCC(=C)F 34a_100011470550_100009893438 [0,2,0,0,0,1|1,0,0]=4 18942 B13R1.90 C#Cc1ccccc1OCC(=C)C 34a_200011470546_100000748629 [0,2,0,0,0,1|0,0,0]=3 18943 B13R1.90 C#Cc1ccccc1OCC(=C)C 7a_200011470546_100000748629 [0,2,0,0,0,1|0,0,0]=3 18944 B13R1.90 C#Cc1ccccc1OCC(=C)F 34a_200011470546_100009893438 [0,2,0,0,0,1|1,0,0]=4 18945 B13R1.90 C#Cc1ccccc1OCC(=C)F 7a_200011470546_100000042424 [0,2,0,0,0,1|1,0,0]=4 18946 B13R1.90 C=C(C)CNc1ccccc1C#N 34a_100000211148_100000748629 [0,2,0,0,0,1|0,0,0]=3 18947 B13R1.90 C=C(C)CNc1ccccc1CC 2230a_100000212081_100000748629 [0,2,0,0,0,1|0,0,0]=3 18948 B13R1.90 C=C(C)CNc1ccccc1CC 34a_100000212081_100000748629 [0,2,0,0,0,1|0,0,0]=3 18949 B13R1.90 C=C(C)CNc1ccccc1CC 7a_100000212081_100000748629 [0,2,0,0,0,1|0,0,0]=3 18950 B13R1.90 C=C(C)CNc1ccccc1CO 34a_100000212039_100000748629 [0,2,0,0,0,1|0,0,0]=3 18951 B13R1.90 C=C(C)CNc1ccccc1OC 34a_100000210025_100000748629 [0,2,0,0,0,1|0,0,0]=3 18952 B13R1.90 C=C(C)CNc1ccccc1SC 34a_100000211160_100000748629 [0,2,0,0,0,1|0,0,0]=3 18953 B13R1.90 C=C(C)CNc1ccncc1C#N 27a_100000765925_100000687039 [0,2,0,0,0,1|1,0,0]=4 18954 B13R1.90 C=C(C)CNc1ccncc1CO 27a_100000765925_100000117392 [0,2,0,0,0,1|1,0,0]=4 18955 B13R1.90 C=C(C)CNc1cnccc1C#N 27a_100000765925_100000684818 [0,2,0,0,0,1|1,0,0]=4 18956 B13R1.90 C=C(C)CNc1ncccc1C#N 27a_100000765925_100000211984 [0,2,0,0,0,1|1,0,0]=4 18957 B13R1.90 C=C(C)COc1ccccc1C#N 34a_100000211048_100000748629 [0,2,0,0,0,1|0,0,0]=3 18958 B13R1.90 C=C(C)COc1ccccc1C#N 7a_100000211048_100000748629 [0,2,0,0,0,1|0,0,0]=3 18959 B13R1.90 C=C(C)COc1ccccc1CC 34a_100000210936_100000748629 [0,2,0,0,0,1|0,0,0]=3 18960 B13R1.90 C=C(C)COc1ccccc1CC 7a_100000210936_100000748629 [0,2,0,0,0,1|0,0,0]=3 18961 B13R1.90 C=C(C)COc1ccccc1CN 34a_100000185550_100000748629 [0,2,0,0,0,1|0,0,0]=3 18962 B13R1.90 C=C(C)COc1ccccc1CO 34a_100011216872_100000748629 [0,2,0,0,0,1|0,0,0]=3 18963 B13R1.90 C=C(C)COc1ccccc1NC 2230a_100000243823_200000210301 [0,2,0,0,0,1|0,0,0]=3 18964 B13R1.90 C=C(C)COc1ccccc1NC 34a_100000033821_100000748629 [0,2,0,0,0,1|0,0,0]=3 18965 B13R1.90 C=C(C)COc1ccccc1NC 34a_100000243823_200000210301 [0,2,0,0,0,1|0,0,0]=3 18966 B13R1.90 C=C(C)COc1ccccc1N[13CH3] 2230a_100000243823_200025704644 [0,2,0,0,0,1|0,0,0]=3 18967 B13R1.90 C=C(C)COc1ccccc1N[13CH3] 34a_100000243823_200025704644 [0,2,0,0,0,1|0,0,0]=3 18968 B13R1.90 C=C(C)COc1ccccc1OC 34a_100000210385_100000748629 [0,2,0,0,0,1|0,0,0]=3 18969 B13R1.90 C=C(C)COc1ccccc1SC 34a_100011216402_100000748629 [0,2,0,0,0,1|0,0,0]=3 18970 B13R1.90 C=C(C)COc1cccnc1C#N 34a_100000722750_100000748629 [0,2,0,0,0,1|1,0,0]=4 18971 B13R1.90 C=C(C)COc1cccnc1C#N 7a_100000722750_100000748629 [0,2,0,0,0,1|1,0,0]=4 18972 B13R1.90 C=C(C)COc1cccnc1CBr 34a_200020655725_100000748629 [0,2,0,0,0,1|1,0,0]=4 18973 B13R1.90 C=C(C)COc1cccnc1CBr 7a_200020655725_100000748629 [0,2,0,0,0,1|1,0,0]=4 18974 B13R1.90 C=C(C)COc1cccnc1CO 34a_100000731849_100000748629 [0,2,0,0,0,1|1,0,0]=4 18975 B13R1.90 C=C(C)COc1cccnc1OC 34a_100000698397_100000748629 [0,2,0,0,0,1|1,0,0]=4 18976 B13R1.90 C=C(C)COc1cccnc1OC 7a_100000698397_100000748629 [0,2,0,0,0,1|1,0,0]=4 18977 B13R1.90 C=C(C)COc1cnccc1C#N 7a_100012181322_100000748629 [0,2,0,0,0,1|1,0,0]=4 18978 B13R1.90 C=C(C)COc1cnccc1CO 34a_100000078615_100000748629 [0,2,0,0,0,1|1,0,0]=4 18979 B13R1.90 C=C(C)COc1cnccc1OC 34a_100000101186_100000748629 [0,2,0,0,0,1|1,0,0]=4 18980 B13R1.90 C=C(C)COc1ncccc1OC 34a_100025773188_100000748629 [0,2,0,0,0,1|1,0,0]=4 18981 B13R1.90 C=C(C)CSc1ccccc1C#N 62a_100000748629_100000188569 [0,2,0,0,0,1|0,0,0]=3 18982 B13R1.90 C=C(C)CSc1ccccc1C=O 62a_100000210073_100000211660 [0,2,0,0,0,1|0,0,0]=3 18983 B13R1.90 C=C(C)CSc1ccccc1C=O 62a_100000748629_100000210073 [0,2,0,0,0,1|0,0,0]=3 18984 B13R1.90 C=C(C)CSc1ccccc1CC 62a_100000748629_100011215823 [0,2,0,0,0,1|0,0,0]=3 18985 B13R1.90 C=C(C)CSc1ccccc1CC 62a_100011215823_100000211660 [0,2,0,0,0,1|0,0,0]=3 18986 B13R1.90 C=C(C)CSc1ccccc1CN 62a_100000689332_100000211660 [0,2,0,0,0,1|0,0,0]=3 18987 B13R1.90 C=C(C)CSc1ccccc1CN 62a_100000748629_100000689332 [0,2,0,0,0,1|0,0,0]=3 18988 B13R1.90 C=C(C)CSc1ccccc1CO 62a_100000187465_100000211660 [0,2,0,0,0,1|0,0,0]=3 18989 B13R1.90 C=C(C)CSc1ccccc1CO 62a_100000748629_100000187465 [0,2,0,0,0,1|0,0,0]=3 18990 B13R1.90 C=C(C)CSc1ccccc1NC 62a_100000748629_100020606079 [0,2,0,0,0,1|0,0,0]=3 18991 B13R1.90 C=C(C)CSc1ccccc1NC 62a_100020606079_100000211660 [0,2,0,0,0,1|0,0,0]=3 18992 B13R1.90 C=C(C)CSc1ccccc1NN 62a_100000241748_100000211660 [0,2,0,0,0,1|0,0,0]=3 18993 B13R1.90 C=C(C)CSc1ccccc1NN 62a_100000748629_100000241748 [0,2,0,0,0,1|0,0,0]=3 18994 B13R1.90 C=C(C)CSc1ccccc1OC 62a_100000210334_100000211660 [0,2,0,0,0,1|0,0,0]=3 18995 B13R1.90 C=C(C)CSc1ccccc1OC 62a_100000748629_100000210334 [0,2,0,0,0,1|0,0,0]=3 18996 B13R1.90 C=C(C)CSc1ccccc1SC 62a_100000748629_100011217816 [0,2,0,0,0,1|0,0,0]=3 18997 B13R1.90 C=C(C)CSc1ccccc1SC 62a_100011217816_100000211660 [0,2,0,0,0,1|0,0,0]=3 18998 B13R1.90 C=C(C)CSc1cccnc1C#N 62a_100000748629_100000685805 [0,2,0,0,0,1|1,0,0]=4 18999 B13R1.90 C=C(C)CSc1cccnc1C=O 62a_100000748629_100011934733 [0,2,0,0,0,1|1,0,0]=4 19000 B13R1.90 C=C(C)CSc1cccnc1C=O 62a_100011934733_100000211660 [0,2,0,0,0,1|1,0,0]=4 19001 B13R1.90 C=C(C)CSc1cccnc1CC 62a_100000748629_100009877225 [0,2,0,0,0,1|1,0,0]=4 19002 B13R1.90 C=C(C)CSc1cccnc1CC 62a_100009877225_100000211660 [0,2,0,0,0,1|1,0,0]=4 19003 B13R1.90 C=C(C)CSc1cccnc1CN 62a_100000748629_100020591323 [0,2,0,0,0,1|1,0,0]=4 19004 B13R1.90 C=C(C)CSc1cccnc1CN 62a_100020591323_100000211660 [0,2,0,0,0,1|1,0,0]=4 19005 B13R1.90 C=C(C)CSc1cccnc1CO 62a_100000748629_100011996772 [0,2,0,0,0,1|1,0,0]=4 19006 B13R1.90 C=C(C)CSc1cccnc1CO 62a_100011996772_100000211660 [0,2,0,0,0,1|1,0,0]=4 19007 B13R1.90 C=C(C)CSc1cccnc1NC 62a_100000700899_100000211660 [0,2,0,0,0,1|1,0,0]=4 19008 B13R1.90 C=C(C)CSc1cccnc1NC 62a_100000748629_100000700899 [0,2,0,0,0,1|1,0,0]=4 19009 B13R1.90 C=C(C)CSc1cccnc1NN 62a_100000748629_100011464834 [0,2,0,0,0,1|1,0,0]=4 19010 B13R1.90 C=C(C)CSc1cccnc1NN 62a_100011464834_100000211660 [0,2,0,0,0,1|1,0,0]=4 19011 B13R1.90 C=C(C)CSc1cccnc1OC 62a_100000047025_100000211660 [0,2,0,0,0,1|1,0,0]=4 19012 B13R1.90 C=C(C)CSc1cccnc1OC 62a_100000748629_100000047025 [0,2,0,0,0,1|1,0,0]=4 19013 B13R1.90 C=C(C)CSc1cccnc1SC 62a_100000748629_100011465278 [0,2,0,0,0,1|1,0,0]=4 19014 B13R1.90 C=C(C)CSc1cccnc1SC 62a_100011465278_100000211660 [0,2,0,0,0,1|1,0,0]=4 19015 B13R1.90 C=C(C)CSc1ccncc1C#N 62a_100000748629_100000687039 [0,2,0,0,0,1|1,0,0]=4 19016 B13R1.90 C=C(C)CSc1ccncc1C=O 62a_100000050567_100000211660 [0,2,0,0,0,1|1,0,0]=4 19017 B13R1.90 C=C(C)CSc1ccncc1C=O 62a_100000748629_100000050567 [0,2,0,0,0,1|1,0,0]=4 19018 B13R1.90 C=C(C)CSc1ccncc1CC 62a_100000748629_100025704421 [0,2,0,0,0,1|1,0,0]=4 19019 B13R1.90 C=C(C)CSc1ccncc1CC 62a_100025704421_100000211660 [0,2,0,0,0,1|1,0,0]=4 19020 B13R1.90 C=C(C)CSc1ccncc1CO 62a_100000117392_100000211660 [0,2,0,0,0,1|1,0,0]=4 19021 B13R1.90 C=C(C)CSc1ccncc1CO 62a_100000748629_100000117392 [0,2,0,0,0,1|1,0,0]=4 19022 B13R1.90 C=C(C)CSc1ccncc1OC 62a_100000748629_100016988167 [0,2,0,0,0,1|1,0,0]=4 19023 B13R1.90 C=C(C)CSc1ccncc1OC 62a_100016988167_100000211660 [0,2,0,0,0,1|1,0,0]=4 19024 B13R1.90 C=C(C)CSc1cnccc1C#N 62a_100000748629_100000684818 [0,2,0,0,0,1|1,0,0]=4 19025 B13R1.90 C=C(C)CSc1cnccc1C=O 62a_100000748629_100011934409 [0,2,0,0,0,1|1,0,0]=4 19026 B13R1.90 C=C(C)CSc1cnccc1C=O 62a_100011934409_100000211660 [0,2,0,0,0,1|1,0,0]=4 19027 B13R1.90 C=C(C)CSc1cnccc1CC 62a_100000748629_100009819861 [0,2,0,0,0,1|1,0,0]=4 19028 B13R1.90 C=C(C)CSc1cnccc1CC 62a_100009819861_100000211660 [0,2,0,0,0,1|1,0,0]=4 19029 B13R1.90 C=C(C)CSc1cnccc1CN 62a_100000748629_100020640021 [0,2,0,0,0,1|1,0,0]=4 19030 B13R1.90 C=C(C)CSc1cnccc1CN 62a_100020640021_100000211660 [0,2,0,0,0,1|1,0,0]=4 19031 B13R1.90 C=C(C)CSc1cnccc1CO 62a_100000748629_100009873359 [0,2,0,0,0,1|1,0,0]=4 19032 B13R1.90 C=C(C)CSc1cnccc1CO 62a_100009873359_100000211660 [0,2,0,0,0,1|1,0,0]=4 19033 B13R1.90 C=C(C)CSc1cnccc1NC 62a_100000748629_100010069531 [0,2,0,0,0,1|1,0,0]=4 19034 B13R1.90 C=C(C)CSc1cnccc1NC 62a_100010069531_100000211660 [0,2,0,0,0,1|1,0,0]=4 19035 B13R1.90 C=C(C)CSc1cnccc1NN 62a_100000748629_100013404636 [0,2,0,0,0,1|1,0,0]=4 19036 B13R1.90 C=C(C)CSc1cnccc1NN 62a_100013404636_100000211660 [0,2,0,0,0,1|1,0,0]=4 19037 B13R1.90 C=C(C)CSc1cnccc1OC 62a_100000748629_100011997281 [0,2,0,0,0,1|1,0,0]=4 19038 B13R1.90 C=C(C)CSc1cnccc1OC 62a_100011997281_100000211660 [0,2,0,0,0,1|1,0,0]=4 19039 B13R1.90 C=C(C)CSc1ncccc1C#N 62a_100000748629_100000211984 [0,2,0,0,0,1|1,0,0]=4 19040 B13R1.90 C=C(C)CSc1ncccc1C=O 62a_100000748629_100009816751 [0,2,0,0,0,1|1,0,0]=4 19041 B13R1.90 C=C(C)CSc1ncccc1C=O 62a_100009816751_100000211660 [0,2,0,0,0,1|1,0,0]=4 19042 B13R1.90 C=C(C)CSc1ncccc1CN 62a_100000748629_100015189234 [0,2,0,0,0,1|1,0,0]=4 19043 B13R1.90 C=C(C)CSc1ncccc1CN 62a_100015189234_100000211660 [0,2,0,0,0,1|1,0,0]=4 19044 B13R1.90 C=C(C)CSc1ncccc1CO 62a_100000748629_100000748726 [0,2,0,0,0,1|1,0,0]=4 19045 B13R1.90 C=C(C)CSc1ncccc1CO 62a_100000748726_100000211660 [0,2,0,0,0,1|1,0,0]=4 19046 B13R1.90 C=C(C)CSc1ncccc1NC 62a_100000748629_200011806188 [0,2,0,0,0,1|1,0,0]=4 19047 B13R1.90 C=C(C)CSc1ncccc1OC 62a_100000748629_100000690851 [0,2,0,0,0,1|1,0,0]=4 19048 B13R1.90 C=C(C)CSc1ncccc1OC 62a_100000767102_100000211660 [0,2,0,0,0,1|1,0,0]=4 19049 B13R1.90 C=C(F)CNc1ccccc1C#N 34a_100000211148_100009893438 [0,2,0,0,0,1|1,0,0]=4 19050 B13R1.90 C=C(F)CNc1ccccc1CC 2230a_100000212081_100009893438 [0,2,0,0,0,1|1,0,0]=4 19051 B13R1.90 C=C(F)CNc1ccccc1CC 34a_100000212081_100009893438 [0,2,0,0,0,1|1,0,0]=4 19052 B13R1.90 C=C(F)CNc1ccccc1CC 7a_100000212081_100000042424 [0,2,0,0,0,1|1,0,0]=4 19053 B13R1.90 C=C(F)CNc1ccccc1CO 34a_100000212039_100009893438 [0,2,0,0,0,1|1,0,0]=4 19054 B13R1.90 C=C(F)CNc1ccccc1OC 34a_100000210025_100009893438 [0,2,0,0,0,1|1,0,0]=4 19055 B13R1.90 C=C(F)CNc1ccccc1SC 34a_100000211160_100009893438 [0,2,0,0,0,1|1,0,0]=4 19056 B13R1.90 C=C(F)COc1ccccc1C#N 34a_100000211048_100009893438 [0,2,0,0,0,1|1,0,0]=4 19057 B13R1.90 C=C(F)COc1ccccc1C#N 7a_100000211048_100000042424 [0,2,0,0,0,1|1,0,0]=4 19058 B13R1.90 C=C(F)COc1ccccc1CC 34a_100000210936_100009893438 [0,2,0,0,0,1|1,0,0]=4 19059 B13R1.90 C=C(F)COc1ccccc1CC 7a_100000210936_100000042424 [0,2,0,0,0,1|1,0,0]=4 19060 B13R1.90 C=C(F)COc1ccccc1CN 34a_100000185550_100009893438 [0,2,0,0,0,1|1,0,0]=4 19061 B13R1.90 C=C(F)COc1ccccc1CO 34a_100011216872_100009893438 [0,2,0,0,0,1|1,0,0]=4 19062 B13R1.90 C=C(F)COc1ccccc1NC 34a_100000033821_100009893438 [0,2,0,0,0,1|1,0,0]=4 19063 B13R1.90 C=C(F)COc1ccccc1OC 34a_100000210385_100009893438 [0,2,0,0,0,1|1,0,0]=4 19064 B13R1.90 C=C(F)COc1ccccc1SC 34a_100011216402_100009893438 [0,2,0,0,0,1|1,0,0]=4 19065 B13R1.90 C=C(F)CSc1ccccc1C#N 62a_100000042424_100000188569 [0,2,0,0,0,1|1,0,0]=4 19066 B13R1.90 C=C(F)CSc1ccccc1C=O 62a_100000042424_100000210073 [0,2,0,0,0,1|1,0,0]=4 19067 B13R1.90 C=C(F)CSc1ccccc1C=O 62a_100000210073_100000042424 [0,2,0,0,0,1|1,0,0]=4 19068 B13R1.90 C=C(F)CSc1ccccc1CC 62a_100000042424_100011215823 [0,2,0,0,0,1|1,0,0]=4 19069 B13R1.90 C=C(F)CSc1ccccc1CC 62a_100011215823_100000042424 [0,2,0,0,0,1|1,0,0]=4 19070 B13R1.90 C=C(F)CSc1ccccc1CN 62a_100000042424_100000689332 [0,2,0,0,0,1|1,0,0]=4 19071 B13R1.90 C=C(F)CSc1ccccc1CN 62a_100000689332_100000042424 [0,2,0,0,0,1|1,0,0]=4 19072 B13R1.90 C=C(F)CSc1ccccc1CO 62a_100000042424_100000187465 [0,2,0,0,0,1|1,0,0]=4 19073 B13R1.90 C=C(F)CSc1ccccc1CO 62a_100000187465_100000042424 [0,2,0,0,0,1|1,0,0]=4 19074 B13R1.90 C=C(F)CSc1ccccc1NC 62a_100000042424_100020606079 [0,2,0,0,0,1|1,0,0]=4 19075 B13R1.90 C=C(F)CSc1ccccc1NC 62a_100020606079_100000042424 [0,2,0,0,0,1|1,0,0]=4 19076 B13R1.90 C=C(F)CSc1ccccc1NN 62a_100000042424_100000241748 [0,2,0,0,0,1|1,0,0]=4 19077 B13R1.90 C=C(F)CSc1ccccc1NN 62a_100000241748_100000042424 [0,2,0,0,0,1|1,0,0]=4 19078 B13R1.90 C=C(F)CSc1ccccc1OC 62a_100000042424_100000210334 [0,2,0,0,0,1|1,0,0]=4 19079 B13R1.90 C=C(F)CSc1ccccc1OC 62a_100000210334_100000042424 [0,2,0,0,0,1|1,0,0]=4 19080 B13R1.90 C=C(F)CSc1ccccc1SC 62a_100000042424_100011217816 [0,2,0,0,0,1|1,0,0]=4 19081 B13R1.90 C=C(F)CSc1ccccc1SC 62a_100011217816_100000042424 [0,2,0,0,0,1|1,0,0]=4 19082 B13R1.90 C=Cc1ccccc1CNC(=O)C 271570a_100011290941_100011237613 [0,2,0,0,0,1|1,0,0]=4 19083 B13R1.90 C=Cc1ccccc1NCC(=C)C 34a_100012022501_100000748629 [0,2,0,0,0,1|0,0,0]=3 19084 B13R1.90 C=Cc1ccccc1NCC(=C)F 34a_100012022501_100009893438 [0,2,0,0,0,1|1,0,0]=4 19085 B13R1.90 C=Cc1ccccc1SCC(=C)C 62a_100000748629_100011218376 [0,2,0,0,0,1|0,0,0]=3 19086 B13R1.90 C=Cc1ccccc1SCC(=C)C 62a_100011218376_100000211660 [0,2,0,0,0,1|0,0,0]=3 19087 B13R1.90 C=Cc1ccccc1SCC(=C)F 62a_100000042424_100011218376 [0,2,0,0,0,1|1,0,0]=4 19088 B13R1.90 C=Cc1ccccc1SCC(=C)F 62a_100011218376_100000042424 [0,2,0,0,0,1|1,0,0]=4 19089 B13R1.90 CC(=O)CCc1ccccc1C#N 1458a_100000025266_200000210301 [0,2,0,0,0,1|1,0,0]=4 19090 B13R1.90 CC(=O)CCc1ccccc1C#N 1458a_100000070787_200013032965 [0,2,0,0,0,1|1,0,0]=4 19091 B13R1.90 CC(=O)CCc1ccccc1C=O 1458a_100000070787_100010186698 [0,2,0,0,0,1|1,0,0]=4 19092 B13R1.90 CC(=O)COc1ccccc1C#N 1458a_100000182527_200000210301 [0,2,0,0,0,1|1,0,0]=4 19093 B13R1.90 CC(=O)COc1ccccc1CO 1458a_200011894254_200000210301 [0,2,0,0,0,1|1,0,0]=4 19094 B13R1.90 CC(=O)NCc1ccccc1C#N 11a_100016989011_100015343762 [0,2,0,0,0,1|1,0,0]=4 19095 B13R1.90 CC(=O)NCc1ccccc1C#N 1626a_100016989011_100015343762 [0,2,0,0,0,1|1,0,0]=4 19096 B13R1.90 CC(=O)NCc1ccccc1C#N 240690a_100016989011_100015343762 [0,2,0,0,0,1|1,0,0]=4 19097 B13R1.90 CC(=O)NCc1ccccc1C#N 527a_100016989011_100103153847 [0,2,0,0,0,1|1,0,0]=4 19098 B13R1.90 CC(=O)NCc1ccccc1CO 240690a_100000743596_100015343762 [0,2,0,0,0,1|1,0,0]=4 19099 B13R1.90 CC(=O)NCc1ccccc1CO 527a_100000743596_100103153847 [0,2,0,0,0,1|1,0,0]=4 19100 B13R1.90 CC(=O)NCc1ccccc1O[13CH3] 34a_200011628774_200025704644 [0,2,0,0,0,1|1,0,0]=4 19101 B13R1.90 CC(=O)NCc1ccccc1O[13CH3] 7a_200011628774_200025704644 [0,2,0,0,0,1|1,0,0]=4 19102 B13R1.90 CC(=O)NCc1ccccc1S[13CH3] 62a_100011237613_200025704644 [0,2,0,0,0,1|1,0,0]=4 19103 B13R1.90 CC(=O)NCc1ccccc1S[13CH3] 62a_200025704644_100011237613 [0,2,0,0,0,1|1,0,0]=4 19104 B13R1.90 CCc1ccccc1OCC(=O)C 1458a_100000182566_200000210301 [0,2,0,0,0,1|1,0,0]=4 19105 B13R1.90 CCc1ccccc1OCC(=O)[13CH3] 1458a_100000182566_200025704644 [0,2,0,0,0,1|1,0,0]=4 19106 B13R1.90 COc1ccccc1CCC(=O)C 1458a_100000070787_100011713687 [0,2,0,0,0,1|1,0,0]=4 19107 B13R1.90 COc1ccccc1CCC(=O)C 1458a_100000184355_200000210301 [0,2,0,0,0,1|1,0,0]=4 19108 B13R1.90 COc1ccccc1CCC(=O)[13CH3] 1458a_100000184355_200025704644 [0,2,0,0,0,1|1,0,0]=4 19109 B13R1.90 COc1ccccc1CNC(=O)C 11a_100000188900_100015343762 [0,2,0,0,0,1|1,0,0]=4 19110 B13R1.90 COc1ccccc1CNC(=O)C 1626a_100000188900_100015343762 [0,2,0,0,0,1|1,0,0]=4 19111 B13R1.90 COc1ccccc1CNC(=O)C 240690a_100000188900_100015343762 [0,2,0,0,0,1|1,0,0]=4 19112 B13R1.90 COc1ccccc1CNC(=O)C 34a_200011628774_200000210301 [0,2,0,0,0,1|1,0,0]=4 19113 B13R1.90 COc1ccccc1CNC(=O)C 527a_100000188900_100103153847 [0,2,0,0,0,1|1,0,0]=4 19114 B13R1.90 COc1ccccc1CNC(=O)C 7a_200011628774_200000210301 [0,2,0,0,0,1|1,0,0]=4 19115 B13R1.90 COc1ccccc1OCC(=O)C 1458a_100000182946_200000210301 [0,2,0,0,0,1|1,0,0]=4 19116 B13R1.90 COc1ccccc1OCC(=O)[13CH3] 1458a_100000182946_200025704644 [0,2,0,0,0,1|1,0,0]=4 19117 B13R1.90 CSc1ccccc1CNC(=O)C 11a_102495365025_100015343762 [0,2,0,0,0,1|1,0,0]=4 19118 B13R1.90 CSc1ccccc1CNC(=O)C 1626a_102495365025_100015343762 [0,2,0,0,0,1|1,0,0]=4 19119 B13R1.90 CSc1ccccc1CNC(=O)C 240690a_102495365025_100015343762 [0,2,0,0,0,1|1,0,0]=4 19120 B13R1.90 CSc1ccccc1CNC(=O)C 527a_102495365025_100103153847 [0,2,0,0,0,1|1,0,0]=4 19121 B13R1.90 CSc1ccccc1CNC(=O)C 62a_100011237613_200000210301 [0,2,0,0,0,1|1,0,0]=4 19122 B13R1.90 CSc1ccccc1CNC(=O)C 62a_200000210301_100011237613 [0,2,0,0,0,1|1,0,0]=4 19123 B13R1.90 [13CH3]C(=O)CCc1ccccc1C#N 1458a_100000025266_200025704644 [0,2,0,0,0,1|1,0,0]=4 19124 B13R1.90 [13CH3]C(=O)COc1ccccc1C#N 1458a_100000182527_200025704644 [0,2,0,0,0,1|1,0,0]=4 19125 B13R1.90 [13CH3]C(=O)COc1ccccc1CO 1458a_200011894254_200025704644 [0,2,0,0,0,1|1,0,0]=4 19126 B13R1.150 C=C(C)CNc1cccc(c1Br)C 34a_100000684715_100000748629 [0,2,0,0,0,1|0,0,0]=3 19127 B13R1.150 C=C(C)CNc1cccc(c1Br)Cl 34a_100000687072_100000748629 [0,2,0,0,0,1|0,0,0]=3 19128 B13R1.150 C=C(C)CNc1cccc(c1Br)F 34a_100011934729_100000748629 [0,2,0,0,0,1|0,0,0]=3 19129 B13R1.150 C=C(C)CNc1cccc(c1Br)O 34a_100012183704_100000748629 [0,2,0,0,0,1|0,0,0]=3 19130 B13R1.150 C=C(C)CNc1cccc(c1Br)O 7a_100012183704_100000748629 [0,2,0,0,0,1|0,0,0]=3 19131 B13R1.150 C=C(C)CNc1cccc(c1C)Br 34a_100000750434_100000748629 [0,2,0,0,0,1|0,0,0]=3 19132 B13R1.150 C=C(C)CNc1cccc(c1C)C 2230a_100000210026_100000748629 [0,2,0,0,0,1|0,0,0]=3 19133 B13R1.150 C=C(C)CNc1cccc(c1C)C 34a_100000210026_100000748629 [0,2,0,0,0,1|0,0,0]=3 19134 B13R1.150 C=C(C)CNc1cccc(c1C)C 7a_100000210026_100000748629 [0,2,0,0,0,1|0,0,0]=3 19135 B13R1.150 C=C(C)CNc1cccc(c1C)Cl 2230a_100000210441_100000748629 [0,2,0,0,0,1|0,0,0]=3 19136 B13R1.150 C=C(C)CNc1cccc(c1C)Cl 34a_100000210441_100000748629 [0,2,0,0,0,1|0,0,0]=3 19137 B13R1.150 C=C(C)CNc1cccc(c1C)Cl 7a_100000210441_100000748629 [0,2,0,0,0,1|0,0,0]=3 19138 B13R1.150 C=C(C)CNc1cccc(c1C)F 34a_100000745574_100000748629 [0,2,0,0,0,1|0,0,0]=3 19139 B13R1.150 C=C(C)CNc1cccc(c1C)F 7a_100000745574_100000748629 [0,2,0,0,0,1|0,0,0]=3 19140 B13R1.150 C=C(C)CNc1cccc(c1C)I 34a_100000761887_100000748629 [0,2,0,0,0,1|0,0,0]=3 19141 B13R1.150 C=C(C)CNc1cccc(c1C)O 34a_100011216573_100000748629 [0,2,0,0,0,1|0,0,0]=3 19142 B13R1.150 C=C(C)CNc1cccc(c1C)O 7a_100011216573_100000748629 [0,2,0,0,0,1|0,0,0]=3 19143 B13R1.150 C=C(C)CNc1cccc(c1Cl)Br 34a_100000687075_100000748629 [0,2,0,0,0,1|0,0,0]=3 19144 B13R1.150 C=C(C)CNc1cccc(c1Cl)C 34a_100000765562_100000748629 [0,2,0,0,0,1|0,0,0]=3 19145 B13R1.150 C=C(C)CNc1cccc(c1Cl)C 7a_100000765562_100000748629 [0,2,0,0,0,1|0,0,0]=3 19146 B13R1.150 C=C(C)CNc1cccc(c1Cl)Cl 34a_100000185733_100000748629 [0,2,0,0,0,1|0,0,0]=3 19147 B13R1.150 C=C(C)CNc1cccc(c1Cl)F 34a_100000692321_100000748629 [0,2,0,0,0,1|0,0,0]=3 19148 B13R1.150 C=C(C)CNc1cccc(c1Cl)O 34a_100012002038_100000748629 [0,2,0,0,0,1|0,0,0]=3 19149 B13R1.150 C=C(C)CNc1cccc(c1Cl)O 7a_100012002038_100000748629 [0,2,0,0,0,1|0,0,0]=3 19150 B13R1.150 C=C(C)CNc1cccc(c1F)Br 2230a_100011935091_100000748629 [0,2,0,0,0,1|0,0,0]=3 19151 B13R1.150 C=C(C)CNc1cccc(c1F)Br 34a_100011935091_100000748629 [0,2,0,0,0,1|0,0,0]=3 19152 B13R1.150 C=C(C)CNc1cccc(c1F)C 2230a_100000697159_100000748629 [0,2,0,0,0,1|0,0,0]=3 19153 B13R1.150 C=C(C)CNc1cccc(c1F)C 34a_100000697159_100000748629 [0,2,0,0,0,1|0,0,0]=3 19154 B13R1.150 C=C(C)CNc1cccc(c1F)C 7a_100000697159_100000748629 [0,2,0,0,0,1|0,0,0]=3 19155 B13R1.150 C=C(C)CNc1cccc(c1F)Cl 2230a_100000199060_100000748629 [0,2,0,0,0,1|0,0,0]=3 19156 B13R1.150 C=C(C)CNc1cccc(c1F)Cl 34a_100000199060_100000748629 [0,2,0,0,0,1|0,0,0]=3 19157 B13R1.150 C=C(C)CNc1cccc(c1F)F 34a_100000743855_100000748629 [0,2,0,0,0,1|0,0,0]=3 19158 B13R1.150 C=C(C)CNc1cccc(c1I)Br 34a_100020590159_100000748629 [0,2,0,0,0,1|0,0,0]=3 19159 B13R1.150 C=C(C)CNc1cccc(c1I)C 34a_100000761888_100000748629 [0,2,0,0,0,1|0,0,0]=3 19160 B13R1.150 C=C(C)CNc1cccc(c1I)Cl 34a_100000049713_100000748629 [0,2,0,0,0,1|0,0,0]=3 19161 B13R1.150 C=C(C)CNc1cccc(c1I)F 34a_100000690935_100000748629 [0,2,0,0,0,1|0,0,0]=3 19162 B13R1.150 C=C(C)CNc1cccc(c1O)Br 34a_100011934915_100000748629 [0,2,0,0,0,1|0,0,0]=3 19163 B13R1.150 C=C(C)CNc1cccc(c1O)C 34a_100000756359_100000748629 [0,2,0,0,0,1|0,0,0]=3 19164 B13R1.150 C=C(C)CNc1cccc(c1O)Cl 34a_100000754742_100000748629 [0,2,0,0,0,1|0,0,0]=3 19165 B13R1.150 C=C(C)CNc1cccc(c1O)F 34a_100011934987_100000748629 [0,2,0,0,0,1|0,0,0]=3 19166 B13R1.150 C=C(C)CNc1ccnc(c1Br)F 27a_100000765925_100010006599 [0,2,0,0,0,1|1,0,0]=4 19167 B13R1.150 C=C(C)CNc1ccnc(c1C)F 27a_100000765925_100010006593 [0,2,0,0,0,1|1,0,0]=4 19168 B13R1.150 C=C(C)CNc1ccnc(c1Cl)C 27a_100000765925_100000698670 [0,2,0,0,0,1|1,0,0]=4 19169 B13R1.150 C=C(C)CNc1ccnc(c1Cl)F 27a_100000765925_100010067886 [0,2,0,0,0,1|1,0,0]=4 19170 B13R1.150 C=C(C)CNc1ccnc(c1F)C 27a_100000765925_100009849794 [0,2,0,0,0,1|1,0,0]=4 19171 B13R1.150 C=C(C)CNc1ccnc(c1F)F 27a_100000765925_100010214882 [0,2,0,0,0,1|1,0,0]=4 19172 B13R1.150 C=C(C)CNc1nccc(c1C)F 27a_100000765925_100009846374 [0,2,0,0,0,1|1,0,0]=4 19173 B13R1.150 C=C(C)COc1cccc(c1Br)Br 34a_100010187966_100000748629 [0,2,0,0,0,1|0,0,0]=3 19174 B13R1.150 C=C(C)COc1cccc(c1Br)Br 7a_100010187966_100000748629 [0,2,0,0,0,1|0,0,0]=3 19175 B13R1.150 C=C(C)COc1cccc(c1Br)C 34a_100000686692_100000748629 [0,2,0,0,0,1|0,0,0]=3 19176 B13R1.150 C=C(C)COc1cccc(c1Br)C 7a_100000686692_100000748629 [0,2,0,0,0,1|0,0,0]=3 19177 B13R1.150 C=C(C)COc1cccc(c1Br)Cl 34a_100012348804_100000748629 [0,2,0,0,0,1|0,0,0]=3 19178 B13R1.150 C=C(C)COc1cccc(c1Br)Cl 7a_100012348804_100000748629 [0,2,0,0,0,1|0,0,0]=3 19179 B13R1.150 C=C(C)COc1cccc(c1Br)F 34a_100009820682_100000748629 [0,2,0,0,0,1|0,0,0]=3 19180 B13R1.150 C=C(C)COc1cccc(c1Br)F 7a_100009820682_100000748629 [0,2,0,0,0,1|0,0,0]=3 19181 B13R1.150 C=C(C)COc1cccc(c1Br)I 34a_100010187914_100000748629 [0,2,0,0,0,1|0,0,0]=3 19182 B13R1.150 C=C(C)COc1cccc(c1Br)I 7a_100010187914_100000748629 [0,2,0,0,0,1|0,0,0]=3 19183 B13R1.150 C=C(C)COc1cccc(c1Br)N 34a_100012183704_100000748629 [0,2,0,0,0,1|0,0,0]=3 19184 B13R1.150 C=C(C)COc1cccc(c1Br)N 7a_100012183704_100000748629 [0,2,0,0,0,1|0,0,0]=3 19185 B13R1.150 C=C(C)COc1cccc(c1C)Br 34a_100012002258_100000748629 [0,2,0,0,0,1|0,0,0]=3 19186 B13R1.150 C=C(C)COc1cccc(c1C)Br 7a_100012002258_100000748629 [0,2,0,0,0,1|0,0,0]=3 19187 B13R1.150 C=C(C)COc1cccc(c1C)C 34a_100000185855_100000748629 [0,2,0,0,0,1|0,0,0]=3 19188 B13R1.150 C=C(C)COc1cccc(c1C)C 7a_100000185855_100000748629 [0,2,0,0,0,1|0,0,0]=3 19189 B13R1.150 C=C(C)COc1cccc(c1C)Cl 34a_100011265684_100000748629 [0,2,0,0,0,1|0,0,0]=3 19190 B13R1.150 C=C(C)COc1cccc(c1C)Cl 7a_100011265684_100000748629 [0,2,0,0,0,1|0,0,0]=3 19191 B13R1.150 C=C(C)COc1cccc(c1C)F 34a_100011217231_100000748629 [0,2,0,0,0,1|0,0,0]=3 19192 B13R1.150 C=C(C)COc1cccc(c1C)F 7a_100011217231_100000748629 [0,2,0,0,0,1|0,0,0]=3 19193 B13R1.150 C=C(C)COc1cccc(c1C)N 34a_100011216573_100000748629 [0,2,0,0,0,1|0,0,0]=3 19194 B13R1.150 C=C(C)COc1cccc(c1C)N 7a_100011216573_100000748629 [0,2,0,0,0,1|0,0,0]=3 19195 B13R1.150 C=C(C)COc1cccc(c1Cl)Br 34a_100010187913_100000748629 [0,2,0,0,0,1|0,0,0]=3 19196 B13R1.150 C=C(C)COc1cccc(c1Cl)Br 7a_100010187913_100000748629 [0,2,0,0,0,1|0,0,0]=3 19197 B13R1.150 C=C(C)COc1cccc(c1Cl)C 34a_100000695629_100000748629 [0,2,0,0,0,1|0,0,0]=3 19198 B13R1.150 C=C(C)COc1cccc(c1Cl)C 7a_100000695629_100000748629 [0,2,0,0,0,1|0,0,0]=3 19199 B13R1.150 C=C(C)COc1cccc(c1Cl)Cl 34a_100000211076_100000748629 [0,2,0,0,0,1|0,0,0]=3 19200 B13R1.150 C=C(C)COc1cccc(c1Cl)Cl 7a_100000211076_100000748629 [0,2,0,0,0,1|0,0,0]=3 19201 B13R1.150 C=C(C)COc1cccc(c1Cl)F 34a_100000087408_100000748629 [0,2,0,0,0,1|0,0,0]=3 19202 B13R1.150 C=C(C)COc1cccc(c1Cl)F 7a_100000087408_100000748629 [0,2,0,0,0,1|0,0,0]=3 19203 B13R1.150 C=C(C)COc1cccc(c1Cl)I 34a_100000049636_100000748629 [0,2,0,0,0,1|0,0,0]=3 19204 B13R1.150 C=C(C)COc1cccc(c1Cl)I 7a_100000049636_100000748629 [0,2,0,0,0,1|0,0,0]=3 19205 B13R1.150 C=C(C)COc1cccc(c1Cl)N 34a_100012002038_100000748629 [0,2,0,0,0,1|0,0,0]=3 19206 B13R1.150 C=C(C)COc1cccc(c1Cl)N 7a_100012002038_100000748629 [0,2,0,0,0,1|0,0,0]=3 19207 B13R1.150 C=C(C)COc1cccc(c1F)Br 34a_100009817021_100000748629 [0,2,0,0,0,1|0,0,0]=3 19208 B13R1.150 C=C(C)COc1cccc(c1F)Br 7a_100009817021_100000748629 [0,2,0,0,0,1|0,0,0]=3 19209 B13R1.150 C=C(C)COc1cccc(c1F)C 34a_100000751311_100000748629 [0,2,0,0,0,1|0,0,0]=3 19210 B13R1.150 C=C(C)COc1cccc(c1F)C 7a_100000751311_100000748629 [0,2,0,0,0,1|0,0,0]=3 19211 B13R1.150 C=C(C)COc1cccc(c1F)Cl 34a_100000687438_100000748629 [0,2,0,0,0,1|0,0,0]=3 19212 B13R1.150 C=C(C)COc1cccc(c1F)Cl 7a_100000687438_100000748629 [0,2,0,0,0,1|0,0,0]=3 19213 B13R1.150 C=C(C)COc1cccc(c1F)F 34a_100000751161_100000748629 [0,2,0,0,0,1|0,0,0]=3 19214 B13R1.150 C=C(C)COc1cccc(c1F)F 7a_100000751161_100000748629 [0,2,0,0,0,1|0,0,0]=3 19215 B13R1.150 C=C(C)COc1cccc(c1I)Br 34a_100010187912_100000748629 [0,2,0,0,0,1|0,0,0]=3 19216 B13R1.150 C=C(C)COc1cccc(c1I)Br 7a_100010187912_100000748629 [0,2,0,0,0,1|0,0,0]=3 19217 B13R1.150 C=C(C)COc1cccc(c1I)C 34a_100010083724_100000748629 [0,2,0,0,0,1|0,0,0]=3 19218 B13R1.150 C=C(C)COc1cccc(c1I)C 7a_100010083724_100000748629 [0,2,0,0,0,1|0,0,0]=3 19219 B13R1.150 C=C(C)COc1cccc(c1I)Cl 34a_100000050174_100000748629 [0,2,0,0,0,1|0,0,0]=3 19220 B13R1.150 C=C(C)COc1cccc(c1I)Cl 7a_100000050174_100000748629 [0,2,0,0,0,1|0,0,0]=3 19221 B13R1.150 C=C(C)COc1cccc(c1I)F 34a_100000690913_100000748629 [0,2,0,0,0,1|0,0,0]=3 19222 B13R1.150 C=C(C)COc1cccc(c1I)F 7a_100000690913_100000748629 [0,2,0,0,0,1|0,0,0]=3 19223 B13R1.150 C=C(C)COc1cccc(c1N)Br 34a_100011934926_100000748629 [0,2,0,0,0,1|0,0,0]=3 19224 B13R1.150 C=C(C)COc1cccc(c1N)Br 7a_100011934926_100000748629 [0,2,0,0,0,1|0,0,0]=3 19225 B13R1.150 C=C(C)COc1cccc(c1N)C 34a_100000743429_100000748629 [0,2,0,0,0,1|0,0,0]=3 19226 B13R1.150 C=C(C)COc1cccc(c1N)C 7a_100000743429_100000748629 [0,2,0,0,0,1|0,0,0]=3 19227 B13R1.150 C=C(C)COc1cccc(c1N)Cl 34a_100012022510_100000748629 [0,2,0,0,0,1|0,0,0]=3 19228 B13R1.150 C=C(C)COc1cccc(c1N)Cl 7a_100012022510_100000748629 [0,2,0,0,0,1|0,0,0]=3 19229 B13R1.150 C=C(C)COc1cccc(c1N)F 34a_100020591140_100000748629 [0,2,0,0,0,1|0,0,0]=3 19230 B13R1.150 C=C(C)COc1cccc(c1N)F 7a_100020591140_100000748629 [0,2,0,0,0,1|0,0,0]=3 19231 B13R1.150 C=C(C)COc1cccc(c1N)I 34a_200000049512_100000748629 [0,2,0,0,0,1|0,0,0]=3 19232 B13R1.150 C=C(C)COc1cccc(c1N)I 7a_200000049512_100000748629 [0,2,0,0,0,1|0,0,0]=3 19233 B13R1.150 C=C(C)COc1cccc(c1N)N 34a_100000033209_100000748629 [0,2,0,0,0,1|0,0,0]=3 19234 B13R1.150 C=C(C)COc1cccn(c1=O)C 34a_100000117616_100000748629 [0,2,0,0,0,1|1,0,0]=4 19235 B13R1.150 C=C(C)COc1cccn(c1=O)C 7a_100000117616_100000748629 [0,2,0,0,0,1|1,0,0]=4 19236 B13R1.150 C=C(C)COc1ccnc(c1Br)Cl 34a_100010136240_100000748629 [0,2,0,0,0,1|1,0,0]=4 19237 B13R1.150 C=C(C)COc1ccnc(c1Cl)Cl 34a_100009860235_100000748629 [0,2,0,0,0,1|1,0,0]=4 19238 B13R1.150 C=C(C)COc1ccnc(c1F)Br 34a_100009876375_100000748629 [0,2,0,0,0,1|1,0,0]=4 19239 B13R1.150 C=C(C)COc1ccnc(c1F)Cl 34a_100009856406_100000748629 [0,2,0,0,0,1|1,0,0]=4 19240 B13R1.150 C=C(C)COc1ccnc(c1N)Cl 34a_100000128729_100000748629 [0,2,0,0,0,1|1,0,0]=4 19241 B13R1.150 C=C(C)COc1nccc(c1Br)C 34a_100012000493_100000748629 [0,2,0,0,0,1|1,0,0]=4 19242 B13R1.150 C=C(C)COc1nccc(c1C)Br 34a_100009858498_100000748629 [0,2,0,0,0,1|1,0,0]=4 19243 B13R1.150 C=C(C)COc1nccc(c1Cl)N 34a_200000093555_100000748629 [0,2,0,0,0,1|1,0,0]=4 19244 B13R1.150 C=C(C)CSc1cccc(=O)n1C 62a_100000726605_100000211660 [0,2,0,0,0,1|1,0,0]=4 19245 B13R1.150 C=C(C)CSc1cccc(=O)n1C 62a_100000748629_100000726605 [0,2,0,0,0,1|1,0,0]=4 19246 B13R1.150 C=C(C)CSc1cccc(c1Br)Br 62a_100000748629_100010175083 [0,2,0,0,0,1|0,0,0]=3 19247 B13R1.150 C=C(C)CSc1cccc(c1Br)Br 62a_100010175083_100000211660 [0,2,0,0,0,1|0,0,0]=3 19248 B13R1.150 C=C(C)CSc1cccc(c1Br)C 62a_100000748629_100012362457 [0,2,0,0,0,1|0,0,0]=3 19249 B13R1.150 C=C(C)CSc1cccc(c1Br)C 62a_100012362457_100000211660 [0,2,0,0,0,1|0,0,0]=3 19250 B13R1.150 C=C(C)CSc1cccc(c1Br)Cl 62a_100000748629_100014021842 [0,2,0,0,0,1|0,0,0]=3 19251 B13R1.150 C=C(C)CSc1cccc(c1Br)Cl 62a_100014021842_100000211660 [0,2,0,0,0,1|0,0,0]=3 19252 B13R1.150 C=C(C)CSc1cccc(c1Br)F 62a_100000748629_100010202630 [0,2,0,0,0,1|0,0,0]=3 19253 B13R1.150 C=C(C)CSc1cccc(c1Br)F 62a_100010202630_100000211660 [0,2,0,0,0,1|0,0,0]=3 19254 B13R1.150 C=C(C)CSc1cccc(c1Br)O 62a_100000748629_100010187914 [0,2,0,0,0,1|0,0,0]=3 19255 B13R1.150 C=C(C)CSc1cccc(c1Br)O 62a_100010187914_100000211660 [0,2,0,0,0,1|0,0,0]=3 19256 B13R1.150 C=C(C)CSc1cccc(c1C)Br 62a_100000748629_100012353703 [0,2,0,0,0,1|0,0,0]=3 19257 B13R1.150 C=C(C)CSc1cccc(c1C)Br 62a_100012353703_100000211660 [0,2,0,0,0,1|0,0,0]=3 19258 B13R1.150 C=C(C)CSc1cccc(c1C)C 62a_100000748629_100011214922 [0,2,0,0,0,1|0,0,0]=3 19259 B13R1.150 C=C(C)CSc1cccc(c1C)C 62a_100011214922_100000211660 [0,2,0,0,0,1|0,0,0]=3 19260 B13R1.150 C=C(C)CSc1cccc(c1C)Cl 62a_100000726075_100000211660 [0,2,0,0,0,1|0,0,0]=3 19261 B13R1.150 C=C(C)CSc1cccc(c1C)Cl 62a_100000748629_100000726075 [0,2,0,0,0,1|0,0,0]=3 19262 B13R1.150 C=C(C)CSc1cccc(c1C)F 62a_100000748629_100011216893 [0,2,0,0,0,1|0,0,0]=3 19263 B13R1.150 C=C(C)CSc1cccc(c1C)F 62a_100011216893_100000211660 [0,2,0,0,0,1|0,0,0]=3 19264 B13R1.150 C=C(C)CSc1cccc(c1C)N 62a_100000748629_100000761887 [0,2,0,0,0,1|0,0,0]=3 19265 B13R1.150 C=C(C)CSc1cccc(c1C)N 62a_100000761887_100000211660 [0,2,0,0,0,1|0,0,0]=3 19266 B13R1.150 C=C(C)CSc1cccc(c1C)O 62a_100000748629_100012002258 [0,2,0,0,0,1|0,0,0]=3 19267 B13R1.150 C=C(C)CSc1cccc(c1C)O 62a_100012002258_100000211660 [0,2,0,0,0,1|0,0,0]=3 19268 B13R1.150 C=C(C)CSc1cccc(c1Cl)Br 62a_100000748629_100010142854 [0,2,0,0,0,1|0,0,0]=3 19269 B13R1.150 C=C(C)CSc1cccc(c1Cl)Br 62a_100010142854_100000211660 [0,2,0,0,0,1|0,0,0]=3 19270 B13R1.150 C=C(C)CSc1cccc(c1Cl)C 62a_100000748629_200012352035 [0,2,0,0,0,1|0,0,0]=3 19271 B13R1.150 C=C(C)CSc1cccc(c1Cl)C 62a_200012352035_100000211660 [0,2,0,0,0,1|0,0,0]=3 19272 B13R1.150 C=C(C)CSc1cccc(c1Cl)Cl 62a_100000748629_100011215384 [0,2,0,0,0,1|0,0,0]=3 19273 B13R1.150 C=C(C)CSc1cccc(c1Cl)Cl 62a_100011215384_100000211660 [0,2,0,0,0,1|0,0,0]=3 19274 B13R1.150 C=C(C)CSc1cccc(c1Cl)F 62a_100000748629_200010234923 [0,2,0,0,0,1|0,0,0]=3 19275 B13R1.150 C=C(C)CSc1cccc(c1Cl)F 62a_200010234923_100000211660 [0,2,0,0,0,1|0,0,0]=3 19276 B13R1.150 C=C(C)CSc1cccc(c1Cl)O 62a_100000748629_100000049636 [0,2,0,0,0,1|0,0,0]=3 19277 B13R1.150 C=C(C)CSc1cccc(c1F)Br 62a_100000702267_100000211660 [0,2,0,0,0,1|0,0,0]=3 19278 B13R1.150 C=C(C)CSc1cccc(c1F)Br 62a_100000748629_100000702267 [0,2,0,0,0,1|0,0,0]=3 19279 B13R1.150 C=C(C)CSc1cccc(c1F)C 62a_100000717567_100000211660 [0,2,0,0,0,1|0,0,0]=3 19280 B13R1.150 C=C(C)CSc1cccc(c1F)C 62a_100000748629_100000717567 [0,2,0,0,0,1|0,0,0]=3 19281 B13R1.150 C=C(C)CSc1cccc(c1F)Cl 62a_100000748629_100011217346 [0,2,0,0,0,1|0,0,0]=3 19282 B13R1.150 C=C(C)CSc1cccc(c1F)Cl 62a_100011217346_100000211660 [0,2,0,0,0,1|0,0,0]=3 19283 B13R1.150 C=C(C)CSc1cccc(c1F)F 62a_100000694657_100000211660 [0,2,0,0,0,1|0,0,0]=3 19284 B13R1.150 C=C(C)CSc1cccc(c1F)F 62a_100000748629_100000694657 [0,2,0,0,0,1|0,0,0]=3 19285 B13R1.150 C=C(C)CSc1cccc(c1F)N 62a_100000748629_100011935091 [0,2,0,0,0,1|0,0,0]=3 19286 B13R1.150 C=C(C)CSc1cccc(c1F)N 62a_100011935091_100000211660 [0,2,0,0,0,1|0,0,0]=3 19287 B13R1.150 C=C(C)CSc1cccc(c1F)O 62a_100000748629_100009817021 [0,2,0,0,0,1|0,0,0]=3 19288 B13R1.150 C=C(C)CSc1cccc(c1F)O 62a_100009817021_100000211660 [0,2,0,0,0,1|0,0,0]=3 19289 B13R1.150 C=C(C)CSc1cccc(c1N)Br 62a_100000748629_100010146558 [0,2,0,0,0,1|0,0,0]=3 19290 B13R1.150 C=C(C)CSc1cccc(c1N)Br 62a_100010146558_100000211660 [0,2,0,0,0,1|0,0,0]=3 19291 B13R1.150 C=C(C)CSc1cccc(c1N)C 62a_100000748629_100011834072 [0,2,0,0,0,1|0,0,0]=3 19292 B13R1.150 C=C(C)CSc1cccc(c1N)C 62a_100011834072_100000211660 [0,2,0,0,0,1|0,0,0]=3 19293 B13R1.150 C=C(C)CSc1cccc(c1N)Cl 62a_100000748629_100010190421 [0,2,0,0,0,1|0,0,0]=3 19294 B13R1.150 C=C(C)CSc1cccc(c1N)Cl 62a_100010190421_100000211660 [0,2,0,0,0,1|0,0,0]=3 19295 B13R1.150 C=C(C)CSc1cccc(c1N)F 62a_100000042321_100000211660 [0,2,0,0,0,1|0,0,0]=3 19296 B13R1.150 C=C(C)CSc1cccc(c1N)F 62a_100000748629_100000042321 [0,2,0,0,0,1|0,0,0]=3 19297 B13R1.150 C=C(C)CSc1cccc(c1N)N 62a_100015191791_100000211660 [0,2,0,0,0,1|0,0,0]=3 19298 B13R1.150 C=C(C)CSc1cccc(c1N)O 62a_100000748629_100011934926 [0,2,0,0,0,1|0,0,0]=3 19299 B13R1.150 C=C(C)CSc1cccc(c1O)Br 62a_100000748629_100010084509 [0,2,0,0,0,1|0,0,0]=3 19300 B13R1.150 C=C(C)CSc1cccc(c1O)Br 62a_100010084509_100000211660 [0,2,0,0,0,1|0,0,0]=3 19301 B13R1.150 C=C(C)CSc1cccc(c1O)C 62a_100000748629_100009817157 [0,2,0,0,0,1|0,0,0]=3 19302 B13R1.150 C=C(C)CSc1cccc(c1O)C 62a_100009817157_100000211660 [0,2,0,0,0,1|0,0,0]=3 19303 B13R1.150 C=C(C)CSc1cccc(c1O)Cl 62a_100000748629_100010202889 [0,2,0,0,0,1|0,0,0]=3 19304 B13R1.150 C=C(C)CSc1cccc(c1O)Cl 62a_100010202889_100000211660 [0,2,0,0,0,1|0,0,0]=3 19305 B13R1.150 C=C(C)CSc1cccc(c1O)F 62a_100000748629_100009813666 [0,2,0,0,0,1|0,0,0]=3 19306 B13R1.150 C=C(C)CSc1cccc(c1O)F 62a_100009813666_100000211660 [0,2,0,0,0,1|0,0,0]=3 19307 B13R1.150 C=C(C)CSc1cccc(c1O)N 62a_100000748629_100010084371 [0,2,0,0,0,1|0,0,0]=3 19308 B13R1.150 C=C(C)CSc1cccc(c1O)N 62a_100011934915_100000211660 [0,2,0,0,0,1|0,0,0]=3 19309 B13R1.150 C=C(C)CSc1cccc(c1O)O 62a_100000748629_100009815950 [0,2,0,0,0,1|0,0,0]=3 19310 B13R1.150 C=C(C)CSc1cccn(c1=O)C 62a_100000687173_100000211660 [0,2,0,0,0,1|1,0,0]=4 19311 B13R1.150 C=C(C)CSc1cccn(c1=O)C 62a_100000748629_100000687173 [0,2,0,0,0,1|1,0,0]=4 19312 B13R1.150 C=C(C)CSc1ccnc(c1Br)F 62a_100000748629_100010006599 [0,2,0,0,0,1|1,0,0]=4 19313 B13R1.150 C=C(C)CSc1ccnc(c1Br)F 62a_100010006599_100000211660 [0,2,0,0,0,1|1,0,0]=4 19314 B13R1.150 C=C(C)CSc1ccnc(c1C)C 62a_100000748629_100009846815 [0,2,0,0,0,1|1,0,0]=4 19315 B13R1.150 C=C(C)CSc1ccnc(c1C)C 62a_100009846815_100000211660 [0,2,0,0,0,1|1,0,0]=4 19316 B13R1.150 C=C(C)CSc1ccnc(c1C)Cl 62a_100000047055_100000211660 [0,2,0,0,0,1|1,0,0]=4 19317 B13R1.150 C=C(C)CSc1ccnc(c1C)Cl 62a_100000748629_100000047055 [0,2,0,0,0,1|1,0,0]=4 19318 B13R1.150 C=C(C)CSc1ccnc(c1C)F 62a_100000748629_100010006593 [0,2,0,0,0,1|1,0,0]=4 19319 B13R1.150 C=C(C)CSc1ccnc(c1C)F 62a_100010006593_100000211660 [0,2,0,0,0,1|1,0,0]=4 19320 B13R1.150 C=C(C)CSc1ccnc(c1C)N 62a_100000748629_100009865460 [0,2,0,0,0,1|1,0,0]=4 19321 B13R1.150 C=C(C)CSc1ccnc(c1C)N 62a_100009865460_100000211660 [0,2,0,0,0,1|1,0,0]=4 19322 B13R1.150 C=C(C)CSc1ccnc(c1C)O 62a_100000748629_100009858498 [0,2,0,0,0,1|1,0,0]=4 19323 B13R1.150 C=C(C)CSc1ccnc(c1C)O 62a_100009858498_100000211660 [0,2,0,0,0,1|1,0,0]=4 19324 B13R1.150 C=C(C)CSc1ccnc(c1Cl)C 62a_100000698670_100000211660 [0,2,0,0,0,1|1,0,0]=4 19325 B13R1.150 C=C(C)CSc1ccnc(c1Cl)C 62a_100000748629_100000698670 [0,2,0,0,0,1|1,0,0]=4 19326 B13R1.150 C=C(C)CSc1ccnc(c1Cl)Cl 62a_100000748629_100010246212 [0,2,0,0,0,1|1,0,0]=4 19327 B13R1.150 C=C(C)CSc1ccnc(c1Cl)Cl 62a_100010246212_100000211660 [0,2,0,0,0,1|1,0,0]=4 19328 B13R1.150 C=C(C)CSc1ccnc(c1Cl)F 62a_100000748629_100010067886 [0,2,0,0,0,1|1,0,0]=4 19329 B13R1.150 C=C(C)CSc1ccnc(c1Cl)F 62a_100010067886_100000211660 [0,2,0,0,0,1|1,0,0]=4 19330 B13R1.150 C=C(C)CSc1ccnc(c1Cl)N 62a_100000748629_100010735111 [0,2,0,0,0,1|1,0,0]=4 19331 B13R1.150 C=C(C)CSc1ccnc(c1Cl)N 62a_100010735111_100000211660 [0,2,0,0,0,1|1,0,0]=4 19332 B13R1.150 C=C(C)CSc1ccnc(c1F)Br 62a_100000748629_200015269031 [0,2,0,0,0,1|1,0,0]=4 19333 B13R1.150 C=C(C)CSc1ccnc(c1F)Br 62a_200015269031_100000211660 [0,2,0,0,0,1|1,0,0]=4 19334 B13R1.150 C=C(C)CSc1ccnc(c1F)C 62a_100000748629_100009849794 [0,2,0,0,0,1|1,0,0]=4 19335 B13R1.150 C=C(C)CSc1ccnc(c1F)C 62a_100009849794_100000211660 [0,2,0,0,0,1|1,0,0]=4 19336 B13R1.150 C=C(C)CSc1ccnc(c1F)Cl 62a_100000748629_100010150473 [0,2,0,0,0,1|1,0,0]=4 19337 B13R1.150 C=C(C)CSc1ccnc(c1F)Cl 62a_100010150473_100000211660 [0,2,0,0,0,1|1,0,0]=4 19338 B13R1.150 C=C(C)CSc1ccnc(c1F)F 62a_100000748629_100010214882 [0,2,0,0,0,1|1,0,0]=4 19339 B13R1.150 C=C(C)CSc1ccnc(c1F)F 62a_100010214882_100000211660 [0,2,0,0,0,1|1,0,0]=4 19340 B13R1.150 C=C(C)CSc1ccnc(c1F)N 62a_100000748629_100010077785 [0,2,0,0,0,1|1,0,0]=4 19341 B13R1.150 C=C(C)CSc1ccnc(c1F)N 62a_100010077785_100000211660 [0,2,0,0,0,1|1,0,0]=4 19342 B13R1.150 C=C(C)CSc1ccnc(c1N)C 62a_100000748629_100009885578 [0,2,0,0,0,1|1,0,0]=4 19343 B13R1.150 C=C(C)CSc1ccnc(c1N)C 62a_100009885578_100000211660 [0,2,0,0,0,1|1,0,0]=4 19344 B13R1.150 C=C(C)CSc1ccnc(c1N)N 62a_100000124095_100000211660 [0,2,0,0,0,1|1,0,0]=4 19345 B13R1.150 C=C(C)CSc1ccnc(c1O)Cl 62a_100000748629_100010067911 [0,2,0,0,0,1|1,0,0]=4 19346 B13R1.150 C=C(C)CSc1cncc(c1C)Br 62a_100000748629_100010109657 [0,2,0,0,0,1|1,0,0]=4 19347 B13R1.150 C=C(C)CSc1cncc(c1C)Br 62a_100010109657_100000211660 [0,2,0,0,0,1|1,0,0]=4 19348 B13R1.150 C=C(C)CSc1cncc(c1C)C 62a_100000748629_100009864703 [0,2,0,0,0,1|1,0,0]=4 19349 B13R1.150 C=C(C)CSc1cncc(c1C)C 62a_100009864703_100000211660 [0,2,0,0,0,1|1,0,0]=4 19350 B13R1.150 C=C(C)CSc1cncc(c1C)F 62a_100000748629_100009881546 [0,2,0,0,0,1|1,0,0]=4 19351 B13R1.150 C=C(C)CSc1cncc(c1C)F 62a_100009881546_100000211660 [0,2,0,0,0,1|1,0,0]=4 19352 B13R1.150 C=C(C)CSc1cncc(c1C)N 62a_100000748629_100011998293 [0,2,0,0,0,1|1,0,0]=4 19353 B13R1.150 C=C(C)CSc1cncc(c1C)N 62a_100011998293_100000211660 [0,2,0,0,0,1|1,0,0]=4 19354 B13R1.150 C=C(C)CSc1cncc(c1N)Br 62a_100000748629_100011290786 [0,2,0,0,0,1|1,0,0]=4 19355 B13R1.150 C=C(C)CSc1cncc(c1N)Br 62a_100011290786_100000211660 [0,2,0,0,0,1|1,0,0]=4 19356 B13R1.150 C=C(C)CSc1cncc(c1N)C 62a_100000748629_100009818025 [0,2,0,0,0,1|1,0,0]=4 19357 B13R1.150 C=C(C)CSc1cncc(c1N)C 62a_100009818025_100000211660 [0,2,0,0,0,1|1,0,0]=4 19358 B13R1.150 C=C(C)CSc1cncc(c1N)Cl 62a_100000684942_100000211660 [0,2,0,0,0,1|1,0,0]=4 19359 B13R1.150 C=C(C)CSc1cncc(c1N)Cl 62a_100000748629_100000684942 [0,2,0,0,0,1|1,0,0]=4 19360 B13R1.150 C=C(C)CSc1cncc(c1N)F 62a_100000748629_100009880649 [0,2,0,0,0,1|1,0,0]=4 19361 B13R1.150 C=C(C)CSc1cncc(c1N)F 62a_100009880649_100000211660 [0,2,0,0,0,1|1,0,0]=4 19362 B13R1.150 C=C(C)CSc1cncc(c1N)N 62a_100000694774_100000211660 [0,2,0,0,0,1|1,0,0]=4 19363 B13R1.150 C=C(C)CSc1cncc(c1N)N 62a_100000748629_100000694774 [0,2,0,0,0,1|1,0,0]=4 19364 B13R1.150 C=C(C)CSc1cncc(c1O)N 62a_100000694263_100000211660 [0,2,0,0,0,1|1,0,0]=4 19365 B13R1.150 C=C(C)CSc1cncc(c1O)N 62a_100000748629_100000694263 [0,2,0,0,0,1|1,0,0]=4 19366 B13R1.150 C=C(C)CSc1nccc(c1C)C 62a_100000748629_100009847204 [0,2,0,0,0,1|1,0,0]=4 19367 B13R1.150 C=C(C)CSc1nccc(c1C)C 62a_100009847204_100000211660 [0,2,0,0,0,1|1,0,0]=4 19368 B13R1.150 C=C(C)CSc1nccc(c1C)F 62a_100000748629_100009846374 [0,2,0,0,0,1|1,0,0]=4 19369 B13R1.150 C=C(C)CSc1nccc(c1C)F 62a_100009846374_100000211660 [0,2,0,0,0,1|1,0,0]=4 19370 B13R1.150 C=C(C)CSc1nccc(c1C)N 62a_100000690622_100000211660 [0,2,0,0,0,1|1,0,0]=4 19371 B13R1.150 C=C(C)CSc1nccc(c1C)N 62a_100000748629_100000690622 [0,2,0,0,0,1|1,0,0]=4 19372 B13R1.150 C=C(C)CSc1nccc(c1F)C 62a_100000748629_100009817629 [0,2,0,0,0,1|1,0,0]=4 19373 B13R1.150 C=C(C)CSc1nccc(c1F)C 62a_100009817629_100000211660 [0,2,0,0,0,1|1,0,0]=4 19374 B13R1.150 C=C(C)CSc1nccc(c1F)N 62a_100000748629_100015205195 [0,2,0,0,0,1|1,0,0]=4 19375 B13R1.150 C=C(C)CSc1nccc(c1F)N 62a_100015205195_100000211660 [0,2,0,0,0,1|1,0,0]=4 19376 B13R1.150 C=C(C)CSc1nccc(c1F)O 62a_100000748629_100009876375 [0,2,0,0,0,1|1,0,0]=4 19377 B13R1.150 C=C(C)CSc1nccc(c1F)O 62a_100009876375_100000211660 [0,2,0,0,0,1|1,0,0]=4 19378 B13R1.150 C=C(C)CSc1nccc(c1N)C 62a_100000748629_100000763560 [0,2,0,0,0,1|1,0,0]=4 19379 B13R1.150 C=C(C)CSc1nccc(c1N)C 62a_100000763560_100000211660 [0,2,0,0,0,1|1,0,0]=4 19380 B13R1.150 C=C(C)CSc1nccc(c1N)N 62a_100000085203_100000211660 [0,2,0,0,0,1|1,0,0]=4 19381 B13R1.150 C=C(C)CSc1nccc(c1N)N 62a_100000748629_100000085203 [0,2,0,0,0,1|1,0,0]=4 19382 B13R1.150 C=C(C)CSc1nccc(c1O)C 62a_100000748629_100000696282 [0,2,0,0,0,1|1,0,0]=4 19383 B13R1.150 C=C(C)CSc1nccc(c1O)F 62a_100000748629_100009867227 [0,2,0,0,0,1|1,0,0]=4 19384 B13R1.150 C=C(C)CSc1nccc(c1O)N 62a_100000748629_100009844647 [0,2,0,0,0,1|1,0,0]=4 19385 B13R1.150 C=C(F)CNc1cccc(c1Br)C 34a_100000684715_100009893438 [0,2,0,0,0,1|1,0,0]=4 19386 B13R1.150 C=C(F)CNc1cccc(c1Br)Cl 34a_100000687072_100009893438 [0,2,0,0,0,1|1,0,0]=4 19387 B13R1.150 C=C(F)CNc1cccc(c1Br)F 34a_100011934729_100009893438 [0,2,0,0,0,1|1,0,0]=4 19388 B13R1.150 C=C(F)CNc1cccc(c1Br)O 34a_100012183704_100009893438 [0,2,0,0,0,1|1,0,0]=4 19389 B13R1.150 C=C(F)CNc1cccc(c1Br)O 7a_100012183704_100000042424 [0,2,0,0,0,1|1,0,0]=4 19390 B13R1.150 C=C(F)CNc1cccc(c1C)Br 34a_100000750434_100009893438 [0,2,0,0,0,1|1,0,0]=4 19391 B13R1.150 C=C(F)CNc1cccc(c1C)C 2230a_100000210026_100009893438 [0,2,0,0,0,1|1,0,0]=4 19392 B13R1.150 C=C(F)CNc1cccc(c1C)C 34a_100000210026_100009893438 [0,2,0,0,0,1|1,0,0]=4 19393 B13R1.150 C=C(F)CNc1cccc(c1C)C 7a_100000210026_100000042424 [0,2,0,0,0,1|1,0,0]=4 19394 B13R1.150 C=C(F)CNc1cccc(c1C)Cl 2230a_100000210441_100009893438 [0,2,0,0,0,1|1,0,0]=4 19395 B13R1.150 C=C(F)CNc1cccc(c1C)Cl 34a_100000210441_100009893438 [0,2,0,0,0,1|1,0,0]=4 19396 B13R1.150 C=C(F)CNc1cccc(c1C)Cl 7a_100000210441_100000042424 [0,2,0,0,0,1|1,0,0]=4 19397 B13R1.150 C=C(F)CNc1cccc(c1C)F 34a_100000745574_100009893438 [0,2,0,0,0,1|1,0,0]=4 19398 B13R1.150 C=C(F)CNc1cccc(c1C)F 7a_100000745574_100000042424 [0,2,0,0,0,1|1,0,0]=4 19399 B13R1.150 C=C(F)CNc1cccc(c1C)I 34a_100000761887_100009893438 [0,2,0,0,0,1|1,0,0]=4 19400 B13R1.150 C=C(F)CNc1cccc(c1C)O 34a_100011216573_100009893438 [0,2,0,0,0,1|1,0,0]=4 19401 B13R1.150 C=C(F)CNc1cccc(c1C)O 7a_100011216573_100000042424 [0,2,0,0,0,1|1,0,0]=4 19402 B13R1.150 C=C(F)CNc1cccc(c1Cl)Br 34a_100000687075_100009893438 [0,2,0,0,0,1|1,0,0]=4 19403 B13R1.150 C=C(F)CNc1cccc(c1Cl)C 34a_100000765562_100009893438 [0,2,0,0,0,1|1,0,0]=4 19404 B13R1.150 C=C(F)CNc1cccc(c1Cl)C 7a_100000765562_100000042424 [0,2,0,0,0,1|1,0,0]=4 19405 B13R1.150 C=C(F)CNc1cccc(c1Cl)Cl 34a_100000185733_100009893438 [0,2,0,0,0,1|1,0,0]=4 19406 B13R1.150 C=C(F)CNc1cccc(c1Cl)F 34a_100000692321_100009893438 [0,2,0,0,0,1|1,0,0]=4 19407 B13R1.150 C=C(F)CNc1cccc(c1Cl)O 34a_100012002038_100009893438 [0,2,0,0,0,1|1,0,0]=4 19408 B13R1.150 C=C(F)CNc1cccc(c1Cl)O 7a_100012002038_100000042424 [0,2,0,0,0,1|1,0,0]=4 19409 B13R1.150 C=C(F)CNc1cccc(c1F)Br 2230a_100011935091_100009893438 [0,2,0,0,0,1|1,0,0]=4 19410 B13R1.150 C=C(F)CNc1cccc(c1F)Br 34a_100011935091_100009893438 [0,2,0,0,0,1|1,0,0]=4 19411 B13R1.150 C=C(F)CNc1cccc(c1F)C 2230a_100000697159_100009893438 [0,2,0,0,0,1|1,0,0]=4 19412 B13R1.150 C=C(F)CNc1cccc(c1F)C 34a_100000697159_100009893438 [0,2,0,0,0,1|1,0,0]=4 19413 B13R1.150 C=C(F)CNc1cccc(c1F)C 7a_100000697159_100000042424 [0,2,0,0,0,1|1,0,0]=4 19414 B13R1.150 C=C(F)CNc1cccc(c1F)Cl 2230a_100000199060_100009893438 [0,2,0,0,0,1|1,0,0]=4 19415 B13R1.150 C=C(F)CNc1cccc(c1F)Cl 34a_100000199060_100009893438 [0,2,0,0,0,1|1,0,0]=4 19416 B13R1.150 C=C(F)CNc1cccc(c1F)F 34a_100000743855_100009893438 [0,2,0,0,0,1|1,0,0]=4 19417 B13R1.150 C=C(F)CNc1cccc(c1I)Br 34a_100020590159_100009893438 [0,2,0,0,0,1|1,0,0]=4 19418 B13R1.150 C=C(F)CNc1cccc(c1I)C 34a_100000761888_100009893438 [0,2,0,0,0,1|1,0,0]=4 19419 B13R1.150 C=C(F)CNc1cccc(c1I)Cl 34a_100000049713_100009893438 [0,2,0,0,0,1|1,0,0]=4 19420 B13R1.150 C=C(F)CNc1cccc(c1I)F 34a_100000690935_100009893438 [0,2,0,0,0,1|1,0,0]=4 19421 B13R1.150 C=C(F)CNc1cccc(c1O)Br 34a_100011934915_100009893438 [0,2,0,0,0,1|1,0,0]=4 19422 B13R1.150 C=C(F)CNc1cccc(c1O)C 34a_100000756359_100009893438 [0,2,0,0,0,1|1,0,0]=4 19423 B13R1.150 C=C(F)CNc1cccc(c1O)Cl 34a_100000754742_100009893438 [0,2,0,0,0,1|1,0,0]=4 19424 B13R1.150 C=C(F)CNc1cccc(c1O)F 34a_100011934987_100009893438 [0,2,0,0,0,1|1,0,0]=4 19425 B13R1.150 C=C(F)COc1cccc(c1Br)Br 34a_100010187966_100009893438 [0,2,0,0,0,1|1,0,0]=4 19426 B13R1.150 C=C(F)COc1cccc(c1Br)Br 7a_100010187966_100000042424 [0,2,0,0,0,1|1,0,0]=4 19427 B13R1.150 C=C(F)COc1cccc(c1Br)C 34a_100000686692_100009893438 [0,2,0,0,0,1|1,0,0]=4 19428 B13R1.150 C=C(F)COc1cccc(c1Br)C 7a_100000686692_100000042424 [0,2,0,0,0,1|1,0,0]=4 19429 B13R1.150 C=C(F)COc1cccc(c1Br)Cl 34a_100012348804_100009893438 [0,2,0,0,0,1|1,0,0]=4 19430 B13R1.150 C=C(F)COc1cccc(c1Br)Cl 7a_100012348804_100000042424 [0,2,0,0,0,1|1,0,0]=4 19431 B13R1.150 C=C(F)COc1cccc(c1Br)F 34a_100009820682_100009893438 [0,2,0,0,0,1|1,0,0]=4 19432 B13R1.150 C=C(F)COc1cccc(c1Br)F 7a_100009820682_100000042424 [0,2,0,0,0,1|1,0,0]=4 19433 B13R1.150 C=C(F)COc1cccc(c1Br)I 34a_100010187914_100009893438 [0,2,0,0,0,1|1,0,0]=4 19434 B13R1.150 C=C(F)COc1cccc(c1Br)I 7a_100010187914_100000042424 [0,2,0,0,0,1|1,0,0]=4 19435 B13R1.150 C=C(F)COc1cccc(c1Br)N 34a_100012183704_100009893438 [0,2,0,0,0,1|1,0,0]=4 19436 B13R1.150 C=C(F)COc1cccc(c1Br)N 7a_100012183704_100000042424 [0,2,0,0,0,1|1,0,0]=4 19437 B13R1.150 C=C(F)COc1cccc(c1C)Br 34a_100012002258_100009893438 [0,2,0,0,0,1|1,0,0]=4 19438 B13R1.150 C=C(F)COc1cccc(c1C)Br 7a_100012002258_100000042424 [0,2,0,0,0,1|1,0,0]=4 19439 B13R1.150 C=C(F)COc1cccc(c1C)C 34a_100000185855_100009893438 [0,2,0,0,0,1|1,0,0]=4 19440 B13R1.150 C=C(F)COc1cccc(c1C)C 7a_100000185855_100000042424 [0,2,0,0,0,1|1,0,0]=4 19441 B13R1.150 C=C(F)COc1cccc(c1C)Cl 34a_100011265684_100009893438 [0,2,0,0,0,1|1,0,0]=4 19442 B13R1.150 C=C(F)COc1cccc(c1C)Cl 7a_100011265684_100000042424 [0,2,0,0,0,1|1,0,0]=4 19443 B13R1.150 C=C(F)COc1cccc(c1C)F 34a_100011217231_100009893438 [0,2,0,0,0,1|1,0,0]=4 19444 B13R1.150 C=C(F)COc1cccc(c1C)F 7a_100011217231_100000042424 [0,2,0,0,0,1|1,0,0]=4 19445 B13R1.150 C=C(F)COc1cccc(c1C)N 34a_100011216573_100009893438 [0,2,0,0,0,1|1,0,0]=4 19446 B13R1.150 C=C(F)COc1cccc(c1C)N 7a_100011216573_100000042424 [0,2,0,0,0,1|1,0,0]=4 19447 B13R1.150 C=C(F)COc1cccc(c1Cl)Br 34a_100010187913_100009893438 [0,2,0,0,0,1|1,0,0]=4 19448 B13R1.150 C=C(F)COc1cccc(c1Cl)Br 7a_100010187913_100000042424 [0,2,0,0,0,1|1,0,0]=4 19449 B13R1.150 C=C(F)COc1cccc(c1Cl)C 34a_100000695629_100009893438 [0,2,0,0,0,1|1,0,0]=4 19450 B13R1.150 C=C(F)COc1cccc(c1Cl)C 7a_100000695629_100000042424 [0,2,0,0,0,1|1,0,0]=4 19451 B13R1.150 C=C(F)COc1cccc(c1Cl)Cl 34a_100000211076_100009893438 [0,2,0,0,0,1|1,0,0]=4 19452 B13R1.150 C=C(F)COc1cccc(c1Cl)Cl 7a_100000211076_100000042424 [0,2,0,0,0,1|1,0,0]=4 19453 B13R1.150 C=C(F)COc1cccc(c1Cl)F 34a_100000087408_100009893438 [0,2,0,0,0,1|1,0,0]=4 19454 B13R1.150 C=C(F)COc1cccc(c1Cl)F 7a_100000087408_100000042424 [0,2,0,0,0,1|1,0,0]=4 19455 B13R1.150 C=C(F)COc1cccc(c1Cl)I 34a_100000049636_100009893438 [0,2,0,0,0,1|1,0,0]=4 19456 B13R1.150 C=C(F)COc1cccc(c1Cl)I 7a_100000049636_100000042424 [0,2,0,0,0,1|1,0,0]=4 19457 B13R1.150 C=C(F)COc1cccc(c1Cl)N 34a_100012002038_100009893438 [0,2,0,0,0,1|1,0,0]=4 19458 B13R1.150 C=C(F)COc1cccc(c1Cl)N 7a_100012002038_100000042424 [0,2,0,0,0,1|1,0,0]=4 19459 B13R1.150 C=C(F)COc1cccc(c1F)Br 34a_100009817021_100009893438 [0,2,0,0,0,1|1,0,0]=4 19460 B13R1.150 C=C(F)COc1cccc(c1F)Br 7a_100009817021_100000042424 [0,2,0,0,0,1|1,0,0]=4 19461 B13R1.150 C=C(F)COc1cccc(c1F)C 34a_100000751311_100009893438 [0,2,0,0,0,1|1,0,0]=4 19462 B13R1.150 C=C(F)COc1cccc(c1F)C 7a_100000751311_100000042424 [0,2,0,0,0,1|1,0,0]=4 19463 B13R1.150 C=C(F)COc1cccc(c1F)Cl 34a_100000687438_100009893438 [0,2,0,0,0,1|1,0,0]=4 19464 B13R1.150 C=C(F)COc1cccc(c1F)Cl 7a_100000687438_100000042424 [0,2,0,0,0,1|1,0,0]=4 19465 B13R1.150 C=C(F)COc1cccc(c1F)F 34a_100000751161_100009893438 [0,2,0,0,0,1|1,0,0]=4 19466 B13R1.150 C=C(F)COc1cccc(c1F)F 7a_100000751161_100000042424 [0,2,0,0,0,1|1,0,0]=4 19467 B13R1.150 C=C(F)COc1cccc(c1I)Br 34a_100010187912_100009893438 [0,2,0,0,0,1|1,0,0]=4 19468 B13R1.150 C=C(F)COc1cccc(c1I)Br 7a_100010187912_100000042424 [0,2,0,0,0,1|1,0,0]=4 19469 B13R1.150 C=C(F)COc1cccc(c1I)C 34a_100010083724_100009893438 [0,2,0,0,0,1|1,0,0]=4 19470 B13R1.150 C=C(F)COc1cccc(c1I)C 7a_100010083724_100000042424 [0,2,0,0,0,1|1,0,0]=4 19471 B13R1.150 C=C(F)COc1cccc(c1I)Cl 34a_100000050174_100009893438 [0,2,0,0,0,1|1,0,0]=4 19472 B13R1.150 C=C(F)COc1cccc(c1I)Cl 7a_100000050174_100000042424 [0,2,0,0,0,1|1,0,0]=4 19473 B13R1.150 C=C(F)COc1cccc(c1I)F 34a_100000690913_100009893438 [0,2,0,0,0,1|1,0,0]=4 19474 B13R1.150 C=C(F)COc1cccc(c1I)F 7a_100000690913_100000042424 [0,2,0,0,0,1|1,0,0]=4 19475 B13R1.150 C=C(F)COc1cccc(c1N)Br 34a_100011934926_100009893438 [0,2,0,0,0,1|1,0,0]=4 19476 B13R1.150 C=C(F)COc1cccc(c1N)Br 7a_100011934926_100000042424 [0,2,0,0,0,1|1,0,0]=4 19477 B13R1.150 C=C(F)COc1cccc(c1N)C 34a_100000743429_100009893438 [0,2,0,0,0,1|1,0,0]=4 19478 B13R1.150 C=C(F)COc1cccc(c1N)C 7a_100000743429_100000042424 [0,2,0,0,0,1|1,0,0]=4 19479 B13R1.150 C=C(F)COc1cccc(c1N)Cl 34a_100012022510_100009893438 [0,2,0,0,0,1|1,0,0]=4 19480 B13R1.150 C=C(F)COc1cccc(c1N)Cl 7a_100012022510_100000042424 [0,2,0,0,0,1|1,0,0]=4 19481 B13R1.150 C=C(F)COc1cccc(c1N)F 34a_100020591140_100009893438 [0,2,0,0,0,1|1,0,0]=4 19482 B13R1.150 C=C(F)COc1cccc(c1N)F 7a_100020591140_100000042424 [0,2,0,0,0,1|1,0,0]=4 19483 B13R1.150 C=C(F)COc1cccc(c1N)I 34a_200000049512_100009893438 [0,2,0,0,0,1|1,0,0]=4 19484 B13R1.150 C=C(F)COc1cccc(c1N)I 7a_200000049512_100000042424 [0,2,0,0,0,1|1,0,0]=4 19485 B13R1.150 C=C(F)COc1cccc(c1N)N 34a_100000033209_100009893438 [0,2,0,0,0,1|1,0,0]=4 19486 B13R1.150 C=C(F)CSc1cccc(c1Br)Br 62a_100000042424_100010175083 [0,2,0,0,0,1|1,0,0]=4 19487 B13R1.150 C=C(F)CSc1cccc(c1Br)Br 62a_100010175083_100000042424 [0,2,0,0,0,1|1,0,0]=4 19488 B13R1.150 C=C(F)CSc1cccc(c1Br)C 62a_100000042424_100012362457 [0,2,0,0,0,1|1,0,0]=4 19489 B13R1.150 C=C(F)CSc1cccc(c1Br)C 62a_100012362457_100000042424 [0,2,0,0,0,1|1,0,0]=4 19490 B13R1.150 C=C(F)CSc1cccc(c1Br)Cl 62a_100000042424_100014021842 [0,2,0,0,0,1|1,0,0]=4 19491 B13R1.150 C=C(F)CSc1cccc(c1Br)Cl 62a_100014021842_100000042424 [0,2,0,0,0,1|1,0,0]=4 19492 B13R1.150 C=C(F)CSc1cccc(c1Br)F 62a_100000042424_100010202630 [0,2,0,0,0,1|1,0,0]=4 19493 B13R1.150 C=C(F)CSc1cccc(c1Br)F 62a_100010202630_100000042424 [0,2,0,0,0,1|1,0,0]=4 19494 B13R1.150 C=C(F)CSc1cccc(c1Br)O 62a_100000042424_100010187914 [0,2,0,0,0,1|1,0,0]=4 19495 B13R1.150 C=C(F)CSc1cccc(c1Br)O 62a_100010187914_100000042424 [0,2,0,0,0,1|1,0,0]=4 19496 B13R1.150 C=C(F)CSc1cccc(c1C)Br 62a_100000042424_100012353703 [0,2,0,0,0,1|1,0,0]=4 19497 B13R1.150 C=C(F)CSc1cccc(c1C)Br 62a_100012353703_100000042424 [0,2,0,0,0,1|1,0,0]=4 19498 B13R1.150 C=C(F)CSc1cccc(c1C)C 62a_100000042424_100011214922 [0,2,0,0,0,1|1,0,0]=4 19499 B13R1.150 C=C(F)CSc1cccc(c1C)C 62a_100011214922_100000042424 [0,2,0,0,0,1|1,0,0]=4 19500 B13R1.150 C=C(F)CSc1cccc(c1C)Cl 62a_100000042424_100000726075 [0,2,0,0,0,1|1,0,0]=4 19501 B13R1.150 C=C(F)CSc1cccc(c1C)Cl 62a_100000726075_100000042424 [0,2,0,0,0,1|1,0,0]=4 19502 B13R1.150 C=C(F)CSc1cccc(c1C)F 62a_100000042424_100011216893 [0,2,0,0,0,1|1,0,0]=4 19503 B13R1.150 C=C(F)CSc1cccc(c1C)F 62a_100011216893_100000042424 [0,2,0,0,0,1|1,0,0]=4 19504 B13R1.150 C=C(F)CSc1cccc(c1C)N 62a_100000042424_100000761887 [0,2,0,0,0,1|1,0,0]=4 19505 B13R1.150 C=C(F)CSc1cccc(c1C)N 62a_100000761887_100000042424 [0,2,0,0,0,1|1,0,0]=4 19506 B13R1.150 C=C(F)CSc1cccc(c1C)O 62a_100000042424_100012002258 [0,2,0,0,0,1|1,0,0]=4 19507 B13R1.150 C=C(F)CSc1cccc(c1C)O 62a_100012002258_100000042424 [0,2,0,0,0,1|1,0,0]=4 19508 B13R1.150 C=C(F)CSc1cccc(c1Cl)Br 62a_100000042424_100010142854 [0,2,0,0,0,1|1,0,0]=4 19509 B13R1.150 C=C(F)CSc1cccc(c1Cl)Br 62a_100010142854_100000042424 [0,2,0,0,0,1|1,0,0]=4 19510 B13R1.150 C=C(F)CSc1cccc(c1Cl)C 62a_100000042424_200012352035 [0,2,0,0,0,1|1,0,0]=4 19511 B13R1.150 C=C(F)CSc1cccc(c1Cl)C 62a_200012352035_100000042424 [0,2,0,0,0,1|1,0,0]=4 19512 B13R1.150 C=C(F)CSc1cccc(c1Cl)Cl 62a_100000042424_100011215384 [0,2,0,0,0,1|1,0,0]=4 19513 B13R1.150 C=C(F)CSc1cccc(c1Cl)Cl 62a_100011215384_100000042424 [0,2,0,0,0,1|1,0,0]=4 19514 B13R1.150 C=C(F)CSc1cccc(c1Cl)F 62a_100000042424_200010234923 [0,2,0,0,0,1|1,0,0]=4 19515 B13R1.150 C=C(F)CSc1cccc(c1Cl)F 62a_200010234923_100000042424 [0,2,0,0,0,1|1,0,0]=4 19516 B13R1.150 C=C(F)CSc1cccc(c1Cl)O 62a_100000042424_100000049636 [0,2,0,0,0,1|1,0,0]=4 19517 B13R1.150 C=C(F)CSc1cccc(c1F)Br 62a_100000042424_100000702267 [0,2,0,0,0,1|1,0,0]=4 19518 B13R1.150 C=C(F)CSc1cccc(c1F)Br 62a_100000702267_100000042424 [0,2,0,0,0,1|1,0,0]=4 19519 B13R1.150 C=C(F)CSc1cccc(c1F)C 62a_100000042424_100000717567 [0,2,0,0,0,1|1,0,0]=4 19520 B13R1.150 C=C(F)CSc1cccc(c1F)C 62a_100000717567_100000042424 [0,2,0,0,0,1|1,0,0]=4 19521 B13R1.150 C=C(F)CSc1cccc(c1F)Cl 62a_100000042424_100011217346 [0,2,0,0,0,1|1,0,0]=4 19522 B13R1.150 C=C(F)CSc1cccc(c1F)Cl 62a_100011217346_100000042424 [0,2,0,0,0,1|1,0,0]=4 19523 B13R1.150 C=C(F)CSc1cccc(c1F)F 62a_100000042424_100000694657 [0,2,0,0,0,1|1,0,0]=4 19524 B13R1.150 C=C(F)CSc1cccc(c1F)F 62a_100000694657_100000042424 [0,2,0,0,0,1|1,0,0]=4 19525 B13R1.150 C=C(F)CSc1cccc(c1F)N 62a_100000042424_100011935091 [0,2,0,0,0,1|1,0,0]=4 19526 B13R1.150 C=C(F)CSc1cccc(c1F)N 62a_100011935091_100000042424 [0,2,0,0,0,1|1,0,0]=4 19527 B13R1.150 C=C(F)CSc1cccc(c1F)O 62a_100000042424_100009817021 [0,2,0,0,0,1|1,0,0]=4 19528 B13R1.150 C=C(F)CSc1cccc(c1F)O 62a_100009817021_100000042424 [0,2,0,0,0,1|1,0,0]=4 19529 B13R1.150 C=C(F)CSc1cccc(c1N)Br 62a_100000042424_100010146558 [0,2,0,0,0,1|1,0,0]=4 19530 B13R1.150 C=C(F)CSc1cccc(c1N)Br 62a_100010146558_100000042424 [0,2,0,0,0,1|1,0,0]=4 19531 B13R1.150 C=C(F)CSc1cccc(c1N)C 62a_100000042424_100011834072 [0,2,0,0,0,1|1,0,0]=4 19532 B13R1.150 C=C(F)CSc1cccc(c1N)C 62a_100011834072_100000042424 [0,2,0,0,0,1|1,0,0]=4 19533 B13R1.150 C=C(F)CSc1cccc(c1N)Cl 62a_100000042424_100010190421 [0,2,0,0,0,1|1,0,0]=4 19534 B13R1.150 C=C(F)CSc1cccc(c1N)Cl 62a_100010190421_100000042424 [0,2,0,0,0,1|1,0,0]=4 19535 B13R1.150 C=C(F)CSc1cccc(c1N)F 62a_100000042321_100000042424 [0,2,0,0,0,1|1,0,0]=4 19536 B13R1.150 C=C(F)CSc1cccc(c1N)F 62a_100000042424_100000042321 [0,2,0,0,0,1|1,0,0]=4 19537 B13R1.150 C=C(F)CSc1cccc(c1N)N 62a_100015191791_100000042424 [0,2,0,0,0,1|1,0,0]=4 19538 B13R1.150 C=C(F)CSc1cccc(c1N)O 62a_100000042424_100011934926 [0,2,0,0,0,1|1,0,0]=4 19539 B13R1.150 C=C(F)CSc1cccc(c1O)Br 62a_100000042424_100010084509 [0,2,0,0,0,1|1,0,0]=4 19540 B13R1.150 C=C(F)CSc1cccc(c1O)Br 62a_100010084509_100000042424 [0,2,0,0,0,1|1,0,0]=4 19541 B13R1.150 C=C(F)CSc1cccc(c1O)C 62a_100000042424_100009817157 [0,2,0,0,0,1|1,0,0]=4 19542 B13R1.150 C=C(F)CSc1cccc(c1O)C 62a_100009817157_100000042424 [0,2,0,0,0,1|1,0,0]=4 19543 B13R1.150 C=C(F)CSc1cccc(c1O)Cl 62a_100000042424_100010202889 [0,2,0,0,0,1|1,0,0]=4 19544 B13R1.150 C=C(F)CSc1cccc(c1O)Cl 62a_100010202889_100000042424 [0,2,0,0,0,1|1,0,0]=4 19545 B13R1.150 C=C(F)CSc1cccc(c1O)F 62a_100000042424_100009813666 [0,2,0,0,0,1|1,0,0]=4 19546 B13R1.150 C=C(F)CSc1cccc(c1O)F 62a_100009813666_100000042424 [0,2,0,0,0,1|1,0,0]=4 19547 B13R1.150 C=C(F)CSc1cccc(c1O)N 62a_100000042424_100010084371 [0,2,0,0,0,1|1,0,0]=4 19548 B13R1.150 C=C(F)CSc1cccc(c1O)N 62a_100011934915_100000042424 [0,2,0,0,0,1|1,0,0]=4 19549 B13R1.150 C=C(F)CSc1cccc(c1O)O 62a_100000042424_100009815950 [0,2,0,0,0,1|1,0,0]=4 19550 B13R1.150 CC(=O)CCc1cccc(c1C)C 1458a_100011218151_200000210301 [0,2,0,0,0,1|1,0,0]=4 19551 B13R1.150 CC(=O)CCc1cccc(c1C)F 1458a_100000069055_200000210301 [0,2,0,0,0,1|1,0,0]=4 19552 B13R1.150 CC(=O)CCc1cccc(c1Cl)Cl 1458a_100000070787_100000723033 [0,2,0,0,0,1|1,0,0]=4 19553 B13R1.150 CC(=O)CCc1cccc(c1Cl)Cl 1458a_100000739359_200000210301 [0,2,0,0,0,1|1,0,0]=4 19554 B13R1.150 CC(=O)CCc1cccc(c1F)Br 1458a_100012349569_200000210301 [0,2,0,0,0,1|1,0,0]=4 19555 B13R1.150 CC(=O)CCc1cccc(c1F)Cl 1458a_100012349026_200000210301 [0,2,0,0,0,1|1,0,0]=4 19556 B13R1.150 CC(=O)CCc1cccc(c1F)F 1458a_100000748811_200000210301 [0,2,0,0,0,1|1,0,0]=4 19557 B13R1.150 CC(=O)CCc1cccc(c1O)O 1458a_100009873524_200000210301 [0,2,0,0,0,1|1,0,0]=4 19558 B13R1.150 CC(=O)COc1cccc(c1C)C 1458a_200000183798_200000210301 [0,2,0,0,0,1|1,0,0]=4 19559 B13R1.150 CC(=O)COc1cccc(c1Cl)Cl 1458a_100000191259_200000210301 [0,2,0,0,0,1|1,0,0]=4 19560 B13R1.150 CC(=O)NCc1cccc(c1Br)F 11a_100020638964_100015343762 [0,2,0,0,0,1|1,0,0]=4 19561 B13R1.150 CC(=O)NCc1cccc(c1Br)F 1626a_100020638964_100015343762 [0,2,0,0,0,1|1,0,0]=4 19562 B13R1.150 CC(=O)NCc1cccc(c1Br)F 240690a_100020638964_100015343762 [0,2,0,0,0,1|1,0,0]=4 19563 B13R1.150 CC(=O)NCc1cccc(c1Br)F 527a_100020638964_100103153847 [0,2,0,0,0,1|1,0,0]=4 19564 B13R1.150 CC(=O)NCc1cccc(c1C)Br 11a_100000724210_100015343762 [0,2,0,0,0,1|1,0,0]=4 19565 B13R1.150 CC(=O)NCc1cccc(c1C)Br 1626a_100000724210_100015343762 [0,2,0,0,0,1|1,0,0]=4 19566 B13R1.150 CC(=O)NCc1cccc(c1C)Br 240690a_100000724210_100015343762 [0,2,0,0,0,1|1,0,0]=4 19567 B13R1.150 CC(=O)NCc1cccc(c1C)Br 527a_100000724210_100103153847 [0,2,0,0,0,1|1,0,0]=4 19568 B13R1.150 CC(=O)NCc1cccc(c1C)C 11a_100011211637_100015343762 [0,2,0,0,0,1|1,0,0]=4 19569 B13R1.150 CC(=O)NCc1cccc(c1C)C 1626a_100011211637_100015343762 [0,2,0,0,0,1|1,0,0]=4 19570 B13R1.150 CC(=O)NCc1cccc(c1C)C 240690a_100011211637_100015343762 [0,2,0,0,0,1|1,0,0]=4 19571 B13R1.150 CC(=O)NCc1cccc(c1C)C 527a_100011211637_100103153847 [0,2,0,0,0,1|1,0,0]=4 19572 B13R1.150 CC(=O)NCc1cccc(c1C)Cl 11a_100020639605_100015343762 [0,2,0,0,0,1|1,0,0]=4 19573 B13R1.150 CC(=O)NCc1cccc(c1C)Cl 1626a_100020639605_100015343762 [0,2,0,0,0,1|1,0,0]=4 19574 B13R1.150 CC(=O)NCc1cccc(c1C)Cl 240690a_100020639605_100015343762 [0,2,0,0,0,1|1,0,0]=4 19575 B13R1.150 CC(=O)NCc1cccc(c1C)Cl 527a_100020639605_100103153847 [0,2,0,0,0,1|1,0,0]=4 19576 B13R1.150 CC(=O)NCc1cccc(c1C)F 11a_100132306986_100015343762 [0,2,0,0,0,1|1,0,0]=4 19577 B13R1.150 CC(=O)NCc1cccc(c1C)F 1626a_100132306986_100015343762 [0,2,0,0,0,1|1,0,0]=4 19578 B13R1.150 CC(=O)NCc1cccc(c1C)F 240690a_100132306986_100015343762 [0,2,0,0,0,1|1,0,0]=4 19579 B13R1.150 CC(=O)NCc1cccc(c1C)F 527a_100132306986_100103153847 [0,2,0,0,0,1|1,0,0]=4 19580 B13R1.150 CC(=O)NCc1cccc(c1Cl)C 11a_100025705714_100015343762 [0,2,0,0,0,1|1,0,0]=4 19581 B13R1.150 CC(=O)NCc1cccc(c1Cl)C 1626a_100025705714_100015343762 [0,2,0,0,0,1|1,0,0]=4 19582 B13R1.150 CC(=O)NCc1cccc(c1Cl)C 240690a_100025705714_100015343762 [0,2,0,0,0,1|1,0,0]=4 19583 B13R1.150 CC(=O)NCc1cccc(c1Cl)C 527a_100025705714_100103153847 [0,2,0,0,0,1|1,0,0]=4 19584 B13R1.150 CC(=O)NCc1cccc(c1Cl)Cl 11a_100011211633_100015343762 [0,2,0,0,0,1|1,0,0]=4 19585 B13R1.150 CC(=O)NCc1cccc(c1Cl)Cl 1626a_100011211633_100015343762 [0,2,0,0,0,1|1,0,0]=4 19586 B13R1.150 CC(=O)NCc1cccc(c1Cl)Cl 240690a_100011211633_100015343762 [0,2,0,0,0,1|1,0,0]=4 19587 B13R1.150 CC(=O)NCc1cccc(c1Cl)Cl 527a_100011211633_100103153847 [0,2,0,0,0,1|1,0,0]=4 19588 B13R1.150 CC(=O)NCc1cccc(c1Cl)F 11a_100012001614_100015343762 [0,2,0,0,0,1|1,0,0]=4 19589 B13R1.150 CC(=O)NCc1cccc(c1Cl)F 1626a_100012001614_100015343762 [0,2,0,0,0,1|1,0,0]=4 19590 B13R1.150 CC(=O)NCc1cccc(c1Cl)F 240690a_100012001614_100015343762 [0,2,0,0,0,1|1,0,0]=4 19591 B13R1.150 CC(=O)NCc1cccc(c1Cl)F 527a_100012001614_100103153847 [0,2,0,0,0,1|1,0,0]=4 19592 B13R1.150 CC(=O)NCc1cccc(c1F)Br 11a_100015189953_100015343762 [0,2,0,0,0,1|1,0,0]=4 19593 B13R1.150 CC(=O)NCc1cccc(c1F)Br 1626a_100015189953_100015343762 [0,2,0,0,0,1|1,0,0]=4 19594 B13R1.150 CC(=O)NCc1cccc(c1F)Br 240690a_100015189953_100015343762 [0,2,0,0,0,1|1,0,0]=4 19595 B13R1.150 CC(=O)NCc1cccc(c1F)Br 527a_100015189953_100103153847 [0,2,0,0,0,1|1,0,0]=4 19596 B13R1.150 CC(=O)NCc1cccc(c1F)C 11a_100012002060_100015343762 [0,2,0,0,0,1|1,0,0]=4 19597 B13R1.150 CC(=O)NCc1cccc(c1F)C 1626a_100012002060_100015343762 [0,2,0,0,0,1|1,0,0]=4 19598 B13R1.150 CC(=O)NCc1cccc(c1F)C 240690a_100012002060_100015343762 [0,2,0,0,0,1|1,0,0]=4 19599 B13R1.150 CC(=O)NCc1cccc(c1F)C 527a_100012002060_100103153847 [0,2,0,0,0,1|1,0,0]=4 19600 B13R1.150 CC(=O)NCc1cccc(c1F)Cl 11a_100000764326_100015343762 [0,2,0,0,0,1|1,0,0]=4 19601 B13R1.150 CC(=O)NCc1cccc(c1F)Cl 1626a_100000764326_100015343762 [0,2,0,0,0,1|1,0,0]=4 19602 B13R1.150 CC(=O)NCc1cccc(c1F)Cl 240690a_100000764326_100015343762 [0,2,0,0,0,1|1,0,0]=4 19603 B13R1.150 CC(=O)NCc1cccc(c1F)Cl 527a_100000764326_100103153847 [0,2,0,0,0,1|1,0,0]=4 19604 B13R1.150 CC(=O)NCc1cccc(c1F)F 11a_100011199105_100015343762 [0,2,0,0,0,1|1,0,0]=4 19605 B13R1.150 CC(=O)NCc1cccc(c1F)F 1626a_100011199105_100015343762 [0,2,0,0,0,1|1,0,0]=4 19606 B13R1.150 CC(=O)NCc1cccc(c1F)F 240690a_100011199105_100015343762 [0,2,0,0,0,1|1,0,0]=4 19607 B13R1.150 CC(=O)NCc1cccc(c1F)F 527a_100011199105_100103153847 [0,2,0,0,0,1|1,0,0]=4 19608 B13R1.150 CC(=O)NCc1cccc(c1F)O 240690a_100025773512_100015343762 [0,2,0,0,0,1|1,0,0]=4 19609 B13R1.150 CC(=O)NCc1cccc(c1F)O 527a_100025773512_100103153847 [0,2,0,0,0,1|1,0,0]=4 19610 B13R1.150 CC(=O)NCc1cccc(c1O)C 11a_100020639391_100015343762 [0,2,0,0,0,1|1,0,0]=4 19611 B13R1.150 CC(=O)NCc1cccc(c1O)C 240690a_100020639391_100015343762 [0,2,0,0,0,1|1,0,0]=4 19612 B13R1.150 CC(=O)NCc1cccc(c1O)C 527a_100020639391_100103153847 [0,2,0,0,0,1|1,0,0]=4 19613 B13R1.150 Cc1c(cccc1CCC(=O)[13CH3])F 1458a_100000069055_200025704644 [0,2,0,0,0,1|1,0,0]=4 19614 B13R1.150 Cc1cccc(c1C)CCC(=O)[13CH3] 1458a_100011218151_200025704644 [0,2,0,0,0,1|1,0,0]=4 19615 B13R1.150 Cc1cccc(c1C)OCC(=O)[13CH3] 1458a_200000183798_200025704644 [0,2,0,0,0,1|1,0,0]=4 19616 B13R1.150 [13CH3]C(=O)CCc1cccc(c1Cl)Cl 1458a_100000739359_200025704644 [0,2,0,0,0,1|1,0,0]=4 19617 B13R1.150 [13CH3]C(=O)CCc1cccc(c1F)Br 1458a_100012349569_200025704644 [0,2,0,0,0,1|1,0,0]=4 19618 B13R1.150 [13CH3]C(=O)CCc1cccc(c1F)Cl 1458a_100012349026_200025704644 [0,2,0,0,0,1|1,0,0]=4 19619 B13R1.150 [13CH3]C(=O)CCc1cccc(c1F)F 1458a_100000748811_200025704644 [0,2,0,0,0,1|1,0,0]=4 19620 B13R1.150 [13CH3]C(=O)CCc1cccc(c1O)O 1458a_100009873524_200025704644 [0,2,0,0,0,1|1,0,0]=4 19621 B13R1.150 [13CH3]C(=O)COc1cccc(c1Cl)Cl 1458a_100000191259_200025704644 [0,2,0,0,0,1|1,0,0]=4 19622 B13R1.893 C=C(C)CNc1cc(ccc1Br)Br 34a_100000737762_100000748629 [0,2,0,0,0,1|0,0,0]=3 19623 B13R1.893 C=C(C)CNc1cc(ccc1Br)C 34a_100000745044_100000748629 [0,2,0,0,0,1|0,0,0]=3 19624 B13R1.893 C=C(C)CNc1cc(ccc1Br)Cl 34a_100000687073_100000748629 [0,2,0,0,0,1|0,0,0]=3 19625 B13R1.893 C=C(C)CNc1cc(ccc1Br)F 34a_100000687223_100000748629 [0,2,0,0,0,1|0,0,0]=3 19626 B13R1.893 C=C(C)CNc1cc(ccc1Br)O 34a_100011999798_100000748629 [0,2,0,0,0,1|0,0,0]=3 19627 B13R1.893 C=C(C)CNc1cc(ccc1C)Br 34a_100000741167_100000748629 [0,2,0,0,0,1|0,0,0]=3 19628 B13R1.893 C=C(C)CNc1cc(ccc1C)Br 7a_100000741167_100000748629 [0,2,0,0,0,1|0,0,0]=3 19629 B13R1.893 C=C(C)CNc1cc(ccc1C)C 2230a_100000185781_100000748629 [0,2,0,0,0,1|0,0,0]=3 19630 B13R1.893 C=C(C)CNc1cc(ccc1C)C 34a_100000185781_100000748629 [0,2,0,0,0,1|0,0,0]=3 19631 B13R1.893 C=C(C)CNc1cc(ccc1C)C 7a_100000185781_100000748629 [0,2,0,0,0,1|0,0,0]=3 19632 B13R1.893 C=C(C)CNc1cc(ccc1C)Cl 34a_100000211374_100000748629 [0,2,0,0,0,1|0,0,0]=3 19633 B13R1.893 C=C(C)CNc1cc(ccc1C)Cl 7a_100000211374_100000748629 [0,2,0,0,0,1|0,0,0]=3 19634 B13R1.893 C=C(C)CNc1cc(ccc1C)F 34a_100000211107_100000748629 [0,2,0,0,0,1|0,0,0]=3 19635 B13R1.893 C=C(C)CNc1cc(ccc1C)F 7a_100000211107_100000748629 [0,2,0,0,0,1|0,0,0]=3 19636 B13R1.893 C=C(C)CNc1cc(ccc1C)I 7a_100000761890_100000748629 [0,2,0,0,0,1|0,0,0]=3 19637 B13R1.893 C=C(C)CNc1cc(ccc1C)O 34a_100011216113_100000748629 [0,2,0,0,0,1|0,0,0]=3 19638 B13R1.893 C=C(C)CNc1cc(ccc1Cl)Br 34a_100000750497_100000748629 [0,2,0,0,0,1|0,0,0]=3 19639 B13R1.893 C=C(C)CNc1cc(ccc1Cl)C 34a_100011215360_100000748629 [0,2,0,0,0,1|0,0,0]=3 19640 B13R1.893 C=C(C)CNc1cc(ccc1Cl)Cl 34a_100000184485_100000748629 [0,2,0,0,0,1|0,0,0]=3 19641 B13R1.893 C=C(C)CNc1cc(ccc1Cl)F 34a_100000751338_100000748629 [0,2,0,0,0,1|0,0,0]=3 19642 B13R1.893 C=C(C)CNc1cc(ccc1Cl)I 34a_200000761891_100000748629 [0,2,0,0,0,1|0,0,0]=3 19643 B13R1.893 C=C(C)CNc1cc(ccc1Cl)O 34a_100011934297_100000748629 [0,2,0,0,0,1|0,0,0]=3 19644 B13R1.893 C=C(C)CNc1cc(ccc1F)Br 34a_100000740924_100000748629 [0,2,0,0,0,1|0,0,0]=3 19645 B13R1.893 C=C(C)CNc1cc(ccc1F)C 34a_100000211285_100000748629 [0,2,0,0,0,1|0,0,0]=3 19646 B13R1.893 C=C(C)CNc1cc(ccc1F)Cl 34a_100000212115_100000748629 [0,2,0,0,0,1|0,0,0]=3 19647 B13R1.893 C=C(C)CNc1cc(ccc1F)F 34a_100000210742_100000748629 [0,2,0,0,0,1|0,0,0]=3 19648 B13R1.893 C=C(C)CNc1cc(ccc1F)I 34a_100011464823_100000748629 [0,2,0,0,0,1|0,0,0]=3 19649 B13R1.893 C=C(C)CNc1cc(ccc1F)O 34a_100012017239_100000748629 [0,2,0,0,0,1|0,0,0]=3 19650 B13R1.893 C=C(C)CNc1cc(ccc1I)Br 34a_100000743836_100000748629 [0,2,0,0,0,1|0,0,0]=3 19651 B13R1.893 C=C(C)CNc1cc(ccc1I)C 34a_100011216686_100000748629 [0,2,0,0,0,1|0,0,0]=3 19652 B13R1.893 C=C(C)CNc1cc(ccc1I)Cl 34a_100000761886_100000748629 [0,2,0,0,0,1|0,0,0]=3 19653 B13R1.893 C=C(C)CNc1cc(ccc1I)F 34a_100011218093_100000748629 [0,2,0,0,0,1|0,0,0]=3 19654 B13R1.893 C=C(C)CNc1cc(ccc1O)Br 34a_100000752626_100000748629 [0,2,0,0,0,1|0,0,0]=3 19655 B13R1.893 C=C(C)CNc1cc(ccc1O)C 34a_100011215204_100000748629 [0,2,0,0,0,1|0,0,0]=3 19656 B13R1.893 C=C(C)CNc1cc(ccc1O)Cl 34a_100000210500_100000748629 [0,2,0,0,0,1|0,0,0]=3 19657 B13R1.893 C=C(C)CNc1cc(ccc1O)F 34a_100000759472_100000748629 [0,2,0,0,0,1|0,0,0]=3 19658 B13R1.893 C=C(C)CNc1cc(cnc1F)Br 27a_100000765925_100010172738 [0,2,0,0,0,1|1,0,0]=4 19659 B13R1.893 C=C(C)CNc1cc(cnc1F)C 27a_100000765925_100009820679 [0,2,0,0,0,1|1,0,0]=4 19660 B13R1.893 C=C(C)CNc1cc(cnc1F)Cl 27a_100000765925_100010188783 [0,2,0,0,0,1|1,0,0]=4 19661 B13R1.893 C=C(C)CNc1cc(ncc1Br)Br 27a_100000765925_100010171693 [0,2,0,0,0,1|1,0,0]=4 19662 B13R1.893 C=C(C)CNc1cc(ncc1C)F 27a_100000765925_100000049870 [0,2,0,0,0,1|1,0,0]=4 19663 B13R1.893 C=C(C)CNc1cc(ncc1Cl)F 27a_100000765925_100009892587 [0,2,0,0,0,1|1,0,0]=4 19664 B13R1.893 C=C(C)CNc1cc(ncc1F)C 27a_100000765925_100009867690 [0,2,0,0,0,1|1,0,0]=4 19665 B13R1.893 C=C(C)CNc1cc(ncc1F)F 27a_100000765925_100010233071 [0,2,0,0,0,1|1,0,0]=4 19666 B13R1.893 C=C(C)CNc1nc(ccc1F)F 27a_100000765925_100010997973 [0,2,0,0,0,1|1,0,0]=4 19667 B13R1.893 C=C(C)CNc1nc(ccc1N)F 27a_100000765925_100009879877 [0,2,0,0,0,1|1,0,0]=4 19668 B13R1.893 C=C(C)COc1cc(=O)[nH]cc1Cl 34a_100000069390_100000748629 [0,2,0,0,0,1|1,0,0]=4 19669 B13R1.893 C=C(C)COc1cc(ccc1Br)Br 34a_100011220040_100000748629 [0,2,0,0,0,1|0,0,0]=3 19670 B13R1.893 C=C(C)COc1cc(ccc1Br)Br 7a_100011220040_100000748629 [0,2,0,0,0,1|0,0,0]=3 19671 B13R1.893 C=C(C)COc1cc(ccc1Br)C 34a_100012002257_100000748629 [0,2,0,0,0,1|0,0,0]=3 19672 B13R1.893 C=C(C)COc1cc(ccc1Br)C 7a_100012002257_100000748629 [0,2,0,0,0,1|0,0,0]=3 19673 B13R1.893 C=C(C)COc1cc(ccc1Br)Cl 34a_100012339455_100000748629 [0,2,0,0,0,1|0,0,0]=3 19674 B13R1.893 C=C(C)COc1cc(ccc1Br)Cl 7a_100012339455_100000748629 [0,2,0,0,0,1|0,0,0]=3 19675 B13R1.893 C=C(C)COc1cc(ccc1Br)F 34a_100000690578_100000748629 [0,2,0,0,0,1|0,0,0]=3 19676 B13R1.893 C=C(C)COc1cc(ccc1Br)F 7a_100000690578_100000748629 [0,2,0,0,0,1|0,0,0]=3 19677 B13R1.893 C=C(C)COc1cc(ccc1Br)I 34a_100012356990_100000748629 [0,2,0,0,0,1|0,0,0]=3 19678 B13R1.893 C=C(C)COc1cc(ccc1Br)I 7a_100012356990_100000748629 [0,2,0,0,0,1|0,0,0]=3 19679 B13R1.893 C=C(C)COc1cc(ccc1C)Br 34a_100000685420_100000748629 [0,2,0,0,0,1|0,0,0]=3 19680 B13R1.893 C=C(C)COc1cc(ccc1C)Br 7a_100000685420_100000748629 [0,2,0,0,0,1|0,0,0]=3 19681 B13R1.893 C=C(C)COc1cc(ccc1C)C 34a_100000210931_100000748629 [0,2,0,0,0,1|0,0,0]=3 19682 B13R1.893 C=C(C)COc1cc(ccc1C)C 7a_100000210931_100000748629 [0,2,0,0,0,1|0,0,0]=3 19683 B13R1.893 C=C(C)COc1cc(ccc1C)Cl 34a_100000756515_100000748629 [0,2,0,0,0,1|0,0,0]=3 19684 B13R1.893 C=C(C)COc1cc(ccc1C)Cl 7a_100000756515_100000748629 [0,2,0,0,0,1|0,0,0]=3 19685 B13R1.893 C=C(C)COc1cc(ccc1C)F 34a_100000690566_100000748629 [0,2,0,0,0,1|0,0,0]=3 19686 B13R1.893 C=C(C)COc1cc(ccc1C)F 7a_100000690566_100000748629 [0,2,0,0,0,1|0,0,0]=3 19687 B13R1.893 C=C(C)COc1cc(ccc1C)I 7a_100000766334_100000748629 [0,2,0,0,0,1|0,0,0]=3 19688 B13R1.893 C=C(C)COc1cc(ccc1C)N 34a_100000759471_100000748629 [0,2,0,0,0,1|0,0,0]=3 19689 B13R1.893 C=C(C)COc1cc(ccc1C)N 7a_100000759471_100000748629 [0,2,0,0,0,1|0,0,0]=3 19690 B13R1.893 C=C(C)COc1cc(ccc1Cl)Br 34a_100000738945_100000748629 [0,2,0,0,0,1|0,0,0]=3 19691 B13R1.893 C=C(C)COc1cc(ccc1Cl)Br 7a_100000738945_100000748629 [0,2,0,0,0,1|0,0,0]=3 19692 B13R1.893 C=C(C)COc1cc(ccc1Cl)C 34a_100000211493_100000748629 [0,2,0,0,0,1|0,0,0]=3 19693 B13R1.893 C=C(C)COc1cc(ccc1Cl)C 7a_100000211493_100000748629 [0,2,0,0,0,1|0,0,0]=3 19694 B13R1.893 C=C(C)COc1cc(ccc1Cl)Cl 34a_100000211422_100000748629 [0,2,0,0,0,1|0,0,0]=3 19695 B13R1.893 C=C(C)COc1cc(ccc1Cl)Cl 7a_100000211422_100000748629 [0,2,0,0,0,1|0,0,0]=3 19696 B13R1.893 C=C(C)COc1cc(ccc1Cl)F 34a_100000692107_100000748629 [0,2,0,0,0,1|0,0,0]=3 19697 B13R1.893 C=C(C)COc1cc(ccc1Cl)F 7a_100000692107_100000748629 [0,2,0,0,0,1|0,0,0]=3 19698 B13R1.893 C=C(C)COc1cc(ccc1Cl)I 34a_100011356854_100000748629 [0,2,0,0,0,1|0,0,0]=3 19699 B13R1.893 C=C(C)COc1cc(ccc1Cl)I 7a_100011356854_100000748629 [0,2,0,0,0,1|0,0,0]=3 19700 B13R1.893 C=C(C)COc1cc(ccc1Cl)N 34a_100011934209_100000748629 [0,2,0,0,0,1|0,0,0]=3 19701 B13R1.893 C=C(C)COc1cc(ccc1F)Br 34a_100000686035_100000748629 [0,2,0,0,0,1|0,0,0]=3 19702 B13R1.893 C=C(C)COc1cc(ccc1F)Br 7a_100000686035_100000748629 [0,2,0,0,0,1|0,0,0]=3 19703 B13R1.893 C=C(C)COc1cc(ccc1F)C 34a_100000759540_100000748629 [0,2,0,0,0,1|0,0,0]=3 19704 B13R1.893 C=C(C)COc1cc(ccc1F)C 7a_100000759540_100000748629 [0,2,0,0,0,1|0,0,0]=3 19705 B13R1.893 C=C(C)COc1cc(ccc1F)Cl 34a_100000757397_100000748629 [0,2,0,0,0,1|0,0,0]=3 19706 B13R1.893 C=C(C)COc1cc(ccc1F)Cl 7a_100000757397_100000748629 [0,2,0,0,0,1|0,0,0]=3 19707 B13R1.893 C=C(C)COc1cc(ccc1F)F 34a_100000752141_100000748629 [0,2,0,0,0,1|0,0,0]=3 19708 B13R1.893 C=C(C)COc1cc(ccc1F)F 7a_100000752141_100000748629 [0,2,0,0,0,1|0,0,0]=3 19709 B13R1.893 C=C(C)COc1cc(ccc1F)I 34a_100009958187_100000748629 [0,2,0,0,0,1|0,0,0]=3 19710 B13R1.893 C=C(C)COc1cc(ccc1F)I 7a_100009958187_100000748629 [0,2,0,0,0,1|0,0,0]=3 19711 B13R1.893 C=C(C)COc1cc(ccc1F)N 34a_100012017398_100000748629 [0,2,0,0,0,1|0,0,0]=3 19712 B13R1.893 C=C(C)COc1cc(ccc1F)N 7a_100012017398_100000748629 [0,2,0,0,0,1|0,0,0]=3 19713 B13R1.893 C=C(C)COc1cc(ccc1I)Br 34a_100012344904_100000748629 [0,2,0,0,0,1|0,0,0]=3 19714 B13R1.893 C=C(C)COc1cc(ccc1I)Br 7a_100012344904_100000748629 [0,2,0,0,0,1|0,0,0]=3 19715 B13R1.893 C=C(C)COc1cc(ccc1I)Cl 34a_100000050036_100000748629 [0,2,0,0,0,1|0,0,0]=3 19716 B13R1.893 C=C(C)COc1cc(ccc1I)Cl 7a_100000050036_100000748629 [0,2,0,0,0,1|0,0,0]=3 19717 B13R1.893 C=C(C)COc1cc(ccc1I)F 34a_100010084537_100000748629 [0,2,0,0,0,1|0,0,0]=3 19718 B13R1.893 C=C(C)COc1cc(ccc1I)F 7a_100010084537_100000748629 [0,2,0,0,0,1|0,0,0]=3 19719 B13R1.893 C=C(C)COc1cc(ccc1N)Br 34a_100000739049_100000748629 [0,2,0,0,0,1|0,0,0]=3 19720 B13R1.893 C=C(C)COc1cc(ccc1N)Br 7a_100000739049_100000748629 [0,2,0,0,0,1|0,0,0]=3 19721 B13R1.893 C=C(C)COc1cc(ccc1N)C 34a_100000211527_100000748629 [0,2,0,0,0,1|0,0,0]=3 19722 B13R1.893 C=C(C)COc1cc(ccc1N)C 7a_100000211527_100000748629 [0,2,0,0,0,1|0,0,0]=3 19723 B13R1.893 C=C(C)COc1cc(ccc1N)Cl 34a_100000185728_100000748629 [0,2,0,0,0,1|0,0,0]=3 19724 B13R1.893 C=C(C)COc1cc(ccc1N)Cl 7a_100000185728_100000748629 [0,2,0,0,0,1|0,0,0]=3 19725 B13R1.893 C=C(C)COc1cc(ccc1N)F 34a_100000753323_100000748629 [0,2,0,0,0,1|0,0,0]=3 19726 B13R1.893 C=C(C)COc1cc(ccc1N)F 7a_100000753323_100000748629 [0,2,0,0,0,1|0,0,0]=3 19727 B13R1.893 C=C(C)COc1cc(ccc1N)I 34a_100000057187_100000748629 [0,2,0,0,0,1|0,0,0]=3 19728 B13R1.893 C=C(C)COc1cc(ccc1N)I 7a_100000057187_100000748629 [0,2,0,0,0,1|0,0,0]=3 19729 B13R1.893 C=C(C)COc1cc(ccc1N)N 34a_100025717382_100000748629 [0,2,0,0,0,1|0,0,0]=3 19730 B13R1.893 C=C(C)COc1cc(cnc1Br)Cl 34a_100000697010_100000748629 [0,2,0,0,0,1|1,0,0]=4 19731 B13R1.893 C=C(C)COc1cc(cnc1Br)Cl 7a_100000697010_100000748629 [0,2,0,0,0,1|1,0,0]=4 19732 B13R1.893 C=C(C)COc1cc(cnc1Br)F 34a_100009820119_100000748629 [0,2,0,0,0,1|1,0,0]=4 19733 B13R1.893 C=C(C)COc1cc(cnc1Br)F 7a_100009820119_100000748629 [0,2,0,0,0,1|1,0,0]=4 19734 B13R1.893 C=C(C)COc1cc(cnc1C)Br 34a_100009864810_100000748629 [0,2,0,0,0,1|1,0,0]=4 19735 B13R1.893 C=C(C)COc1cc(cnc1C)Br 7a_100009864810_100000748629 [0,2,0,0,0,1|1,0,0]=4 19736 B13R1.893 C=C(C)COc1cc(cnc1Cl)Br 34a_100012354860_100000748629 [0,2,0,0,0,1|1,0,0]=4 19737 B13R1.893 C=C(C)COc1cc(cnc1Cl)Br 7a_100012354860_100000748629 [0,2,0,0,0,1|1,0,0]=4 19738 B13R1.893 C=C(C)COc1cc(cnc1Cl)C 34a_100012000487_100000748629 [0,2,0,0,0,1|1,0,0]=4 19739 B13R1.893 C=C(C)COc1cc(cnc1Cl)C 7a_100012000487_100000748629 [0,2,0,0,0,1|1,0,0]=4 19740 B13R1.893 C=C(C)COc1cc(cnc1Cl)F 34a_100000079967_100000748629 [0,2,0,0,0,1|1,0,0]=4 19741 B13R1.893 C=C(C)COc1cc(cnc1Cl)F 7a_100000079967_100000748629 [0,2,0,0,0,1|1,0,0]=4 19742 B13R1.893 C=C(C)COc1cc(cnc1F)Br 34a_100009819871_100000748629 [0,2,0,0,0,1|1,0,0]=4 19743 B13R1.893 C=C(C)COc1cc(cnc1F)Br 7a_100009819871_100000748629 [0,2,0,0,0,1|1,0,0]=4 19744 B13R1.893 C=C(C)COc1cc(cnc1F)C 34a_100009849810_100000748629 [0,2,0,0,0,1|1,0,0]=4 19745 B13R1.893 C=C(C)COc1cc(cnc1F)C 7a_100009849810_100000748629 [0,2,0,0,0,1|1,0,0]=4 19746 B13R1.893 C=C(C)COc1cc(cnc1F)Cl 34a_100000094372_100000748629 [0,2,0,0,0,1|1,0,0]=4 19747 B13R1.893 C=C(C)COc1cc(cnc1F)Cl 7a_100000094372_100000748629 [0,2,0,0,0,1|1,0,0]=4 19748 B13R1.893 C=C(C)COc1cc(cnc1I)Br 34a_100010210634_100000748629 [0,2,0,0,0,1|1,0,0]=4 19749 B13R1.893 C=C(C)COc1cc(cnc1I)Br 7a_100010210634_100000748629 [0,2,0,0,0,1|1,0,0]=4 19750 B13R1.893 C=C(C)COc1cc(cnc1I)Cl 34a_100010233512_100000748629 [0,2,0,0,0,1|1,0,0]=4 19751 B13R1.893 C=C(C)COc1cc(cnc1I)Cl 7a_100010233512_100000748629 [0,2,0,0,0,1|1,0,0]=4 19752 B13R1.893 C=C(C)COc1cc(cnc1I)F 34a_100015624800_100000748629 [0,2,0,0,0,1|1,0,0]=4 19753 B13R1.893 C=C(C)COc1cc(cnc1I)F 7a_100015624800_100000748629 [0,2,0,0,0,1|1,0,0]=4 19754 B13R1.893 C=C(C)COc1cc(cnc1N)Br 34a_100009819042_100000748629 [0,2,0,0,0,1|1,0,0]=4 19755 B13R1.893 C=C(C)COc1cc(cnc1N)Br 7a_100009819042_100000748629 [0,2,0,0,0,1|1,0,0]=4 19756 B13R1.893 C=C(C)COc1cc(cnc1N)Cl 34a_100000123674_100000748629 [0,2,0,0,0,1|1,0,0]=4 19757 B13R1.893 C=C(C)COc1cc(cnc1N)Cl 7a_100000123674_100000748629 [0,2,0,0,0,1|1,0,0]=4 19758 B13R1.893 C=C(C)COc1cc(cnc1N)F 34a_100000094369_100000748629 [0,2,0,0,0,1|1,0,0]=4 19759 B13R1.893 C=C(C)COc1cc(cnc1N)F 7a_100000094369_100000748629 [0,2,0,0,0,1|1,0,0]=4 19760 B13R1.893 C=C(C)COc1cc(ncc1Br)Br 34a_100010235016_100000748629 [0,2,0,0,0,1|1,0,0]=4 19761 B13R1.893 C=C(C)COc1cc(ncc1Br)C 34a_100011016184_100000748629 [0,2,0,0,0,1|1,0,0]=4 19762 B13R1.893 C=C(C)COc1cc(ncc1Br)Cl 34a_100010173860_100000748629 [0,2,0,0,0,1|1,0,0]=4 19763 B13R1.893 C=C(C)COc1cc(ncc1C)Br 34a_100000704368_100000748629 [0,2,0,0,0,1|1,0,0]=4 19764 B13R1.893 C=C(C)COc1cc(ncc1C)Br 7a_100000704368_100000748629 [0,2,0,0,0,1|1,0,0]=4 19765 B13R1.893 C=C(C)COc1cc(ncc1Cl)Br 34a_100010173861_100000748629 [0,2,0,0,0,1|1,0,0]=4 19766 B13R1.893 C=C(C)COc1cc(ncc1F)Br 34a_100009854642_100000748629 [0,2,0,0,0,1|1,0,0]=4 19767 B13R1.893 C=C(C)COc1cc(ncc1F)Cl 34a_100009851168_100000748629 [0,2,0,0,0,1|1,0,0]=4 19768 B13R1.893 C=C(C)COc1nc(ccc1Br)C 34a_100009817604_100000748629 [0,2,0,0,0,1|1,0,0]=4 19769 B13R1.893 C=C(C)COc1nc(ccc1F)Cl 34a_100010729010_100000748629 [0,2,0,0,0,1|1,0,0]=4 19770 B13R1.893 C=C(C)COc1nc(ccc1N)C 34a_100000687486_100000748629 [0,2,0,0,0,1|1,0,0]=4 19771 B13R1.893 C=C(C)CSc1cc(=O)[nH]cc1F 62a_100000748629_100009817642 [0,2,0,0,0,1|1,0,0]=4 19772 B13R1.893 C=C(C)CSc1cc(=O)[nH]cc1F 62a_100009817642_100000211660 [0,2,0,0,0,1|1,0,0]=4 19773 B13R1.893 C=C(C)CSc1cc(c[nH]c1=O)F 62a_100000748629_100009817720 [0,2,0,0,0,1|1,0,0]=4 19774 B13R1.893 C=C(C)CSc1cc(c[nH]c1=O)F 62a_100009817720_100000211660 [0,2,0,0,0,1|1,0,0]=4 19775 B13R1.893 C=C(C)CSc1cc(ccc1Br)Br 62a_100000748629_100011483371 [0,2,0,0,0,1|0,0,0]=3 19776 B13R1.893 C=C(C)CSc1cc(ccc1Br)Br 62a_100011483371_100000211660 [0,2,0,0,0,1|0,0,0]=3 19777 B13R1.893 C=C(C)CSc1cc(ccc1Br)C 62a_100000748629_100012353751 [0,2,0,0,0,1|0,0,0]=3 19778 B13R1.893 C=C(C)CSc1cc(ccc1Br)C 62a_100012353751_100000211660 [0,2,0,0,0,1|0,0,0]=3 19779 B13R1.893 C=C(C)CSc1cc(ccc1Br)Cl 62a_100000748629_100012339723 [0,2,0,0,0,1|0,0,0]=3 19780 B13R1.893 C=C(C)CSc1cc(ccc1Br)Cl 62a_100012339723_100000211660 [0,2,0,0,0,1|0,0,0]=3 19781 B13R1.893 C=C(C)CSc1cc(ccc1Br)F 62a_100000748629_100011217576 [0,2,0,0,0,1|0,0,0]=3 19782 B13R1.893 C=C(C)CSc1cc(ccc1Br)F 62a_100011217576_100000211660 [0,2,0,0,0,1|0,0,0]=3 19783 B13R1.893 C=C(C)CSc1cc(ccc1Br)N 62a_100000748629_100000750459 [0,2,0,0,0,1|0,0,0]=3 19784 B13R1.893 C=C(C)CSc1cc(ccc1Br)N 62a_100000750459_100000211660 [0,2,0,0,0,1|0,0,0]=3 19785 B13R1.893 C=C(C)CSc1cc(ccc1Br)O 62a_100000748629_100012339312 [0,2,0,0,0,1|0,0,0]=3 19786 B13R1.893 C=C(C)CSc1cc(ccc1Br)O 62a_100012339312_100000211660 [0,2,0,0,0,1|0,0,0]=3 19787 B13R1.893 C=C(C)CSc1cc(ccc1C)Br 62a_100000748629_100011344865 [0,2,0,0,0,1|0,0,0]=3 19788 B13R1.893 C=C(C)CSc1cc(ccc1C)Br 62a_100011344865_100000211660 [0,2,0,0,0,1|0,0,0]=3 19789 B13R1.893 C=C(C)CSc1cc(ccc1C)C 62a_100000210833_100000211660 [0,2,0,0,0,1|0,0,0]=3 19790 B13R1.893 C=C(C)CSc1cc(ccc1C)C 62a_100000748629_100000210833 [0,2,0,0,0,1|0,0,0]=3 19791 B13R1.893 C=C(C)CSc1cc(ccc1C)Cl 62a_100000748629_100011263213 [0,2,0,0,0,1|0,0,0]=3 19792 B13R1.893 C=C(C)CSc1cc(ccc1C)Cl 62a_100011263213_100000211660 [0,2,0,0,0,1|0,0,0]=3 19793 B13R1.893 C=C(C)CSc1cc(ccc1C)F 62a_100000748629_100011218078 [0,2,0,0,0,1|0,0,0]=3 19794 B13R1.893 C=C(C)CSc1cc(ccc1C)F 62a_100011218078_100000211660 [0,2,0,0,0,1|0,0,0]=3 19795 B13R1.893 C=C(C)CSc1cc(ccc1C)N 62a_100000736455_100000211660 [0,2,0,0,0,1|0,0,0]=3 19796 B13R1.893 C=C(C)CSc1cc(ccc1C)N 62a_100000748629_100000736455 [0,2,0,0,0,1|0,0,0]=3 19797 B13R1.893 C=C(C)CSc1cc(ccc1C)O 62a_100000748629_100011380479 [0,2,0,0,0,1|0,0,0]=3 19798 B13R1.893 C=C(C)CSc1cc(ccc1C)O 62a_100011380479_100000211660 [0,2,0,0,0,1|0,0,0]=3 19799 B13R1.893 C=C(C)CSc1cc(ccc1Cl)Br 62a_100000748629_100011772130 [0,2,0,0,0,1|0,0,0]=3 19800 B13R1.893 C=C(C)CSc1cc(ccc1Cl)Br 62a_100011772130_100000211660 [0,2,0,0,0,1|0,0,0]=3 19801 B13R1.893 C=C(C)CSc1cc(ccc1Cl)C 62a_100000748629_100012356289 [0,2,0,0,0,1|0,0,0]=3 19802 B13R1.893 C=C(C)CSc1cc(ccc1Cl)C 62a_100012356289_100000211660 [0,2,0,0,0,1|0,0,0]=3 19803 B13R1.893 C=C(C)CSc1cc(ccc1Cl)Cl 62a_100000707729_100000211660 [0,2,0,0,0,1|0,0,0]=3 19804 B13R1.893 C=C(C)CSc1cc(ccc1Cl)Cl 62a_100000748629_100000707729 [0,2,0,0,0,1|0,0,0]=3 19805 B13R1.893 C=C(C)CSc1cc(ccc1Cl)F 62a_100000748629_100011217299 [0,2,0,0,0,1|0,0,0]=3 19806 B13R1.893 C=C(C)CSc1cc(ccc1Cl)F 62a_100011217299_100000211660 [0,2,0,0,0,1|0,0,0]=3 19807 B13R1.893 C=C(C)CSc1cc(ccc1Cl)N 62a_100000748629_100012360549 [0,2,0,0,0,1|0,0,0]=3 19808 B13R1.893 C=C(C)CSc1cc(ccc1Cl)N 62a_100012360549_100000211660 [0,2,0,0,0,1|0,0,0]=3 19809 B13R1.893 C=C(C)CSc1cc(ccc1Cl)O 62a_100000049588_100000211660 [0,2,0,0,0,1|0,0,0]=3 19810 B13R1.893 C=C(C)CSc1cc(ccc1Cl)O 62a_100000748629_100000049588 [0,2,0,0,0,1|0,0,0]=3 19811 B13R1.893 C=C(C)CSc1cc(ccc1F)Br 62a_100000748629_100011217312 [0,2,0,0,0,1|0,0,0]=3 19812 B13R1.893 C=C(C)CSc1cc(ccc1F)Br 62a_100011217312_100000211660 [0,2,0,0,0,1|0,0,0]=3 19813 B13R1.893 C=C(C)CSc1cc(ccc1F)C 62a_100000736223_100000211660 [0,2,0,0,0,1|0,0,0]=3 19814 B13R1.893 C=C(C)CSc1cc(ccc1F)C 62a_100000748629_100000736223 [0,2,0,0,0,1|0,0,0]=3 19815 B13R1.893 C=C(C)CSc1cc(ccc1F)Cl 62a_100000748629_100011218116 [0,2,0,0,0,1|0,0,0]=3 19816 B13R1.893 C=C(C)CSc1cc(ccc1F)Cl 62a_100011218116_100000211660 [0,2,0,0,0,1|0,0,0]=3 19817 B13R1.893 C=C(C)CSc1cc(ccc1F)F 62a_100000748629_100011219198 [0,2,0,0,0,1|0,0,0]=3 19818 B13R1.893 C=C(C)CSc1cc(ccc1F)F 62a_100011219198_100000211660 [0,2,0,0,0,1|0,0,0]=3 19819 B13R1.893 C=C(C)CSc1cc(ccc1F)N 62a_100000748629_100000760356 [0,2,0,0,0,1|0,0,0]=3 19820 B13R1.893 C=C(C)CSc1cc(ccc1F)N 62a_100000760356_100000211660 [0,2,0,0,0,1|0,0,0]=3 19821 B13R1.893 C=C(C)CSc1cc(ccc1F)O 62a_100000693481_100000211660 [0,2,0,0,0,1|0,0,0]=3 19822 B13R1.893 C=C(C)CSc1cc(ccc1F)O 62a_100000748629_100000693481 [0,2,0,0,0,1|0,0,0]=3 19823 B13R1.893 C=C(C)CSc1cc(ccc1N)Br 62a_100000187925_100000211660 [0,2,0,0,0,1|0,0,0]=3 19824 B13R1.893 C=C(C)CSc1cc(ccc1N)Br 62a_100000748629_100000187925 [0,2,0,0,0,1|0,0,0]=3 19825 B13R1.893 C=C(C)CSc1cc(ccc1N)C 62a_100000748629_100011356834 [0,2,0,0,0,1|0,0,0]=3 19826 B13R1.893 C=C(C)CSc1cc(ccc1N)C 62a_100011356834_100000211660 [0,2,0,0,0,1|0,0,0]=3 19827 B13R1.893 C=C(C)CSc1cc(ccc1N)Cl 62a_100000748629_100000761889 [0,2,0,0,0,1|0,0,0]=3 19828 B13R1.893 C=C(C)CSc1cc(ccc1N)Cl 62a_100000761889_100000211660 [0,2,0,0,0,1|0,0,0]=3 19829 B13R1.893 C=C(C)CSc1cc(ccc1N)F 62a_100000748629_100000760547 [0,2,0,0,0,1|0,0,0]=3 19830 B13R1.893 C=C(C)CSc1cc(ccc1N)F 62a_100000760547_100000211660 [0,2,0,0,0,1|0,0,0]=3 19831 B13R1.893 C=C(C)CSc1cc(ccc1N)N 62a_100000748629_100011534242 [0,2,0,0,0,1|0,0,0]=3 19832 B13R1.893 C=C(C)CSc1cc(ccc1N)N 62a_100011534242_100000211660 [0,2,0,0,0,1|0,0,0]=3 19833 B13R1.893 C=C(C)CSc1cc(ccc1N)O 62a_100000748629_100012001276 [0,2,0,0,0,1|0,0,0]=3 19834 B13R1.893 C=C(C)CSc1cc(ccc1N)O 62a_100012001276_100000211660 [0,2,0,0,0,1|0,0,0]=3 19835 B13R1.893 C=C(C)CSc1cc(ccc1O)Br 62a_100000748629_100012355227 [0,2,0,0,0,1|0,0,0]=3 19836 B13R1.893 C=C(C)CSc1cc(ccc1O)Br 62a_100012355227_100000211660 [0,2,0,0,0,1|0,0,0]=3 19837 B13R1.893 C=C(C)CSc1cc(ccc1O)C 62a_100000748629_100000765521 [0,2,0,0,0,1|0,0,0]=3 19838 B13R1.893 C=C(C)CSc1cc(ccc1O)C 62a_100000765521_100000211660 [0,2,0,0,0,1|0,0,0]=3 19839 B13R1.893 C=C(C)CSc1cc(ccc1O)Cl 62a_100000748629_100011356953 [0,2,0,0,0,1|0,0,0]=3 19840 B13R1.893 C=C(C)CSc1cc(ccc1O)Cl 62a_100011356953_100000211660 [0,2,0,0,0,1|0,0,0]=3 19841 B13R1.893 C=C(C)CSc1cc(ccc1O)F 62a_100000211999_100000211660 [0,2,0,0,0,1|0,0,0]=3 19842 B13R1.893 C=C(C)CSc1cc(ccc1O)F 62a_100000748629_100000211999 [0,2,0,0,0,1|0,0,0]=3 19843 B13R1.893 C=C(C)CSc1cc(ccc1O)N 62a_100000748629_100011534360 [0,2,0,0,0,1|0,0,0]=3 19844 B13R1.893 C=C(C)CSc1cc(ccc1O)N 62a_100011534360_100000211660 [0,2,0,0,0,1|0,0,0]=3 19845 B13R1.893 C=C(C)CSc1cc(ccc1O)O 62a_100000748629_100009813629 [0,2,0,0,0,1|0,0,0]=3 19846 B13R1.893 C=C(C)CSc1cc(cnc1Br)N 62a_100000748629_100010201102 [0,2,0,0,0,1|1,0,0]=4 19847 B13R1.893 C=C(C)CSc1cc(cnc1Br)N 62a_100010201102_100000211660 [0,2,0,0,0,1|1,0,0]=4 19848 B13R1.893 C=C(C)CSc1cc(cnc1C)Br 62a_100000748629_200010090566 [0,2,0,0,0,1|1,0,0]=4 19849 B13R1.893 C=C(C)CSc1cc(cnc1C)Br 62a_200010090566_100000211660 [0,2,0,0,0,1|1,0,0]=4 19850 B13R1.893 C=C(C)CSc1cc(cnc1C)C 62a_100000748629_100009817436 [0,2,0,0,0,1|1,0,0]=4 19851 B13R1.893 C=C(C)CSc1cc(cnc1C)C 62a_100009817436_100000211660 [0,2,0,0,0,1|1,0,0]=4 19852 B13R1.893 C=C(C)CSc1cc(cnc1C)F 62a_100000748629_100009860710 [0,2,0,0,0,1|1,0,0]=4 19853 B13R1.893 C=C(C)CSc1cc(cnc1C)F 62a_100009860710_100000211660 [0,2,0,0,0,1|1,0,0]=4 19854 B13R1.893 C=C(C)CSc1cc(cnc1C)N 62a_100000748629_100011998591 [0,2,0,0,0,1|1,0,0]=4 19855 B13R1.893 C=C(C)CSc1cc(cnc1C)N 62a_100011998591_100000211660 [0,2,0,0,0,1|1,0,0]=4 19856 B13R1.893 C=C(C)CSc1cc(cnc1C)O 62a_100000748629_100009819603 [0,2,0,0,0,1|1,0,0]=4 19857 B13R1.893 C=C(C)CSc1cc(cnc1C)O 62a_100009819603_100000211660 [0,2,0,0,0,1|1,0,0]=4 19858 B13R1.893 C=C(C)CSc1cc(cnc1Cl)Br 62a_100000748629_100009814771 [0,2,0,0,0,1|1,0,0]=4 19859 B13R1.893 C=C(C)CSc1cc(cnc1Cl)Br 62a_100009814771_100000211660 [0,2,0,0,0,1|1,0,0]=4 19860 B13R1.893 C=C(C)CSc1cc(cnc1Cl)C 62a_100000748629_100010210167 [0,2,0,0,0,1|1,0,0]=4 19861 B13R1.893 C=C(C)CSc1cc(cnc1Cl)C 62a_100010210167_100000211660 [0,2,0,0,0,1|1,0,0]=4 19862 B13R1.893 C=C(C)CSc1cc(cnc1Cl)Cl 62a_100000748629_200000062399 [0,2,0,0,0,1|1,0,0]=4 19863 B13R1.893 C=C(C)CSc1cc(cnc1Cl)Cl 62a_200000062399_100000211660 [0,2,0,0,0,1|1,0,0]=4 19864 B13R1.893 C=C(C)CSc1cc(cnc1Cl)N 62a_100000748629_100010253917 [0,2,0,0,0,1|1,0,0]=4 19865 B13R1.893 C=C(C)CSc1cc(cnc1Cl)N 62a_100010253917_100000211660 [0,2,0,0,0,1|1,0,0]=4 19866 B13R1.893 C=C(C)CSc1cc(cnc1F)Br 62a_100000748629_100010172738 [0,2,0,0,0,1|1,0,0]=4 19867 B13R1.893 C=C(C)CSc1cc(cnc1F)Br 62a_100010172738_100000211660 [0,2,0,0,0,1|1,0,0]=4 19868 B13R1.893 C=C(C)CSc1cc(cnc1F)C 62a_100000049784_100000211660 [0,2,0,0,0,1|1,0,0]=4 19869 B13R1.893 C=C(C)CSc1cc(cnc1F)C 62a_100000748629_100000049784 [0,2,0,0,0,1|1,0,0]=4 19870 B13R1.893 C=C(C)CSc1cc(cnc1F)Cl 62a_100000748629_100010188783 [0,2,0,0,0,1|1,0,0]=4 19871 B13R1.893 C=C(C)CSc1cc(cnc1F)Cl 62a_100010188783_100000211660 [0,2,0,0,0,1|1,0,0]=4 19872 B13R1.893 C=C(C)CSc1cc(cnc1F)F 62a_100000748629_100009820768 [0,2,0,0,0,1|1,0,0]=4 19873 B13R1.893 C=C(C)CSc1cc(cnc1F)F 62a_100009820768_100000211660 [0,2,0,0,0,1|1,0,0]=4 19874 B13R1.893 C=C(C)CSc1cc(cnc1F)N 62a_100000748629_100009840397 [0,2,0,0,0,1|1,0,0]=4 19875 B13R1.893 C=C(C)CSc1cc(cnc1F)N 62a_100009840397_100000211660 [0,2,0,0,0,1|1,0,0]=4 19876 B13R1.893 C=C(C)CSc1cc(cnc1F)O 62a_100000748629_100009817267 [0,2,0,0,0,1|1,0,0]=4 19877 B13R1.893 C=C(C)CSc1cc(cnc1F)O 62a_100009817267_100000211660 [0,2,0,0,0,1|1,0,0]=4 19878 B13R1.893 C=C(C)CSc1cc(cnc1N)Br 62a_100000748629_100000760472 [0,2,0,0,0,1|1,0,0]=4 19879 B13R1.893 C=C(C)CSc1cc(cnc1N)Br 62a_100000760472_100000211660 [0,2,0,0,0,1|1,0,0]=4 19880 B13R1.893 C=C(C)CSc1cc(cnc1N)C 62a_100000049664_100000211660 [0,2,0,0,0,1|1,0,0]=4 19881 B13R1.893 C=C(C)CSc1cc(cnc1N)C 62a_100000748629_100000049664 [0,2,0,0,0,1|1,0,0]=4 19882 B13R1.893 C=C(C)CSc1cc(cnc1N)Cl 62a_100000050159_100000211660 [0,2,0,0,0,1|1,0,0]=4 19883 B13R1.893 C=C(C)CSc1cc(cnc1N)Cl 62a_100000748629_100000050159 [0,2,0,0,0,1|1,0,0]=4 19884 B13R1.893 C=C(C)CSc1cc(cnc1N)F 62a_100000748629_100009814671 [0,2,0,0,0,1|1,0,0]=4 19885 B13R1.893 C=C(C)CSc1cc(cnc1N)F 62a_100009814671_100000211660 [0,2,0,0,0,1|1,0,0]=4 19886 B13R1.893 C=C(C)CSc1cc(cnc1N)N 62a_100000748629_200011934315 [0,2,0,0,0,1|1,0,0]=4 19887 B13R1.893 C=C(C)CSc1cc(cnc1N)N 62a_200011934315_100000211660 [0,2,0,0,0,1|1,0,0]=4 19888 B13R1.893 C=C(C)CSc1cc(cnc1O)Br 62a_100000748629_100010197142 [0,2,0,0,0,1|1,0,0]=4 19889 B13R1.893 C=C(C)CSc1cc(cnc1O)Br 62a_100010197142_100000211660 [0,2,0,0,0,1|1,0,0]=4 19890 B13R1.893 C=C(C)CSc1cc(cnc1O)C 62a_100000719714_100000211660 [0,2,0,0,0,1|1,0,0]=4 19891 B13R1.893 C=C(C)CSc1cc(cnc1O)C 62a_100000748629_100000719714 [0,2,0,0,0,1|1,0,0]=4 19892 B13R1.893 C=C(C)CSc1cc(cnc1O)Cl 62a_100000748629_100010188700 [0,2,0,0,0,1|1,0,0]=4 19893 B13R1.893 C=C(C)CSc1cc(cnc1O)Cl 62a_100010188700_100000211660 [0,2,0,0,0,1|1,0,0]=4 19894 B13R1.893 C=C(C)CSc1cc(ncc1Br)Br 62a_100000748629_100010171693 [0,2,0,0,0,1|1,0,0]=4 19895 B13R1.893 C=C(C)CSc1cc(ncc1Br)Br 62a_100010171693_100000211660 [0,2,0,0,0,1|1,0,0]=4 19896 B13R1.893 C=C(C)CSc1cc(ncc1Br)Cl 62a_100000748629_100009815598 [0,2,0,0,0,1|1,0,0]=4 19897 B13R1.893 C=C(C)CSc1cc(ncc1Br)Cl 62a_100009815598_100000211660 [0,2,0,0,0,1|1,0,0]=4 19898 B13R1.893 C=C(C)CSc1cc(ncc1C)Br 62a_100000748629_100010067628 [0,2,0,0,0,1|1,0,0]=4 19899 B13R1.893 C=C(C)CSc1cc(ncc1C)Br 62a_100010067628_100000211660 [0,2,0,0,0,1|1,0,0]=4 19900 B13R1.893 C=C(C)CSc1cc(ncc1C)C 62a_100000748629_100009862788 [0,2,0,0,0,1|1,0,0]=4 19901 B13R1.893 C=C(C)CSc1cc(ncc1C)C 62a_100009862788_100000211660 [0,2,0,0,0,1|1,0,0]=4 19902 B13R1.893 C=C(C)CSc1cc(ncc1C)Cl 62a_100000748629_100010068021 [0,2,0,0,0,1|1,0,0]=4 19903 B13R1.893 C=C(C)CSc1cc(ncc1C)Cl 62a_100010068021_100000211660 [0,2,0,0,0,1|1,0,0]=4 19904 B13R1.893 C=C(C)CSc1cc(ncc1C)F 62a_100000049870_100000211660 [0,2,0,0,0,1|1,0,0]=4 19905 B13R1.893 C=C(C)CSc1cc(ncc1C)F 62a_100000748629_100000049870 [0,2,0,0,0,1|1,0,0]=4 19906 B13R1.893 C=C(C)CSc1cc(ncc1C)N 62a_100000748629_100009819938 [0,2,0,0,0,1|1,0,0]=4 19907 B13R1.893 C=C(C)CSc1cc(ncc1C)N 62a_100009819938_100000211660 [0,2,0,0,0,1|1,0,0]=4 19908 B13R1.893 C=C(C)CSc1cc(ncc1C)O 62a_100000748629_100009831917 [0,2,0,0,0,1|1,0,0]=4 19909 B13R1.893 C=C(C)CSc1cc(ncc1C)O 62a_100009831917_100000211660 [0,2,0,0,0,1|1,0,0]=4 19910 B13R1.893 C=C(C)CSc1cc(ncc1Cl)Br 62a_100000748629_100010223331 [0,2,0,0,0,1|1,0,0]=4 19911 B13R1.893 C=C(C)CSc1cc(ncc1Cl)Br 62a_100010223331_100000211660 [0,2,0,0,0,1|1,0,0]=4 19912 B13R1.893 C=C(C)CSc1cc(ncc1Cl)Cl 62a_100000748629_100010172835 [0,2,0,0,0,1|1,0,0]=4 19913 B13R1.893 C=C(C)CSc1cc(ncc1Cl)Cl 62a_100010172835_100000211660 [0,2,0,0,0,1|1,0,0]=4 19914 B13R1.893 C=C(C)CSc1cc(ncc1Cl)F 62a_100000748629_100009892587 [0,2,0,0,0,1|1,0,0]=4 19915 B13R1.893 C=C(C)CSc1cc(ncc1Cl)F 62a_100009892587_100000211660 [0,2,0,0,0,1|1,0,0]=4 19916 B13R1.893 C=C(C)CSc1cc(ncc1Cl)N 62a_100000748629_100010134119 [0,2,0,0,0,1|1,0,0]=4 19917 B13R1.893 C=C(C)CSc1cc(ncc1Cl)N 62a_100010134119_100000211660 [0,2,0,0,0,1|1,0,0]=4 19918 B13R1.893 C=C(C)CSc1cc(ncc1F)Br 62a_100000748629_100010193852 [0,2,0,0,0,1|1,0,0]=4 19919 B13R1.893 C=C(C)CSc1cc(ncc1F)Br 62a_100010193852_100000211660 [0,2,0,0,0,1|1,0,0]=4 19920 B13R1.893 C=C(C)CSc1cc(ncc1F)C 62a_100000748629_100009867690 [0,2,0,0,0,1|1,0,0]=4 19921 B13R1.893 C=C(C)CSc1cc(ncc1F)C 62a_100009867690_100000211660 [0,2,0,0,0,1|1,0,0]=4 19922 B13R1.893 C=C(C)CSc1cc(ncc1F)Cl 62a_100000708277_100000211660 [0,2,0,0,0,1|1,0,0]=4 19923 B13R1.893 C=C(C)CSc1cc(ncc1F)Cl 62a_100000748629_100000708277 [0,2,0,0,0,1|1,0,0]=4 19924 B13R1.893 C=C(C)CSc1cc(ncc1F)F 62a_100000748629_100010233071 [0,2,0,0,0,1|1,0,0]=4 19925 B13R1.893 C=C(C)CSc1cc(ncc1F)F 62a_100010233071_100000211660 [0,2,0,0,0,1|1,0,0]=4 19926 B13R1.893 C=C(C)CSc1cc(ncc1F)N 62a_100000748629_100015713587 [0,2,0,0,0,1|1,0,0]=4 19927 B13R1.893 C=C(C)CSc1cc(ncc1F)N 62a_100015713587_100000211660 [0,2,0,0,0,1|1,0,0]=4 19928 B13R1.893 C=C(C)CSc1cc(ncc1N)Cl 62a_100000050123_100000211660 [0,2,0,0,0,1|1,0,0]=4 19929 B13R1.893 C=C(C)CSc1cc(ncc1N)Cl 62a_100000748629_100000050123 [0,2,0,0,0,1|1,0,0]=4 19930 B13R1.893 C=C(C)CSc1cc(ncc1O)C 62a_100000748629_100009843476 [0,2,0,0,0,1|1,0,0]=4 19931 B13R1.893 C=C(C)CSc1cc(ncc1O)C 62a_100009843476_100000211660 [0,2,0,0,0,1|1,0,0]=4 19932 B13R1.893 C=C(C)CSc1cc(ncc1O)Cl 62a_100000698892_100000211660 [0,2,0,0,0,1|1,0,0]=4 19933 B13R1.893 C=C(C)CSc1cc(ncc1O)Cl 62a_100000748629_100000698892 [0,2,0,0,0,1|1,0,0]=4 19934 B13R1.893 C=C(C)CSc1cn(ccc1=O)C 62a_100000748629_100010750718 [0,2,0,0,0,1|1,0,0]=4 19935 B13R1.893 C=C(C)CSc1cn(ccc1=O)C 62a_100010750718_100000211660 [0,2,0,0,0,1|1,0,0]=4 19936 B13R1.893 C=C(C)CSc1nc(ccc1Br)N 62a_100000748629_100010192275 [0,2,0,0,0,1|1,0,0]=4 19937 B13R1.893 C=C(C)CSc1nc(ccc1Br)N 62a_100010192275_100000211660 [0,2,0,0,0,1|1,0,0]=4 19938 B13R1.893 C=C(C)CSc1nc(ccc1C)C 62a_100000748629_100009854376 [0,2,0,0,0,1|1,0,0]=4 19939 B13R1.893 C=C(C)CSc1nc(ccc1C)C 62a_100009854376_100000211660 [0,2,0,0,0,1|1,0,0]=4 19940 B13R1.893 C=C(C)CSc1nc(ccc1C)N 62a_100000126722_100000211660 [0,2,0,0,0,1|1,0,0]=4 19941 B13R1.893 C=C(C)CSc1nc(ccc1C)N 62a_100000748629_100000126722 [0,2,0,0,0,1|1,0,0]=4 19942 B13R1.893 C=C(C)CSc1nc(ccc1F)C 62a_100000748629_100009817602 [0,2,0,0,0,1|1,0,0]=4 19943 B13R1.893 C=C(C)CSc1nc(ccc1F)C 62a_100009817602_100000211660 [0,2,0,0,0,1|1,0,0]=4 19944 B13R1.893 C=C(C)CSc1nc(ccc1F)Cl 62a_100000748629_100010136221 [0,2,0,0,0,1|1,0,0]=4 19945 B13R1.893 C=C(C)CSc1nc(ccc1F)Cl 62a_100010136221_100000211660 [0,2,0,0,0,1|1,0,0]=4 19946 B13R1.893 C=C(C)CSc1nc(ccc1F)F 62a_100000748629_100010997973 [0,2,0,0,0,1|1,0,0]=4 19947 B13R1.893 C=C(C)CSc1nc(ccc1F)F 62a_100010997973_100000211660 [0,2,0,0,0,1|1,0,0]=4 19948 B13R1.893 C=C(C)CSc1nc(ccc1F)N 62a_100000748629_100010892222 [0,2,0,0,0,1|1,0,0]=4 19949 B13R1.893 C=C(C)CSc1nc(ccc1F)N 62a_100010892222_100000211660 [0,2,0,0,0,1|1,0,0]=4 19950 B13R1.893 C=C(C)CSc1nc(ccc1N)Br 62a_100000748629_100010168765 [0,2,0,0,0,1|1,0,0]=4 19951 B13R1.893 C=C(C)CSc1nc(ccc1N)Br 62a_100010168765_100000211660 [0,2,0,0,0,1|1,0,0]=4 19952 B13R1.893 C=C(C)CSc1nc(ccc1N)C 62a_100000685570_100000211660 [0,2,0,0,0,1|1,0,0]=4 19953 B13R1.893 C=C(C)CSc1nc(ccc1N)C 62a_100000748629_100000685570 [0,2,0,0,0,1|1,0,0]=4 19954 B13R1.893 C=C(C)CSc1nc(ccc1N)Cl 62a_100000748629_100010233647 [0,2,0,0,0,1|1,0,0]=4 19955 B13R1.893 C=C(C)CSc1nc(ccc1N)Cl 62a_100010233647_100000211660 [0,2,0,0,0,1|1,0,0]=4 19956 B13R1.893 C=C(C)CSc1nc(ccc1N)F 62a_100000748629_100009879877 [0,2,0,0,0,1|1,0,0]=4 19957 B13R1.893 C=C(C)CSc1nc(ccc1N)F 62a_100009879877_100000211660 [0,2,0,0,0,1|1,0,0]=4 19958 B13R1.893 C=C(C)CSc1nc(ccc1N)N 62a_100000748629_200009884323 [0,2,0,0,0,1|1,0,0]=4 19959 B13R1.893 C=C(C)CSc1nc(ccc1N)N 62a_200009884323_100000211660 [0,2,0,0,0,1|1,0,0]=4 19960 B13R1.893 C=C(C)CSc1nc(ccc1O)Br 62a_100000748629_100010253912 [0,2,0,0,0,1|1,0,0]=4 19961 B13R1.893 C=C(C)CSc1nc(ccc1O)Br 62a_100010253912_100000211660 [0,2,0,0,0,1|1,0,0]=4 19962 B13R1.893 C=C(C)CSc1nc(ccc1O)C 62a_100000702858_100000211660 [0,2,0,0,0,1|1,0,0]=4 19963 B13R1.893 C=C(C)CSc1nc(ccc1O)C 62a_100000748629_100000702858 [0,2,0,0,0,1|1,0,0]=4 19964 B13R1.893 C=C(C)CSc1nc(ccc1O)Cl 62a_100000748629_100000696390 [0,2,0,0,0,1|1,0,0]=4 19965 B13R1.893 C=C(C)CSc1nc(ccc1O)F 62a_100000748629_100010382442 [0,2,0,0,0,1|1,0,0]=4 19966 B13R1.893 C=C(C)CSc1nc(ccc1O)F 62a_100010382442_100000211660 [0,2,0,0,0,1|1,0,0]=4 19967 B13R1.893 C=C(F)CNc1cc(ccc1Br)Br 34a_100000737762_100009893438 [0,2,0,0,0,1|1,0,0]=4 19968 B13R1.893 C=C(F)CNc1cc(ccc1Br)C 34a_100000745044_100009893438 [0,2,0,0,0,1|1,0,0]=4 19969 B13R1.893 C=C(F)CNc1cc(ccc1Br)Cl 34a_100000687073_100009893438 [0,2,0,0,0,1|1,0,0]=4 19970 B13R1.893 C=C(F)CNc1cc(ccc1Br)F 34a_100000687223_100009893438 [0,2,0,0,0,1|1,0,0]=4 19971 B13R1.893 C=C(F)CNc1cc(ccc1Br)O 34a_100011999798_100009893438 [0,2,0,0,0,1|1,0,0]=4 19972 B13R1.893 C=C(F)CNc1cc(ccc1C)Br 34a_100000741167_100009893438 [0,2,0,0,0,1|1,0,0]=4 19973 B13R1.893 C=C(F)CNc1cc(ccc1C)Br 7a_100000741167_100000042424 [0,2,0,0,0,1|1,0,0]=4 19974 B13R1.893 C=C(F)CNc1cc(ccc1C)C 2230a_100000185781_100009893438 [0,2,0,0,0,1|1,0,0]=4 19975 B13R1.893 C=C(F)CNc1cc(ccc1C)C 34a_100000185781_100009893438 [0,2,0,0,0,1|1,0,0]=4 19976 B13R1.893 C=C(F)CNc1cc(ccc1C)C 7a_100000185781_100000042424 [0,2,0,0,0,1|1,0,0]=4 19977 B13R1.893 C=C(F)CNc1cc(ccc1C)Cl 34a_100000211374_100009893438 [0,2,0,0,0,1|1,0,0]=4 19978 B13R1.893 C=C(F)CNc1cc(ccc1C)Cl 7a_100000211374_100000042424 [0,2,0,0,0,1|1,0,0]=4 19979 B13R1.893 C=C(F)CNc1cc(ccc1C)F 34a_100000211107_100009893438 [0,2,0,0,0,1|1,0,0]=4 19980 B13R1.893 C=C(F)CNc1cc(ccc1C)F 7a_100000211107_100000042424 [0,2,0,0,0,1|1,0,0]=4 19981 B13R1.893 C=C(F)CNc1cc(ccc1C)I 7a_100000761890_100000042424 [0,2,0,0,0,1|1,0,0]=4 19982 B13R1.893 C=C(F)CNc1cc(ccc1C)O 34a_100011216113_100009893438 [0,2,0,0,0,1|1,0,0]=4 19983 B13R1.893 C=C(F)CNc1cc(ccc1Cl)Br 34a_100000750497_100009893438 [0,2,0,0,0,1|1,0,0]=4 19984 B13R1.893 C=C(F)CNc1cc(ccc1Cl)C 34a_100011215360_100009893438 [0,2,0,0,0,1|1,0,0]=4 19985 B13R1.893 C=C(F)CNc1cc(ccc1Cl)Cl 34a_100000184485_100009893438 [0,2,0,0,0,1|1,0,0]=4 19986 B13R1.893 C=C(F)CNc1cc(ccc1Cl)F 34a_100000751338_100009893438 [0,2,0,0,0,1|1,0,0]=4 19987 B13R1.893 C=C(F)CNc1cc(ccc1Cl)I 34a_200000761891_100009893438 [0,2,0,0,0,1|1,0,0]=4 19988 B13R1.893 C=C(F)CNc1cc(ccc1Cl)O 34a_100011934297_100009893438 [0,2,0,0,0,1|1,0,0]=4 19989 B13R1.893 C=C(F)CNc1cc(ccc1F)Br 34a_100000740924_100009893438 [0,2,0,0,0,1|1,0,0]=4 19990 B13R1.893 C=C(F)CNc1cc(ccc1F)C 34a_100000211285_100009893438 [0,2,0,0,0,1|1,0,0]=4 19991 B13R1.893 C=C(F)CNc1cc(ccc1F)Cl 34a_100000212115_100009893438 [0,2,0,0,0,1|1,0,0]=4 19992 B13R1.893 C=C(F)CNc1cc(ccc1F)F 34a_100000210742_100009893438 [0,2,0,0,0,1|1,0,0]=4 19993 B13R1.893 C=C(F)CNc1cc(ccc1F)I 34a_100011464823_100009893438 [0,2,0,0,0,1|1,0,0]=4 19994 B13R1.893 C=C(F)CNc1cc(ccc1F)O 34a_100012017239_100009893438 [0,2,0,0,0,1|1,0,0]=4 19995 B13R1.893 C=C(F)CNc1cc(ccc1I)Br 34a_100000743836_100009893438 [0,2,0,0,0,1|1,0,0]=4 19996 B13R1.893 C=C(F)CNc1cc(ccc1I)C 34a_100011216686_100009893438 [0,2,0,0,0,1|1,0,0]=4 19997 B13R1.893 C=C(F)CNc1cc(ccc1I)Cl 34a_100000761886_100009893438 [0,2,0,0,0,1|1,0,0]=4 19998 B13R1.893 C=C(F)CNc1cc(ccc1I)F 34a_100011218093_100009893438 [0,2,0,0,0,1|1,0,0]=4 19999 B13R1.893 C=C(F)CNc1cc(ccc1O)Br 34a_100000752626_100009893438 [0,2,0,0,0,1|1,0,0]=4 20000 B13R1.893 C=C(F)CNc1cc(ccc1O)C 34a_100011215204_100009893438 [0,2,0,0,0,1|1,0,0]=4 20001 B13R1.893 C=C(F)CNc1cc(ccc1O)Cl 34a_100000210500_100009893438 [0,2,0,0,0,1|1,0,0]=4 20002 B13R1.893 C=C(F)CNc1cc(ccc1O)F 34a_100000759472_100009893438 [0,2,0,0,0,1|1,0,0]=4 20003 B13R1.893 C=C(F)COc1cc(ccc1Br)Br 34a_100011220040_100009893438 [0,2,0,0,0,1|1,0,0]=4 20004 B13R1.893 C=C(F)COc1cc(ccc1Br)Br 7a_100011220040_100000042424 [0,2,0,0,0,1|1,0,0]=4 20005 B13R1.893 C=C(F)COc1cc(ccc1Br)C 34a_100012002257_100009893438 [0,2,0,0,0,1|1,0,0]=4 20006 B13R1.893 C=C(F)COc1cc(ccc1Br)C 7a_100012002257_100000042424 [0,2,0,0,0,1|1,0,0]=4 20007 B13R1.893 C=C(F)COc1cc(ccc1Br)Cl 34a_100012339455_100009893438 [0,2,0,0,0,1|1,0,0]=4 20008 B13R1.893 C=C(F)COc1cc(ccc1Br)Cl 7a_100012339455_100000042424 [0,2,0,0,0,1|1,0,0]=4 20009 B13R1.893 C=C(F)COc1cc(ccc1Br)F 34a_100000690578_100009893438 [0,2,0,0,0,1|1,0,0]=4 20010 B13R1.893 C=C(F)COc1cc(ccc1Br)F 7a_100000690578_100000042424 [0,2,0,0,0,1|1,0,0]=4 20011 B13R1.893 C=C(F)COc1cc(ccc1Br)I 34a_100012356990_100009893438 [0,2,0,0,0,1|1,0,0]=4 20012 B13R1.893 C=C(F)COc1cc(ccc1Br)I 7a_100012356990_100000042424 [0,2,0,0,0,1|1,0,0]=4 20013 B13R1.893 C=C(F)COc1cc(ccc1C)Br 34a_100000685420_100009893438 [0,2,0,0,0,1|1,0,0]=4 20014 B13R1.893 C=C(F)COc1cc(ccc1C)Br 7a_100000685420_100000042424 [0,2,0,0,0,1|1,0,0]=4 20015 B13R1.893 C=C(F)COc1cc(ccc1C)C 34a_100000210931_100009893438 [0,2,0,0,0,1|1,0,0]=4 20016 B13R1.893 C=C(F)COc1cc(ccc1C)C 7a_100000210931_100000042424 [0,2,0,0,0,1|1,0,0]=4 20017 B13R1.893 C=C(F)COc1cc(ccc1C)Cl 34a_100000756515_100009893438 [0,2,0,0,0,1|1,0,0]=4 20018 B13R1.893 C=C(F)COc1cc(ccc1C)Cl 7a_100000756515_100000042424 [0,2,0,0,0,1|1,0,0]=4 20019 B13R1.893 C=C(F)COc1cc(ccc1C)F 34a_100000690566_100009893438 [0,2,0,0,0,1|1,0,0]=4 20020 B13R1.893 C=C(F)COc1cc(ccc1C)F 7a_100000690566_100000042424 [0,2,0,0,0,1|1,0,0]=4 20021 B13R1.893 C=C(F)COc1cc(ccc1C)I 7a_100000766334_100000042424 [0,2,0,0,0,1|1,0,0]=4 20022 B13R1.893 C=C(F)COc1cc(ccc1C)N 34a_100000759471_100009893438 [0,2,0,0,0,1|1,0,0]=4 20023 B13R1.893 C=C(F)COc1cc(ccc1C)N 7a_100000759471_100000042424 [0,2,0,0,0,1|1,0,0]=4 20024 B13R1.893 C=C(F)COc1cc(ccc1Cl)Br 34a_100000738945_100009893438 [0,2,0,0,0,1|1,0,0]=4 20025 B13R1.893 C=C(F)COc1cc(ccc1Cl)Br 7a_100000738945_100000042424 [0,2,0,0,0,1|1,0,0]=4 20026 B13R1.893 C=C(F)COc1cc(ccc1Cl)C 34a_100000211493_100009893438 [0,2,0,0,0,1|1,0,0]=4 20027 B13R1.893 C=C(F)COc1cc(ccc1Cl)C 7a_100000211493_100000042424 [0,2,0,0,0,1|1,0,0]=4 20028 B13R1.893 C=C(F)COc1cc(ccc1Cl)Cl 34a_100000211422_100009893438 [0,2,0,0,0,1|1,0,0]=4 20029 B13R1.893 C=C(F)COc1cc(ccc1Cl)Cl 7a_100000211422_100000042424 [0,2,0,0,0,1|1,0,0]=4 20030 B13R1.893 C=C(F)COc1cc(ccc1Cl)F 34a_100000692107_100009893438 [0,2,0,0,0,1|1,0,0]=4 20031 B13R1.893 C=C(F)COc1cc(ccc1Cl)F 7a_100000692107_100000042424 [0,2,0,0,0,1|1,0,0]=4 20032 B13R1.893 C=C(F)COc1cc(ccc1Cl)I 34a_100011356854_100009893438 [0,2,0,0,0,1|1,0,0]=4 20033 B13R1.893 C=C(F)COc1cc(ccc1Cl)I 7a_100011356854_100000042424 [0,2,0,0,0,1|1,0,0]=4 20034 B13R1.893 C=C(F)COc1cc(ccc1Cl)N 34a_100011934209_100009893438 [0,2,0,0,0,1|1,0,0]=4 20035 B13R1.893 C=C(F)COc1cc(ccc1F)Br 34a_100000686035_100009893438 [0,2,0,0,0,1|1,0,0]=4 20036 B13R1.893 C=C(F)COc1cc(ccc1F)Br 7a_100000686035_100000042424 [0,2,0,0,0,1|1,0,0]=4 20037 B13R1.893 C=C(F)COc1cc(ccc1F)C 34a_100000759540_100009893438 [0,2,0,0,0,1|1,0,0]=4 20038 B13R1.893 C=C(F)COc1cc(ccc1F)C 7a_100000759540_100000042424 [0,2,0,0,0,1|1,0,0]=4 20039 B13R1.893 C=C(F)COc1cc(ccc1F)Cl 34a_100000757397_100009893438 [0,2,0,0,0,1|1,0,0]=4 20040 B13R1.893 C=C(F)COc1cc(ccc1F)Cl 7a_100000757397_100000042424 [0,2,0,0,0,1|1,0,0]=4 20041 B13R1.893 C=C(F)COc1cc(ccc1F)F 34a_100000752141_100009893438 [0,2,0,0,0,1|1,0,0]=4 20042 B13R1.893 C=C(F)COc1cc(ccc1F)F 7a_100000752141_100000042424 [0,2,0,0,0,1|1,0,0]=4 20043 B13R1.893 C=C(F)COc1cc(ccc1F)I 34a_100009958187_100009893438 [0,2,0,0,0,1|1,0,0]=4 20044 B13R1.893 C=C(F)COc1cc(ccc1F)I 7a_100009958187_100000042424 [0,2,0,0,0,1|1,0,0]=4 20045 B13R1.893 C=C(F)COc1cc(ccc1F)N 34a_100012017398_100009893438 [0,2,0,0,0,1|1,0,0]=4 20046 B13R1.893 C=C(F)COc1cc(ccc1F)N 7a_100012017398_100000042424 [0,2,0,0,0,1|1,0,0]=4 20047 B13R1.893 C=C(F)COc1cc(ccc1I)Br 34a_100012344904_100009893438 [0,2,0,0,0,1|1,0,0]=4 20048 B13R1.893 C=C(F)COc1cc(ccc1I)Br 7a_100012344904_100000042424 [0,2,0,0,0,1|1,0,0]=4 20049 B13R1.893 C=C(F)COc1cc(ccc1I)Cl 34a_100000050036_100009893438 [0,2,0,0,0,1|1,0,0]=4 20050 B13R1.893 C=C(F)COc1cc(ccc1I)Cl 7a_100000050036_100000042424 [0,2,0,0,0,1|1,0,0]=4 20051 B13R1.893 C=C(F)COc1cc(ccc1I)F 34a_100010084537_100009893438 [0,2,0,0,0,1|1,0,0]=4 20052 B13R1.893 C=C(F)COc1cc(ccc1I)F 7a_100010084537_100000042424 [0,2,0,0,0,1|1,0,0]=4 20053 B13R1.893 C=C(F)COc1cc(ccc1N)Br 34a_100000739049_100009893438 [0,2,0,0,0,1|1,0,0]=4 20054 B13R1.893 C=C(F)COc1cc(ccc1N)Br 7a_100000739049_100000042424 [0,2,0,0,0,1|1,0,0]=4 20055 B13R1.893 C=C(F)COc1cc(ccc1N)C 34a_100000211527_100009893438 [0,2,0,0,0,1|1,0,0]=4 20056 B13R1.893 C=C(F)COc1cc(ccc1N)C 7a_100000211527_100000042424 [0,2,0,0,0,1|1,0,0]=4 20057 B13R1.893 C=C(F)COc1cc(ccc1N)Cl 34a_100000185728_100009893438 [0,2,0,0,0,1|1,0,0]=4 20058 B13R1.893 C=C(F)COc1cc(ccc1N)Cl 7a_100000185728_100000042424 [0,2,0,0,0,1|1,0,0]=4 20059 B13R1.893 C=C(F)COc1cc(ccc1N)F 34a_100000753323_100009893438 [0,2,0,0,0,1|1,0,0]=4 20060 B13R1.893 C=C(F)COc1cc(ccc1N)F 7a_100000753323_100000042424 [0,2,0,0,0,1|1,0,0]=4 20061 B13R1.893 C=C(F)COc1cc(ccc1N)I 34a_100000057187_100009893438 [0,2,0,0,0,1|1,0,0]=4 20062 B13R1.893 C=C(F)COc1cc(ccc1N)I 7a_100000057187_100000042424 [0,2,0,0,0,1|1,0,0]=4 20063 B13R1.893 C=C(F)COc1cc(ccc1N)N 34a_100025717382_100009893438 [0,2,0,0,0,1|1,0,0]=4 20064 B13R1.893 C=C(F)CSc1cc(ccc1Br)Br 62a_100000042424_100011483371 [0,2,0,0,0,1|1,0,0]=4 20065 B13R1.893 C=C(F)CSc1cc(ccc1Br)Br 62a_100011483371_100000042424 [0,2,0,0,0,1|1,0,0]=4 20066 B13R1.893 C=C(F)CSc1cc(ccc1Br)C 62a_100000042424_100012353751 [0,2,0,0,0,1|1,0,0]=4 20067 B13R1.893 C=C(F)CSc1cc(ccc1Br)C 62a_100012353751_100000042424 [0,2,0,0,0,1|1,0,0]=4 20068 B13R1.893 C=C(F)CSc1cc(ccc1Br)Cl 62a_100000042424_100012339723 [0,2,0,0,0,1|1,0,0]=4 20069 B13R1.893 C=C(F)CSc1cc(ccc1Br)Cl 62a_100012339723_100000042424 [0,2,0,0,0,1|1,0,0]=4 20070 B13R1.893 C=C(F)CSc1cc(ccc1Br)F 62a_100000042424_100011217576 [0,2,0,0,0,1|1,0,0]=4 20071 B13R1.893 C=C(F)CSc1cc(ccc1Br)F 62a_100011217576_100000042424 [0,2,0,0,0,1|1,0,0]=4 20072 B13R1.893 C=C(F)CSc1cc(ccc1Br)N 62a_100000042424_100000750459 [0,2,0,0,0,1|1,0,0]=4 20073 B13R1.893 C=C(F)CSc1cc(ccc1Br)N 62a_100000750459_100000042424 [0,2,0,0,0,1|1,0,0]=4 20074 B13R1.893 C=C(F)CSc1cc(ccc1Br)O 62a_100000042424_100012339312 [0,2,0,0,0,1|1,0,0]=4 20075 B13R1.893 C=C(F)CSc1cc(ccc1Br)O 62a_100012339312_100000042424 [0,2,0,0,0,1|1,0,0]=4 20076 B13R1.893 C=C(F)CSc1cc(ccc1C)Br 62a_100000042424_100011344865 [0,2,0,0,0,1|1,0,0]=4 20077 B13R1.893 C=C(F)CSc1cc(ccc1C)Br 62a_100011344865_100000042424 [0,2,0,0,0,1|1,0,0]=4 20078 B13R1.893 C=C(F)CSc1cc(ccc1C)C 62a_100000042424_100000210833 [0,2,0,0,0,1|1,0,0]=4 20079 B13R1.893 C=C(F)CSc1cc(ccc1C)C 62a_100000210833_100000042424 [0,2,0,0,0,1|1,0,0]=4 20080 B13R1.893 C=C(F)CSc1cc(ccc1C)Cl 62a_100000042424_100011263213 [0,2,0,0,0,1|1,0,0]=4 20081 B13R1.893 C=C(F)CSc1cc(ccc1C)Cl 62a_100011263213_100000042424 [0,2,0,0,0,1|1,0,0]=4 20082 B13R1.893 C=C(F)CSc1cc(ccc1C)F 62a_100000042424_100011218078 [0,2,0,0,0,1|1,0,0]=4 20083 B13R1.893 C=C(F)CSc1cc(ccc1C)F 62a_100011218078_100000042424 [0,2,0,0,0,1|1,0,0]=4 20084 B13R1.893 C=C(F)CSc1cc(ccc1C)N 62a_100000042424_100000736455 [0,2,0,0,0,1|1,0,0]=4 20085 B13R1.893 C=C(F)CSc1cc(ccc1C)N 62a_100000736455_100000042424 [0,2,0,0,0,1|1,0,0]=4 20086 B13R1.893 C=C(F)CSc1cc(ccc1C)O 62a_100000042424_100011380479 [0,2,0,0,0,1|1,0,0]=4 20087 B13R1.893 C=C(F)CSc1cc(ccc1C)O 62a_100011380479_100000042424 [0,2,0,0,0,1|1,0,0]=4 20088 B13R1.893 C=C(F)CSc1cc(ccc1Cl)Br 62a_100000042424_100011772130 [0,2,0,0,0,1|1,0,0]=4 20089 B13R1.893 C=C(F)CSc1cc(ccc1Cl)Br 62a_100011772130_100000042424 [0,2,0,0,0,1|1,0,0]=4 20090 B13R1.893 C=C(F)CSc1cc(ccc1Cl)C 62a_100000042424_100012356289 [0,2,0,0,0,1|1,0,0]=4 20091 B13R1.893 C=C(F)CSc1cc(ccc1Cl)C 62a_100012356289_100000042424 [0,2,0,0,0,1|1,0,0]=4 20092 B13R1.893 C=C(F)CSc1cc(ccc1Cl)Cl 62a_100000042424_100000707729 [0,2,0,0,0,1|1,0,0]=4 20093 B13R1.893 C=C(F)CSc1cc(ccc1Cl)Cl 62a_100000707729_100000042424 [0,2,0,0,0,1|1,0,0]=4 20094 B13R1.893 C=C(F)CSc1cc(ccc1Cl)F 62a_100000042424_100011217299 [0,2,0,0,0,1|1,0,0]=4 20095 B13R1.893 C=C(F)CSc1cc(ccc1Cl)F 62a_100011217299_100000042424 [0,2,0,0,0,1|1,0,0]=4 20096 B13R1.893 C=C(F)CSc1cc(ccc1Cl)N 62a_100000042424_100012360549 [0,2,0,0,0,1|1,0,0]=4 20097 B13R1.893 C=C(F)CSc1cc(ccc1Cl)N 62a_100012360549_100000042424 [0,2,0,0,0,1|1,0,0]=4 20098 B13R1.893 C=C(F)CSc1cc(ccc1Cl)O 62a_100000042424_100000049588 [0,2,0,0,0,1|1,0,0]=4 20099 B13R1.893 C=C(F)CSc1cc(ccc1Cl)O 62a_100000049588_100000042424 [0,2,0,0,0,1|1,0,0]=4 20100 B13R1.893 C=C(F)CSc1cc(ccc1F)Br 62a_100000042424_100011217312 [0,2,0,0,0,1|1,0,0]=4 20101 B13R1.893 C=C(F)CSc1cc(ccc1F)Br 62a_100011217312_100000042424 [0,2,0,0,0,1|1,0,0]=4 20102 B13R1.893 C=C(F)CSc1cc(ccc1F)C 62a_100000042424_100000736223 [0,2,0,0,0,1|1,0,0]=4 20103 B13R1.893 C=C(F)CSc1cc(ccc1F)C 62a_100000736223_100000042424 [0,2,0,0,0,1|1,0,0]=4 20104 B13R1.893 C=C(F)CSc1cc(ccc1F)Cl 62a_100000042424_100011218116 [0,2,0,0,0,1|1,0,0]=4 20105 B13R1.893 C=C(F)CSc1cc(ccc1F)Cl 62a_100011218116_100000042424 [0,2,0,0,0,1|1,0,0]=4 20106 B13R1.893 C=C(F)CSc1cc(ccc1F)F 62a_100000042424_100011219198 [0,2,0,0,0,1|1,0,0]=4 20107 B13R1.893 C=C(F)CSc1cc(ccc1F)F 62a_100011219198_100000042424 [0,2,0,0,0,1|1,0,0]=4 20108 B13R1.893 C=C(F)CSc1cc(ccc1F)N 62a_100000042424_100000760356 [0,2,0,0,0,1|1,0,0]=4 20109 B13R1.893 C=C(F)CSc1cc(ccc1F)N 62a_100000760356_100000042424 [0,2,0,0,0,1|1,0,0]=4 20110 B13R1.893 C=C(F)CSc1cc(ccc1F)O 62a_100000042424_100000693481 [0,2,0,0,0,1|1,0,0]=4 20111 B13R1.893 C=C(F)CSc1cc(ccc1F)O 62a_100000693481_100000042424 [0,2,0,0,0,1|1,0,0]=4 20112 B13R1.893 C=C(F)CSc1cc(ccc1N)Br 62a_100000042424_100000187925 [0,2,0,0,0,1|1,0,0]=4 20113 B13R1.893 C=C(F)CSc1cc(ccc1N)Br 62a_100000187925_100000042424 [0,2,0,0,0,1|1,0,0]=4 20114 B13R1.893 C=C(F)CSc1cc(ccc1N)C 62a_100000042424_100011356834 [0,2,0,0,0,1|1,0,0]=4 20115 B13R1.893 C=C(F)CSc1cc(ccc1N)C 62a_100011356834_100000042424 [0,2,0,0,0,1|1,0,0]=4 20116 B13R1.893 C=C(F)CSc1cc(ccc1N)Cl 62a_100000042424_100000761889 [0,2,0,0,0,1|1,0,0]=4 20117 B13R1.893 C=C(F)CSc1cc(ccc1N)Cl 62a_100000761889_100000042424 [0,2,0,0,0,1|1,0,0]=4 20118 B13R1.893 C=C(F)CSc1cc(ccc1N)F 62a_100000042424_100000760547 [0,2,0,0,0,1|1,0,0]=4 20119 B13R1.893 C=C(F)CSc1cc(ccc1N)F 62a_100000760547_100000042424 [0,2,0,0,0,1|1,0,0]=4 20120 B13R1.893 C=C(F)CSc1cc(ccc1N)N 62a_100000042424_100011534242 [0,2,0,0,0,1|1,0,0]=4 20121 B13R1.893 C=C(F)CSc1cc(ccc1N)N 62a_100011534242_100000042424 [0,2,0,0,0,1|1,0,0]=4 20122 B13R1.893 C=C(F)CSc1cc(ccc1N)O 62a_100000042424_100012001276 [0,2,0,0,0,1|1,0,0]=4 20123 B13R1.893 C=C(F)CSc1cc(ccc1N)O 62a_100012001276_100000042424 [0,2,0,0,0,1|1,0,0]=4 20124 B13R1.893 C=C(F)CSc1cc(ccc1O)Br 62a_100000042424_100012355227 [0,2,0,0,0,1|1,0,0]=4 20125 B13R1.893 C=C(F)CSc1cc(ccc1O)Br 62a_100012355227_100000042424 [0,2,0,0,0,1|1,0,0]=4 20126 B13R1.893 C=C(F)CSc1cc(ccc1O)C 62a_100000042424_100000765521 [0,2,0,0,0,1|1,0,0]=4 20127 B13R1.893 C=C(F)CSc1cc(ccc1O)C 62a_100000765521_100000042424 [0,2,0,0,0,1|1,0,0]=4 20128 B13R1.893 C=C(F)CSc1cc(ccc1O)Cl 62a_100000042424_100011356953 [0,2,0,0,0,1|1,0,0]=4 20129 B13R1.893 C=C(F)CSc1cc(ccc1O)Cl 62a_100011356953_100000042424 [0,2,0,0,0,1|1,0,0]=4 20130 B13R1.893 C=C(F)CSc1cc(ccc1O)F 62a_100000042424_100000211999 [0,2,0,0,0,1|1,0,0]=4 20131 B13R1.893 C=C(F)CSc1cc(ccc1O)F 62a_100000211999_100000042424 [0,2,0,0,0,1|1,0,0]=4 20132 B13R1.893 C=C(F)CSc1cc(ccc1O)N 62a_100000042424_100011534360 [0,2,0,0,0,1|1,0,0]=4 20133 B13R1.893 C=C(F)CSc1cc(ccc1O)N 62a_100011534360_100000042424 [0,2,0,0,0,1|1,0,0]=4 20134 B13R1.893 C=C(F)CSc1cc(ccc1O)O 62a_100000042424_100009813629 [0,2,0,0,0,1|1,0,0]=4 20135 B13R1.893 CC(=O)CCc1cc(ccc1Br)F 1458a_100000685340_200000210301 [0,2,0,0,0,1|1,0,0]=4 20136 B13R1.893 CC(=O)CCc1cc(ccc1C)C 1458a_100011485725_200000210301 [0,2,0,0,0,1|1,0,0]=4 20137 B13R1.893 CC(=O)CCc1cc(ccc1C)F 1458a_100011830270_200000210301 [0,2,0,0,0,1|1,0,0]=4 20138 B13R1.893 CC(=O)CCc1cc(ccc1Cl)Br 1458a_100010145785_200000210301 [0,2,0,0,0,1|1,0,0]=4 20139 B13R1.893 CC(=O)CCc1cc(ccc1Cl)Cl 1458a_200012258936_200000210301 [0,2,0,0,0,1|1,0,0]=4 20140 B13R1.893 CC(=O)CCc1cc(ccc1Cl)F 1458a_100012357546_200000210301 [0,2,0,0,0,1|1,0,0]=4 20141 B13R1.893 CC(=O)CCc1cc(ccc1F)Br 1458a_100000694007_200000210301 [0,2,0,0,0,1|1,0,0]=4 20142 B13R1.893 CC(=O)CCc1cc(ccc1F)C 1458a_100011934859_200000210301 [0,2,0,0,0,1|1,0,0]=4 20143 B13R1.893 CC(=O)CCc1cc(ccc1F)Cl 1458a_200012349660_200000210301 [0,2,0,0,0,1|1,0,0]=4 20144 B13R1.893 CC(=O)CCc1cc(ccc1F)F 1458a_100000070787_100011755056 [0,2,0,0,0,1|1,0,0]=4 20145 B13R1.893 CC(=O)CCc1cc(ccc1F)F 1458a_100000744313_200000210301 [0,2,0,0,0,1|1,0,0]=4 20146 B13R1.893 CC(=O)COc1cc(ccc1Br)Cl 1458a_100015481456_200000210301 [0,2,0,0,0,1|1,0,0]=4 20147 B13R1.893 CC(=O)COc1cc(ccc1C)C 1458a_100000182428_200000210301 [0,2,0,0,0,1|1,0,0]=4 20148 B13R1.893 CC(=O)COc1cc(ccc1Cl)C 1458a_100000183693_200000210301 [0,2,0,0,0,1|1,0,0]=4 20149 B13R1.893 CC(=O)COc1cc(ccc1Cl)Cl 1458a_100000187393_200000210301 [0,2,0,0,0,1|1,0,0]=4 20150 B13R1.893 CC(=O)COc1cc(ccc1F)F 1458a_100000752474_200000210301 [0,2,0,0,0,1|1,0,0]=4 20151 B13R1.893 CC(=O)CSc1cc(ccc1Cl)Cl 1458a_100000179523_200000210301 [0,2,0,0,0,1|1,0,0]=4 20152 B13R1.893 CC(=O)NCc1cc(ccc1Br)Br 11a_100000707832_100015343762 [0,2,0,0,0,1|1,0,0]=4 20153 B13R1.893 CC(=O)NCc1cc(ccc1Br)Br 1626a_100000707832_100015343762 [0,2,0,0,0,1|1,0,0]=4 20154 B13R1.893 CC(=O)NCc1cc(ccc1Br)Br 240690a_100000707832_100015343762 [0,2,0,0,0,1|1,0,0]=4 20155 B13R1.893 CC(=O)NCc1cc(ccc1Br)Br 527a_100000707832_100103153847 [0,2,0,0,0,1|1,0,0]=4 20156 B13R1.893 CC(=O)NCc1cc(ccc1Br)F 11a_100000742738_100015343762 [0,2,0,0,0,1|1,0,0]=4 20157 B13R1.893 CC(=O)NCc1cc(ccc1Br)F 1626a_100000742738_100015343762 [0,2,0,0,0,1|1,0,0]=4 20158 B13R1.893 CC(=O)NCc1cc(ccc1Br)F 240690a_100000742738_100015343762 [0,2,0,0,0,1|1,0,0]=4 20159 B13R1.893 CC(=O)NCc1cc(ccc1Br)F 527a_100000742738_100103153847 [0,2,0,0,0,1|1,0,0]=4 20160 B13R1.893 CC(=O)NCc1cc(ccc1C)C 11a_100000174964_100015343762 [0,2,0,0,0,1|1,0,0]=4 20161 B13R1.893 CC(=O)NCc1cc(ccc1C)C 1626a_100000174964_100015343762 [0,2,0,0,0,1|1,0,0]=4 20162 B13R1.893 CC(=O)NCc1cc(ccc1C)C 240690a_100000174964_100015343762 [0,2,0,0,0,1|1,0,0]=4 20163 B13R1.893 CC(=O)NCc1cc(ccc1C)C 527a_100000174964_100103153847 [0,2,0,0,0,1|1,0,0]=4 20164 B13R1.893 CC(=O)NCc1cc(ccc1C)Cl 11a_100000717755_100015343762 [0,2,0,0,0,1|1,0,0]=4 20165 B13R1.893 CC(=O)NCc1cc(ccc1C)Cl 1626a_100000717755_100015343762 [0,2,0,0,0,1|1,0,0]=4 20166 B13R1.893 CC(=O)NCc1cc(ccc1C)Cl 240690a_100000717755_100015343762 [0,2,0,0,0,1|1,0,0]=4 20167 B13R1.893 CC(=O)NCc1cc(ccc1C)Cl 527a_100000717755_100103153847 [0,2,0,0,0,1|1,0,0]=4 20168 B13R1.893 CC(=O)NCc1cc(ccc1C)F 11a_100011217291_100015343762 [0,2,0,0,0,1|1,0,0]=4 20169 B13R1.893 CC(=O)NCc1cc(ccc1C)F 1626a_100011217291_100015343762 [0,2,0,0,0,1|1,0,0]=4 20170 B13R1.893 CC(=O)NCc1cc(ccc1C)F 240690a_100011217291_100015343762 [0,2,0,0,0,1|1,0,0]=4 20171 B13R1.893 CC(=O)NCc1cc(ccc1C)F 527a_100011217291_100103153847 [0,2,0,0,0,1|1,0,0]=4 20172 B13R1.893 CC(=O)NCc1cc(ccc1C)O 240690a_200009844824_100015343762 [0,2,0,0,0,1|1,0,0]=4 20173 B13R1.893 CC(=O)NCc1cc(ccc1C)O 527a_200009844824_100103153847 [0,2,0,0,0,1|1,0,0]=4 20174 B13R1.893 CC(=O)NCc1cc(ccc1Cl)Br 11a_100025772652_100015343762 [0,2,0,0,0,1|1,0,0]=4 20175 B13R1.893 CC(=O)NCc1cc(ccc1Cl)Br 1626a_100025772652_100015343762 [0,2,0,0,0,1|1,0,0]=4 20176 B13R1.893 CC(=O)NCc1cc(ccc1Cl)Br 240690a_100025772652_100015343762 [0,2,0,0,0,1|1,0,0]=4 20177 B13R1.893 CC(=O)NCc1cc(ccc1Cl)Br 527a_100025772652_100103153847 [0,2,0,0,0,1|1,0,0]=4 20178 B13R1.893 CC(=O)NCc1cc(ccc1Cl)C 11a_100025705715_100015343762 [0,2,0,0,0,1|1,0,0]=4 20179 B13R1.893 CC(=O)NCc1cc(ccc1Cl)C 1626a_100025705715_100015343762 [0,2,0,0,0,1|1,0,0]=4 20180 B13R1.893 CC(=O)NCc1cc(ccc1Cl)C 240690a_100025705715_100015343762 [0,2,0,0,0,1|1,0,0]=4 20181 B13R1.893 CC(=O)NCc1cc(ccc1Cl)C 527a_100025705715_100103153847 [0,2,0,0,0,1|1,0,0]=4 20182 B13R1.893 CC(=O)NCc1cc(ccc1Cl)Cl 11a_100102946428_100015343762 [0,2,0,0,0,1|1,0,0]=4 20183 B13R1.893 CC(=O)NCc1cc(ccc1Cl)Cl 1626a_100102946428_100015343762 [0,2,0,0,0,1|1,0,0]=4 20184 B13R1.893 CC(=O)NCc1cc(ccc1Cl)Cl 240690a_100102946428_100015343762 [0,2,0,0,0,1|1,0,0]=4 20185 B13R1.893 CC(=O)NCc1cc(ccc1Cl)Cl 527a_100102946428_100103153847 [0,2,0,0,0,1|1,0,0]=4 20186 B13R1.893 CC(=O)NCc1cc(ccc1Cl)F 11a_100011830483_100015343762 [0,2,0,0,0,1|1,0,0]=4 20187 B13R1.893 CC(=O)NCc1cc(ccc1Cl)F 1626a_100011830483_100015343762 [0,2,0,0,0,1|1,0,0]=4 20188 B13R1.893 CC(=O)NCc1cc(ccc1Cl)F 240690a_100011830483_100015343762 [0,2,0,0,0,1|1,0,0]=4 20189 B13R1.893 CC(=O)NCc1cc(ccc1Cl)F 527a_100011830483_100103153847 [0,2,0,0,0,1|1,0,0]=4 20190 B13R1.893 CC(=O)NCc1cc(ccc1F)Br 11a_100009815772_100015343762 [0,2,0,0,0,1|1,0,0]=4 20191 B13R1.893 CC(=O)NCc1cc(ccc1F)Br 1626a_100009815772_100015343762 [0,2,0,0,0,1|1,0,0]=4 20192 B13R1.893 CC(=O)NCc1cc(ccc1F)Br 240690a_100009815772_100015343762 [0,2,0,0,0,1|1,0,0]=4 20193 B13R1.893 CC(=O)NCc1cc(ccc1F)Br 527a_100009815772_100103153847 [0,2,0,0,0,1|1,0,0]=4 20194 B13R1.893 CC(=O)NCc1cc(ccc1F)C 11a_100102693586_100015343762 [0,2,0,0,0,1|1,0,0]=4 20195 B13R1.893 CC(=O)NCc1cc(ccc1F)C 1626a_100102693586_100015343762 [0,2,0,0,0,1|1,0,0]=4 20196 B13R1.893 CC(=O)NCc1cc(ccc1F)C 240690a_100102693586_100015343762 [0,2,0,0,0,1|1,0,0]=4 20197 B13R1.893 CC(=O)NCc1cc(ccc1F)C 527a_100102693586_100103153847 [0,2,0,0,0,1|1,0,0]=4 20198 B13R1.893 CC(=O)NCc1cc(ccc1F)Cl 11a_100011211646_100015343762 [0,2,0,0,0,1|1,0,0]=4 20199 B13R1.893 CC(=O)NCc1cc(ccc1F)Cl 1626a_100011211646_100015343762 [0,2,0,0,0,1|1,0,0]=4 20200 B13R1.893 CC(=O)NCc1cc(ccc1F)Cl 240690a_100011211646_100015343762 [0,2,0,0,0,1|1,0,0]=4 20201 B13R1.893 CC(=O)NCc1cc(ccc1F)Cl 527a_100011211646_100103153847 [0,2,0,0,0,1|1,0,0]=4 20202 B13R1.893 CC(=O)NCc1cc(ccc1F)F 11a_100000752317_100015343762 [0,2,0,0,0,1|1,0,0]=4 20203 B13R1.893 CC(=O)NCc1cc(ccc1F)F 1626a_100000752317_100015343762 [0,2,0,0,0,1|1,0,0]=4 20204 B13R1.893 CC(=O)NCc1cc(ccc1F)F 240690a_100000752317_100015343762 [0,2,0,0,0,1|1,0,0]=4 20205 B13R1.893 CC(=O)NCc1cc(ccc1F)F 527a_100000752317_100103153847 [0,2,0,0,0,1|1,0,0]=4 20206 B13R1.893 CC(=O)NCc1cc(ccc1O)Br 240690a_100000730032_100015343762 [0,2,0,0,0,1|1,0,0]=4 20207 B13R1.893 CC(=O)NCc1cc(ccc1O)Br 527a_100000730032_100103153847 [0,2,0,0,0,1|1,0,0]=4 20208 B13R1.893 CC(=O)NCc1cc(ccc1O)Cl 240690a_100000238540_100015343762 [0,2,0,0,0,1|1,0,0]=4 20209 B13R1.893 CC(=O)NCc1cc(ccc1O)Cl 527a_100000238540_100103153847 [0,2,0,0,0,1|1,0,0]=4 20210 B13R1.893 Cc1ccc(c(c1)CCC(=O)[13CH3])C 1458a_100011485725_200025704644 [0,2,0,0,0,1|1,0,0]=4 20211 B13R1.893 Cc1ccc(c(c1)CCC(=O)[13CH3])F 1458a_100011934859_200025704644 [0,2,0,0,0,1|1,0,0]=4 20212 B13R1.893 Cc1ccc(c(c1)OCC(=O)[13CH3])C 1458a_100000182428_200025704644 [0,2,0,0,0,1|1,0,0]=4 20213 B13R1.893 Cc1ccc(c(c1)OCC(=O)[13CH3])Cl 1458a_100000183693_200025704644 [0,2,0,0,0,1|1,0,0]=4 20214 B13R1.893 Cc1ccc(cc1CCC(=O)[13CH3])F 1458a_100011830270_200025704644 [0,2,0,0,0,1|1,0,0]=4 20215 B13R1.893 [13CH3]C(=O)CCc1cc(ccc1Br)F 1458a_100000685340_200025704644 [0,2,0,0,0,1|1,0,0]=4 20216 B13R1.893 [13CH3]C(=O)CCc1cc(ccc1Cl)Br 1458a_100010145785_200025704644 [0,2,0,0,0,1|1,0,0]=4 20217 B13R1.893 [13CH3]C(=O)CCc1cc(ccc1Cl)Cl 1458a_200012258936_200025704644 [0,2,0,0,0,1|1,0,0]=4 20218 B13R1.893 [13CH3]C(=O)CCc1cc(ccc1Cl)F 1458a_100012357546_200025704644 [0,2,0,0,0,1|1,0,0]=4 20219 B13R1.893 [13CH3]C(=O)CCc1cc(ccc1F)Br 1458a_100000694007_200025704644 [0,2,0,0,0,1|1,0,0]=4 20220 B13R1.893 [13CH3]C(=O)CCc1cc(ccc1F)Cl 1458a_200012349660_200025704644 [0,2,0,0,0,1|1,0,0]=4 20221 B13R1.893 [13CH3]C(=O)CCc1cc(ccc1F)F 1458a_100000744313_200025704644 [0,2,0,0,0,1|1,0,0]=4 20222 B13R1.893 [13CH3]C(=O)COc1cc(ccc1Br)Cl 1458a_100015481456_200025704644 [0,2,0,0,0,1|1,0,0]=4 20223 B13R1.893 [13CH3]C(=O)COc1cc(ccc1Cl)Cl 1458a_100000187393_200025704644 [0,2,0,0,0,1|1,0,0]=4 20224 B13R1.893 [13CH3]C(=O)COc1cc(ccc1F)F 1458a_100000752474_200025704644 [0,2,0,0,0,1|1,0,0]=4 20225 B13R1.893 [13CH3]C(=O)CSc1cc(ccc1Cl)Cl 1458a_100000179523_200025704644 [0,2,0,0,0,1|1,0,0]=4 20226 B13R1.3787 C=C(C)CNc1c(cccc1Br)Br 34a_100000690995_100000748629 [0,2,0,0,0,1|0,0,0]=3 20227 B13R1.3787 C=C(C)CNc1c(cccc1Br)C 34a_100011834072_100000748629 [0,2,0,0,0,1|0,0,0]=3 20228 B13R1.3787 C=C(C)CNc1c(cccc1Br)Cl 34a_100102946385_100000748629 [0,2,0,0,0,1|0,0,0]=3 20229 B13R1.3787 C=C(C)CNc1c(cccc1Br)F 34a_100000684712_100000748629 [0,2,0,0,0,1|0,0,0]=3 20230 B13R1.3787 C=C(C)CNc1c(cccc1Br)O 34a_100011934926_100000748629 [0,2,0,0,0,1|0,0,0]=3 20231 B13R1.3787 C=C(C)CNc1c(cccc1C)C 34a_100000185769_100000748629 [0,2,0,0,0,1|0,0,0]=3 20232 B13R1.3787 C=C(C)CNc1c(cccc1Cl)C 34a_100000756524_100000748629 [0,2,0,0,0,1|0,0,0]=3 20233 B13R1.3787 C=C(C)CNc1c(cccc1Cl)Cl 34a_100000210028_100000748629 [0,2,0,0,0,1|0,0,0]=3 20234 B13R1.3787 C=C(C)CNc1c(cccc1Cl)F 34a_100000760031_100000748629 [0,2,0,0,0,1|0,0,0]=3 20235 B13R1.3787 C=C(C)CNc1c(cccc1Cl)O 34a_100012022510_100000748629 [0,2,0,0,0,1|0,0,0]=3 20236 B13R1.3787 C=C(C)CNc1c(cccc1F)C 34a_100000766463_100000748629 [0,2,0,0,0,1|0,0,0]=3 20237 B13R1.3787 C=C(C)CNc1c(cccc1F)F 2230a_100000210704_100000748629 [0,2,0,0,0,1|0,0,0]=3 20238 B13R1.3787 C=C(C)CNc1c(cccc1F)F 34a_100000210704_100000748629 [0,2,0,0,0,1|0,0,0]=3 20239 B13R1.3787 C=C(C)CNc1c(cccc1F)O 34a_100020591140_100000748629 [0,2,0,0,0,1|0,0,0]=3 20240 B13R1.3787 C=C(C)CNc1c(cccc1I)F 34a_100000042321_100000748629 [0,2,0,0,0,1|0,0,0]=3 20241 B13R1.3787 C=C(C)CNc1c(cccc1O)C 34a_100000743429_100000748629 [0,2,0,0,0,1|0,0,0]=3 20242 B13R1.3787 C=C(C)CNc1c(ccnc1F)C 27a_100000765925_100009818256 [0,2,0,0,0,1|1,0,0]=4 20243 B13R1.3787 C=C(C)CNc1c(ccnc1F)F 27a_100000765925_100009874084 [0,2,0,0,0,1|1,0,0]=4 20244 B13R1.3787 C=C(C)COc1c(cccc1Br)Br 34a_100000736428_100000748629 [0,2,0,0,0,1|0,0,0]=3 20245 B13R1.3787 C=C(C)COc1c(cccc1Br)Br 7a_100000736428_100000748629 [0,2,0,0,0,1|0,0,0]=3 20246 B13R1.3787 C=C(C)COc1c(cccc1Br)C 34a_100009817157_100000748629 [0,2,0,0,0,1|0,0,0]=3 20247 B13R1.3787 C=C(C)COc1c(cccc1Br)C 7a_100009817157_100000748629 [0,2,0,0,0,1|0,0,0]=3 20248 B13R1.3787 C=C(C)COc1c(cccc1Br)Cl 34a_100010214474_100000748629 [0,2,0,0,0,1|0,0,0]=3 20249 B13R1.3787 C=C(C)COc1c(cccc1Br)Cl 7a_100010214474_100000748629 [0,2,0,0,0,1|0,0,0]=3 20250 B13R1.3787 C=C(C)COc1c(cccc1Br)F 34a_100009813666_100000748629 [0,2,0,0,0,1|0,0,0]=3 20251 B13R1.3787 C=C(C)COc1c(cccc1Br)F 7a_100009813666_100000748629 [0,2,0,0,0,1|0,0,0]=3 20252 B13R1.3787 C=C(C)COc1c(cccc1Br)N 34a_100011934915_100000748629 [0,2,0,0,0,1|0,0,0]=3 20253 B13R1.3787 C=C(C)COc1c(cccc1C)C 34a_100000210341_100000748629 [0,2,0,0,0,1|0,0,0]=3 20254 B13R1.3787 C=C(C)COc1c(cccc1C)C 7a_100000210341_100000748629 [0,2,0,0,0,1|0,0,0]=3 20255 B13R1.3787 C=C(C)COc1c(cccc1Cl)C 34a_100000033731_100000748629 [0,2,0,0,0,1|0,0,0]=3 20256 B13R1.3787 C=C(C)COc1c(cccc1Cl)C 7a_100000033731_100000748629 [0,2,0,0,0,1|0,0,0]=3 20257 B13R1.3787 C=C(C)COc1c(cccc1Cl)Cl 34a_100000211709_100000748629 [0,2,0,0,0,1|0,0,0]=3 20258 B13R1.3787 C=C(C)COc1c(cccc1Cl)Cl 7a_100000211709_100000748629 [0,2,0,0,0,1|0,0,0]=3 20259 B13R1.3787 C=C(C)COc1c(cccc1Cl)F 34a_100000694953_100000748629 [0,2,0,0,0,1|0,0,0]=3 20260 B13R1.3787 C=C(C)COc1c(cccc1Cl)F 7a_100000694953_100000748629 [0,2,0,0,0,1|0,0,0]=3 20261 B13R1.3787 C=C(C)COc1c(cccc1Cl)N 34a_100000754742_100000748629 [0,2,0,0,0,1|0,0,0]=3 20262 B13R1.3787 C=C(C)COc1c(cccc1F)C 34a_100011659162_100000748629 [0,2,0,0,0,1|0,0,0]=3 20263 B13R1.3787 C=C(C)COc1c(cccc1F)C 7a_100011659162_100000748629 [0,2,0,0,0,1|0,0,0]=3 20264 B13R1.3787 C=C(C)COc1c(cccc1F)F 34a_100000230165_100000748629 [0,2,0,0,0,1|0,0,0]=3 20265 B13R1.3787 C=C(C)COc1c(cccc1F)F 7a_100000230165_100000748629 [0,2,0,0,0,1|0,0,0]=3 20266 B13R1.3787 C=C(C)COc1c(cccc1F)N 34a_100011934987_100000748629 [0,2,0,0,0,1|0,0,0]=3 20267 B13R1.3787 C=C(C)COc1c(cccc1I)Br 34a_100010084509_100000748629 [0,2,0,0,0,1|0,0,0]=3 20268 B13R1.3787 C=C(C)COc1c(cccc1I)Br 7a_100010084509_100000748629 [0,2,0,0,0,1|0,0,0]=3 20269 B13R1.3787 C=C(C)COc1c(cccc1I)Cl 34a_100010202889_100000748629 [0,2,0,0,0,1|0,0,0]=3 20270 B13R1.3787 C=C(C)COc1c(cccc1I)Cl 7a_100010202889_100000748629 [0,2,0,0,0,1|0,0,0]=3 20271 B13R1.3787 C=C(C)COc1c(cccc1I)F 34a_100010186298_100000748629 [0,2,0,0,0,1|0,0,0]=3 20272 B13R1.3787 C=C(C)COc1c(cccc1I)F 7a_100010186298_100000748629 [0,2,0,0,0,1|0,0,0]=3 20273 B13R1.3787 C=C(C)COc1c(cccc1I)N 34a_100010084371_100000748629 [0,2,0,0,0,1|0,0,0]=3 20274 B13R1.3787 C=C(C)COc1c(cccc1N)C 34a_100000756359_100000748629 [0,2,0,0,0,1|0,0,0]=3 20275 B13R1.3787 C=C(C)COc1c(cccc1N)C 7a_100000756359_100000748629 [0,2,0,0,0,1|0,0,0]=3 20276 B13R1.3787 C=C(C)COc1c(cccc1N)N 34a_200016994477_100000748629 [0,2,0,0,0,1|0,0,0]=3 20277 B13R1.3787 C=C(C)COc1c(ccnc1C)C 34a_100011934651_100000748629 [0,2,0,0,0,1|1,0,0]=4 20278 B13R1.3787 C=C(C)COc1c(ccnc1C)C 7a_100011934651_100000748629 [0,2,0,0,0,1|1,0,0]=4 20279 B13R1.3787 C=C(C)COc1c(ccnc1Cl)C 34a_100000696282_100000748629 [0,2,0,0,0,1|1,0,0]=4 20280 B13R1.3787 C=C(C)COc1c(ccnc1Cl)C 7a_100000696282_100000748629 [0,2,0,0,0,1|1,0,0]=4 20281 B13R1.3787 C=C(C)COc1c(ccnc1Cl)Cl 34a_100000118450_100000748629 [0,2,0,0,0,1|1,0,0]=4 20282 B13R1.3787 C=C(C)COc1c(ccnc1Cl)Cl 7a_100000118450_100000748629 [0,2,0,0,0,1|1,0,0]=4 20283 B13R1.3787 C=C(C)COc1c(ccnc1Cl)F 34a_100009867227_100000748629 [0,2,0,0,0,1|1,0,0]=4 20284 B13R1.3787 C=C(C)COc1c(ccnc1Cl)F 7a_100009867227_100000748629 [0,2,0,0,0,1|1,0,0]=4 20285 B13R1.3787 C=C(C)COc1c(ccnc1Cl)I 34a_100010067911_100000748629 [0,2,0,0,0,1|1,0,0]=4 20286 B13R1.3787 C=C(C)COc1c(ccnc1Cl)I 7a_100010067911_100000748629 [0,2,0,0,0,1|1,0,0]=4 20287 B13R1.3787 C=C(C)COc1c(ccnc1Cl)N 34a_100009844647_100000748629 [0,2,0,0,0,1|1,0,0]=4 20288 B13R1.3787 C=C(C)COc1c(ccnc1Cl)N 7a_100009844647_100000748629 [0,2,0,0,0,1|1,0,0]=4 20289 B13R1.3787 C=C(C)COc1c(occc1=O)C 34a_100000031901_100000748629 [0,2,0,0,0,1|1,0,0]=4 20290 B13R1.3787 C=C(C)CSc1c(ccc[n+]1[O-])C 62a_100000748629_100116209805 [0,2,0,0,0,1|1,0,0]=4 20291 B13R1.3787 C=C(C)CSc1c(cccc1Br)Br 62a_100000748629_100009994525 [0,2,0,0,0,1|0,0,0]=3 20292 B13R1.3787 C=C(C)CSc1c(cccc1Br)Br 62a_100009994525_100000211660 [0,2,0,0,0,1|0,0,0]=3 20293 B13R1.3787 C=C(C)CSc1c(cccc1Br)C 62a_100000748629_100010141302 [0,2,0,0,0,1|0,0,0]=3 20294 B13R1.3787 C=C(C)CSc1c(cccc1Br)C 62a_100010141302_100000211660 [0,2,0,0,0,1|0,0,0]=3 20295 B13R1.3787 C=C(C)CSc1c(cccc1Br)Cl 62a_100000748629_100010214488 [0,2,0,0,0,1|0,0,0]=3 20296 B13R1.3787 C=C(C)CSc1c(cccc1Br)Cl 62a_100010214488_100000211660 [0,2,0,0,0,1|0,0,0]=3 20297 B13R1.3787 C=C(C)CSc1c(cccc1Br)F 62a_100000748629_100011219512 [0,2,0,0,0,1|0,0,0]=3 20298 B13R1.3787 C=C(C)CSc1c(cccc1Br)F 62a_100011219512_100000211660 [0,2,0,0,0,1|0,0,0]=3 20299 B13R1.3787 C=C(C)CSc1c(cccc1Br)N 62a_100000748629_100020590159 [0,2,0,0,0,1|0,0,0]=3 20300 B13R1.3787 C=C(C)CSc1c(cccc1Br)N 62a_100020590159_100000211660 [0,2,0,0,0,1|0,0,0]=3 20301 B13R1.3787 C=C(C)CSc1c(cccc1Br)O 62a_100000748629_100010187912 [0,2,0,0,0,1|0,0,0]=3 20302 B13R1.3787 C=C(C)CSc1c(cccc1Br)O 62a_100010187912_100000211660 [0,2,0,0,0,1|0,0,0]=3 20303 B13R1.3787 C=C(C)CSc1c(cccc1C)C 62a_100000033847_100000211660 [0,2,0,0,0,1|0,0,0]=3 20304 B13R1.3787 C=C(C)CSc1c(cccc1C)C 62a_100000748629_100000033847 [0,2,0,0,0,1|0,0,0]=3 20305 B13R1.3787 C=C(C)CSc1c(cccc1Cl)C 62a_100000043165_100000211660 [0,2,0,0,0,1|0,0,0]=3 20306 B13R1.3787 C=C(C)CSc1c(cccc1Cl)C 62a_100000748629_100000043165 [0,2,0,0,0,1|0,0,0]=3 20307 B13R1.3787 C=C(C)CSc1c(cccc1Cl)Cl 62a_100000034237_100000211660 [0,2,0,0,0,1|0,0,0]=3 20308 B13R1.3787 C=C(C)CSc1c(cccc1Cl)Cl 62a_100000748629_100000034237 [0,2,0,0,0,1|0,0,0]=3 20309 B13R1.3787 C=C(C)CSc1c(cccc1Cl)F 62a_100000050007_100000211660 [0,2,0,0,0,1|0,0,0]=3 20310 B13R1.3787 C=C(C)CSc1c(cccc1Cl)F 62a_100000748629_100000050007 [0,2,0,0,0,1|0,0,0]=3 20311 B13R1.3787 C=C(C)CSc1c(cccc1Cl)N 62a_100000049713_100000211660 [0,2,0,0,0,1|0,0,0]=3 20312 B13R1.3787 C=C(C)CSc1c(cccc1Cl)N 62a_100000748629_100000049713 [0,2,0,0,0,1|0,0,0]=3 20313 B13R1.3787 C=C(C)CSc1c(cccc1Cl)O 62a_100000748629_100000050174 [0,2,0,0,0,1|0,0,0]=3 20314 B13R1.3787 C=C(C)CSc1c(cccc1F)C 62a_100000748629_100011218421 [0,2,0,0,0,1|0,0,0]=3 20315 B13R1.3787 C=C(C)CSc1c(cccc1F)C 62a_100011218421_100000211660 [0,2,0,0,0,1|0,0,0]=3 20316 B13R1.3787 C=C(C)CSc1c(cccc1F)F 62a_100000693133_100000211660 [0,2,0,0,0,1|0,0,0]=3 20317 B13R1.3787 C=C(C)CSc1c(cccc1F)F 62a_100000748629_100000693133 [0,2,0,0,0,1|0,0,0]=3 20318 B13R1.3787 C=C(C)CSc1c(cccc1F)N 62a_100000690935_100000211660 [0,2,0,0,0,1|0,0,0]=3 20319 B13R1.3787 C=C(C)CSc1c(cccc1F)N 62a_100000748629_100000690935 [0,2,0,0,0,1|0,0,0]=3 20320 B13R1.3787 C=C(C)CSc1c(cccc1F)O 62a_100000748629_100009820682 [0,2,0,0,0,1|0,0,0]=3 20321 B13R1.3787 C=C(C)CSc1c(cccc1F)O 62a_100009820682_100000211660 [0,2,0,0,0,1|0,0,0]=3 20322 B13R1.3787 C=C(C)CSc1c(cccc1N)C 62a_100000684715_100000211660 [0,2,0,0,0,1|0,0,0]=3 20323 B13R1.3787 C=C(C)CSc1c(cccc1N)C 62a_100000748629_100000684715 [0,2,0,0,0,1|0,0,0]=3 20324 B13R1.3787 C=C(C)CSc1c(cccc1O)C 62a_100000686692_100000211660 [0,2,0,0,0,1|0,0,0]=3 20325 B13R1.3787 C=C(C)CSc1c(cccc1O)C 62a_100000748629_100000686692 [0,2,0,0,0,1|0,0,0]=3 20326 B13R1.3787 C=C(C)CSc1c(cccc1O)N 62a_100000748629_100012183704 [0,2,0,0,0,1|0,0,0]=3 20327 B13R1.3787 C=C(C)CSc1c(cccc1O)N 62a_100012183704_100000211660 [0,2,0,0,0,1|0,0,0]=3 20328 B13R1.3787 C=C(C)CSc1c(cccc1O)O 62a_100000748629_100010205330 [0,2,0,0,0,1|0,0,0]=3 20329 B13R1.3787 C=C(C)CSc1c(ccnc1C)C 62a_100000748629_100012000501 [0,2,0,0,0,1|1,0,0]=4 20330 B13R1.3787 C=C(C)CSc1c(ccnc1C)C 62a_100012000501_100000211660 [0,2,0,0,0,1|1,0,0]=4 20331 B13R1.3787 C=C(C)CSc1c(ccnc1C)N 62a_100000748629_100010243816 [0,2,0,0,0,1|1,0,0]=4 20332 B13R1.3787 C=C(C)CSc1c(ccnc1C)N 62a_100010243816_100000211660 [0,2,0,0,0,1|1,0,0]=4 20333 B13R1.3787 C=C(C)CSc1c(ccnc1Cl)Br 62a_100000748629_100009814607 [0,2,0,0,0,1|1,0,0]=4 20334 B13R1.3787 C=C(C)CSc1c(ccnc1Cl)Br 62a_100009814607_100000211660 [0,2,0,0,0,1|1,0,0]=4 20335 B13R1.3787 C=C(C)CSc1c(ccnc1Cl)C 62a_100000748629_100010248874 [0,2,0,0,0,1|1,0,0]=4 20336 B13R1.3787 C=C(C)CSc1c(ccnc1Cl)C 62a_100010248874_100000211660 [0,2,0,0,0,1|1,0,0]=4 20337 B13R1.3787 C=C(C)CSc1c(ccnc1Cl)Cl 62a_100000050019_100000211660 [0,2,0,0,0,1|1,0,0]=4 20338 B13R1.3787 C=C(C)CSc1c(ccnc1Cl)Cl 62a_100000748629_100000050019 [0,2,0,0,0,1|1,0,0]=4 20339 B13R1.3787 C=C(C)CSc1c(ccnc1Cl)F 62a_100000716511_100000211660 [0,2,0,0,0,1|1,0,0]=4 20340 B13R1.3787 C=C(C)CSc1c(ccnc1Cl)F 62a_100000748629_100000716511 [0,2,0,0,0,1|1,0,0]=4 20341 B13R1.3787 C=C(C)CSc1c(ccnc1Cl)N 62a_100000748629_100010208016 [0,2,0,0,0,1|1,0,0]=4 20342 B13R1.3787 C=C(C)CSc1c(ccnc1Cl)N 62a_100010208016_100000211660 [0,2,0,0,0,1|1,0,0]=4 20343 B13R1.3787 C=C(C)CSc1c(ccnc1F)C 62a_100000748629_100009818256 [0,2,0,0,0,1|1,0,0]=4 20344 B13R1.3787 C=C(C)CSc1c(ccnc1F)C 62a_100009818256_100000211660 [0,2,0,0,0,1|1,0,0]=4 20345 B13R1.3787 C=C(C)CSc1c(ccnc1F)F 62a_100000748629_100009874084 [0,2,0,0,0,1|1,0,0]=4 20346 B13R1.3787 C=C(C)CSc1c(ccnc1F)F 62a_100009874084_100000211660 [0,2,0,0,0,1|1,0,0]=4 20347 B13R1.3787 C=C(C)CSc1c(ccnc1F)N 62a_100000748629_100010381272 [0,2,0,0,0,1|1,0,0]=4 20348 B13R1.3787 C=C(C)CSc1c(ccnc1F)N 62a_100010381272_100000211660 [0,2,0,0,0,1|1,0,0]=4 20349 B13R1.3787 C=C(C)CSc1c(ccnc1N)C 62a_100000748629_100011998619 [0,2,0,0,0,1|1,0,0]=4 20350 B13R1.3787 C=C(C)CSc1c(ccnc1N)C 62a_100011998619_100000211660 [0,2,0,0,0,1|1,0,0]=4 20351 B13R1.3787 C=C(C)CSc1c(ccnc1N)Cl 62a_100000748629_100010199028 [0,2,0,0,0,1|1,0,0]=4 20352 B13R1.3787 C=C(C)CSc1c(ccnc1N)Cl 62a_100010199028_100000211660 [0,2,0,0,0,1|1,0,0]=4 20353 B13R1.3787 C=C(C)CSc1c(ccnc1O)C 62a_100000748629_100012000493 [0,2,0,0,0,1|1,0,0]=4 20354 B13R1.3787 C=C(C)CSc1c(ccnc1O)C 62a_100012000493_100000211660 [0,2,0,0,0,1|1,0,0]=4 20355 B13R1.3787 C=C(C)CSc1c(ccnc1O)O 62a_100000748629_200009817435 [0,2,0,0,0,1|1,0,0]=4 20356 B13R1.3787 C=C(C)CSc1c(cncc1Br)Br 62a_100000748629_100010172828 [0,2,0,0,0,1|1,0,0]=4 20357 B13R1.3787 C=C(C)CSc1c(cncc1Br)Br 62a_100010172828_100000211660 [0,2,0,0,0,1|1,0,0]=4 20358 B13R1.3787 C=C(C)CSc1c(cncc1C)C 62a_100000748629_100009817138 [0,2,0,0,0,1|1,0,0]=4 20359 B13R1.3787 C=C(C)CSc1c(cncc1C)C 62a_100009817138_100000211660 [0,2,0,0,0,1|1,0,0]=4 20360 B13R1.3787 C=C(C)CSc1c(cncc1Cl)Cl 62a_100000036193_100000211660 [0,2,0,0,0,1|1,0,0]=4 20361 B13R1.3787 C=C(C)CSc1c(cncc1Cl)Cl 62a_100000748629_100000036193 [0,2,0,0,0,1|1,0,0]=4 20362 B13R1.3787 C=C(C)CSc1c(cncc1F)F 62a_100000748629_100000760538 [0,2,0,0,0,1|1,0,0]=4 20363 B13R1.3787 C=C(C)CSc1c(cncc1F)F 62a_100000760538_100000211660 [0,2,0,0,0,1|1,0,0]=4 20364 B13R1.3787 C=C(F)CNc1c(cccc1Br)Br 34a_100000690995_100009893438 [0,2,0,0,0,1|1,0,0]=4 20365 B13R1.3787 C=C(F)CNc1c(cccc1Br)C 34a_100011834072_100009893438 [0,2,0,0,0,1|1,0,0]=4 20366 B13R1.3787 C=C(F)CNc1c(cccc1Br)Cl 34a_100102946385_100009893438 [0,2,0,0,0,1|1,0,0]=4 20367 B13R1.3787 C=C(F)CNc1c(cccc1Br)F 34a_100000684712_100009893438 [0,2,0,0,0,1|1,0,0]=4 20368 B13R1.3787 C=C(F)CNc1c(cccc1Br)O 34a_100011934926_100009893438 [0,2,0,0,0,1|1,0,0]=4 20369 B13R1.3787 C=C(F)CNc1c(cccc1C)C 34a_100000185769_100009893438 [0,2,0,0,0,1|1,0,0]=4 20370 B13R1.3787 C=C(F)CNc1c(cccc1Cl)C 34a_100000756524_100009893438 [0,2,0,0,0,1|1,0,0]=4 20371 B13R1.3787 C=C(F)CNc1c(cccc1Cl)Cl 34a_100000210028_100009893438 [0,2,0,0,0,1|1,0,0]=4 20372 B13R1.3787 C=C(F)CNc1c(cccc1Cl)F 34a_100000760031_100009893438 [0,2,0,0,0,1|1,0,0]=4 20373 B13R1.3787 C=C(F)CNc1c(cccc1Cl)O 34a_100012022510_100009893438 [0,2,0,0,0,1|1,0,0]=4 20374 B13R1.3787 C=C(F)CNc1c(cccc1F)C 34a_100000766463_100009893438 [0,2,0,0,0,1|1,0,0]=4 20375 B13R1.3787 C=C(F)CNc1c(cccc1F)F 2230a_100000210704_100009893438 [0,2,0,0,0,1|1,0,0]=4 20376 B13R1.3787 C=C(F)CNc1c(cccc1F)F 34a_100000210704_100009893438 [0,2,0,0,0,1|1,0,0]=4 20377 B13R1.3787 C=C(F)CNc1c(cccc1F)O 34a_100020591140_100009893438 [0,2,0,0,0,1|1,0,0]=4 20378 B13R1.3787 C=C(F)CNc1c(cccc1I)F 34a_100000042321_100009893438 [0,2,0,0,0,1|1,0,0]=4 20379 B13R1.3787 C=C(F)CNc1c(cccc1O)C 34a_100000743429_100009893438 [0,2,0,0,0,1|1,0,0]=4 20380 B13R1.3787 C=C(F)COc1c(cccc1Br)Br 34a_100000736428_100009893438 [0,2,0,0,0,1|1,0,0]=4 20381 B13R1.3787 C=C(F)COc1c(cccc1Br)Br 7a_100000736428_100000042424 [0,2,0,0,0,1|1,0,0]=4 20382 B13R1.3787 C=C(F)COc1c(cccc1Br)C 34a_100009817157_100009893438 [0,2,0,0,0,1|1,0,0]=4 20383 B13R1.3787 C=C(F)COc1c(cccc1Br)C 7a_100009817157_100000042424 [0,2,0,0,0,1|1,0,0]=4 20384 B13R1.3787 C=C(F)COc1c(cccc1Br)Cl 34a_100010214474_100009893438 [0,2,0,0,0,1|1,0,0]=4 20385 B13R1.3787 C=C(F)COc1c(cccc1Br)Cl 7a_100010214474_100000042424 [0,2,0,0,0,1|1,0,0]=4 20386 B13R1.3787 C=C(F)COc1c(cccc1Br)F 34a_100009813666_100009893438 [0,2,0,0,0,1|1,0,0]=4 20387 B13R1.3787 C=C(F)COc1c(cccc1Br)F 7a_100009813666_100000042424 [0,2,0,0,0,1|1,0,0]=4 20388 B13R1.3787 C=C(F)COc1c(cccc1Br)N 34a_100011934915_100009893438 [0,2,0,0,0,1|1,0,0]=4 20389 B13R1.3787 C=C(F)COc1c(cccc1C)C 34a_100000210341_100009893438 [0,2,0,0,0,1|1,0,0]=4 20390 B13R1.3787 C=C(F)COc1c(cccc1C)C 7a_100000210341_100000042424 [0,2,0,0,0,1|1,0,0]=4 20391 B13R1.3787 C=C(F)COc1c(cccc1Cl)C 34a_100000033731_100009893438 [0,2,0,0,0,1|1,0,0]=4 20392 B13R1.3787 C=C(F)COc1c(cccc1Cl)C 7a_100000033731_100000042424 [0,2,0,0,0,1|1,0,0]=4 20393 B13R1.3787 C=C(F)COc1c(cccc1Cl)Cl 34a_100000211709_100009893438 [0,2,0,0,0,1|1,0,0]=4 20394 B13R1.3787 C=C(F)COc1c(cccc1Cl)Cl 7a_100000211709_100000042424 [0,2,0,0,0,1|1,0,0]=4 20395 B13R1.3787 C=C(F)COc1c(cccc1Cl)F 34a_100000694953_100009893438 [0,2,0,0,0,1|1,0,0]=4 20396 B13R1.3787 C=C(F)COc1c(cccc1Cl)F 7a_100000694953_100000042424 [0,2,0,0,0,1|1,0,0]=4 20397 B13R1.3787 C=C(F)COc1c(cccc1Cl)N 34a_100000754742_100009893438 [0,2,0,0,0,1|1,0,0]=4 20398 B13R1.3787 C=C(F)COc1c(cccc1F)C 34a_100011659162_100009893438 [0,2,0,0,0,1|1,0,0]=4 20399 B13R1.3787 C=C(F)COc1c(cccc1F)C 7a_100011659162_100000042424 [0,2,0,0,0,1|1,0,0]=4 20400 B13R1.3787 C=C(F)COc1c(cccc1F)F 34a_100000230165_100009893438 [0,2,0,0,0,1|1,0,0]=4 20401 B13R1.3787 C=C(F)COc1c(cccc1F)F 7a_100000230165_100000042424 [0,2,0,0,0,1|1,0,0]=4 20402 B13R1.3787 C=C(F)COc1c(cccc1F)N 34a_100011934987_100009893438 [0,2,0,0,0,1|1,0,0]=4 20403 B13R1.3787 C=C(F)COc1c(cccc1I)Br 34a_100010084509_100009893438 [0,2,0,0,0,1|1,0,0]=4 20404 B13R1.3787 C=C(F)COc1c(cccc1I)Br 7a_100010084509_100000042424 [0,2,0,0,0,1|1,0,0]=4 20405 B13R1.3787 C=C(F)COc1c(cccc1I)Cl 34a_100010202889_100009893438 [0,2,0,0,0,1|1,0,0]=4 20406 B13R1.3787 C=C(F)COc1c(cccc1I)Cl 7a_100010202889_100000042424 [0,2,0,0,0,1|1,0,0]=4 20407 B13R1.3787 C=C(F)COc1c(cccc1I)F 34a_100010186298_100009893438 [0,2,0,0,0,1|1,0,0]=4 20408 B13R1.3787 C=C(F)COc1c(cccc1I)F 7a_100010186298_100000042424 [0,2,0,0,0,1|1,0,0]=4 20409 B13R1.3787 C=C(F)COc1c(cccc1I)N 34a_100010084371_100009893438 [0,2,0,0,0,1|1,0,0]=4 20410 B13R1.3787 C=C(F)COc1c(cccc1N)C 34a_100000756359_100009893438 [0,2,0,0,0,1|1,0,0]=4 20411 B13R1.3787 C=C(F)COc1c(cccc1N)C 7a_100000756359_100000042424 [0,2,0,0,0,1|1,0,0]=4 20412 B13R1.3787 C=C(F)COc1c(cccc1N)N 34a_200016994477_100009893438 [0,2,0,0,0,1|1,0,0]=4 20413 B13R1.3787 C=C(F)CSc1c(cccc1Br)Br 62a_100000042424_100009994525 [0,2,0,0,0,1|1,0,0]=4 20414 B13R1.3787 C=C(F)CSc1c(cccc1Br)Br 62a_100009994525_100000042424 [0,2,0,0,0,1|1,0,0]=4 20415 B13R1.3787 C=C(F)CSc1c(cccc1Br)C 62a_100000042424_100010141302 [0,2,0,0,0,1|1,0,0]=4 20416 B13R1.3787 C=C(F)CSc1c(cccc1Br)C 62a_100010141302_100000042424 [0,2,0,0,0,1|1,0,0]=4 20417 B13R1.3787 C=C(F)CSc1c(cccc1Br)Cl 62a_100000042424_100010214488 [0,2,0,0,0,1|1,0,0]=4 20418 B13R1.3787 C=C(F)CSc1c(cccc1Br)Cl 62a_100010214488_100000042424 [0,2,0,0,0,1|1,0,0]=4 20419 B13R1.3787 C=C(F)CSc1c(cccc1Br)F 62a_100000042424_100011219512 [0,2,0,0,0,1|1,0,0]=4 20420 B13R1.3787 C=C(F)CSc1c(cccc1Br)F 62a_100011219512_100000042424 [0,2,0,0,0,1|1,0,0]=4 20421 B13R1.3787 C=C(F)CSc1c(cccc1Br)N 62a_100000042424_100020590159 [0,2,0,0,0,1|1,0,0]=4 20422 B13R1.3787 C=C(F)CSc1c(cccc1Br)N 62a_100020590159_100000042424 [0,2,0,0,0,1|1,0,0]=4 20423 B13R1.3787 C=C(F)CSc1c(cccc1Br)O 62a_100000042424_100010187912 [0,2,0,0,0,1|1,0,0]=4 20424 B13R1.3787 C=C(F)CSc1c(cccc1Br)O 62a_100010187912_100000042424 [0,2,0,0,0,1|1,0,0]=4 20425 B13R1.3787 C=C(F)CSc1c(cccc1C)C 62a_100000033847_100000042424 [0,2,0,0,0,1|1,0,0]=4 20426 B13R1.3787 C=C(F)CSc1c(cccc1C)C 62a_100000042424_100000033847 [0,2,0,0,0,1|1,0,0]=4 20427 B13R1.3787 C=C(F)CSc1c(cccc1Cl)C 62a_100000042424_100000043165 [0,2,0,0,0,1|1,0,0]=4 20428 B13R1.3787 C=C(F)CSc1c(cccc1Cl)C 62a_100000043165_100000042424 [0,2,0,0,0,1|1,0,0]=4 20429 B13R1.3787 C=C(F)CSc1c(cccc1Cl)Cl 62a_100000034237_100000042424 [0,2,0,0,0,1|1,0,0]=4 20430 B13R1.3787 C=C(F)CSc1c(cccc1Cl)Cl 62a_100000042424_100000034237 [0,2,0,0,0,1|1,0,0]=4 20431 B13R1.3787 C=C(F)CSc1c(cccc1Cl)F 62a_100000042424_100000050007 [0,2,0,0,0,1|1,0,0]=4 20432 B13R1.3787 C=C(F)CSc1c(cccc1Cl)F 62a_100000050007_100000042424 [0,2,0,0,0,1|1,0,0]=4 20433 B13R1.3787 C=C(F)CSc1c(cccc1Cl)N 62a_100000042424_100000049713 [0,2,0,0,0,1|1,0,0]=4 20434 B13R1.3787 C=C(F)CSc1c(cccc1Cl)N 62a_100000049713_100000042424 [0,2,0,0,0,1|1,0,0]=4 20435 B13R1.3787 C=C(F)CSc1c(cccc1Cl)O 62a_100000042424_100000050174 [0,2,0,0,0,1|1,0,0]=4 20436 B13R1.3787 C=C(F)CSc1c(cccc1F)C 62a_100000042424_100011218421 [0,2,0,0,0,1|1,0,0]=4 20437 B13R1.3787 C=C(F)CSc1c(cccc1F)C 62a_100011218421_100000042424 [0,2,0,0,0,1|1,0,0]=4 20438 B13R1.3787 C=C(F)CSc1c(cccc1F)F 62a_100000042424_100000693133 [0,2,0,0,0,1|1,0,0]=4 20439 B13R1.3787 C=C(F)CSc1c(cccc1F)F 62a_100000693133_100000042424 [0,2,0,0,0,1|1,0,0]=4 20440 B13R1.3787 C=C(F)CSc1c(cccc1F)N 62a_100000042424_100000690935 [0,2,0,0,0,1|1,0,0]=4 20441 B13R1.3787 C=C(F)CSc1c(cccc1F)N 62a_100000690935_100000042424 [0,2,0,0,0,1|1,0,0]=4 20442 B13R1.3787 C=C(F)CSc1c(cccc1F)O 62a_100000042424_100009820682 [0,2,0,0,0,1|1,0,0]=4 20443 B13R1.3787 C=C(F)CSc1c(cccc1F)O 62a_100009820682_100000042424 [0,2,0,0,0,1|1,0,0]=4 20444 B13R1.3787 C=C(F)CSc1c(cccc1N)C 62a_100000042424_100000684715 [0,2,0,0,0,1|1,0,0]=4 20445 B13R1.3787 C=C(F)CSc1c(cccc1N)C 62a_100000684715_100000042424 [0,2,0,0,0,1|1,0,0]=4 20446 B13R1.3787 C=C(F)CSc1c(cccc1O)C 62a_100000042424_100000686692 [0,2,0,0,0,1|1,0,0]=4 20447 B13R1.3787 C=C(F)CSc1c(cccc1O)C 62a_100000686692_100000042424 [0,2,0,0,0,1|1,0,0]=4 20448 B13R1.3787 C=C(F)CSc1c(cccc1O)N 62a_100000042424_100012183704 [0,2,0,0,0,1|1,0,0]=4 20449 B13R1.3787 C=C(F)CSc1c(cccc1O)N 62a_100012183704_100000042424 [0,2,0,0,0,1|1,0,0]=4 20450 B13R1.3787 C=C(F)CSc1c(cccc1O)O 62a_100000042424_100010205330 [0,2,0,0,0,1|1,0,0]=4 20451 B13R1.3787 CC(=O)CCc1c(cccc1C)C 1458a_200011998103_200000210301 [0,2,0,0,0,1|1,0,0]=4 20452 B13R1.3787 CC(=O)CCc1c(cccc1Cl)Cl 1458a_100000070787_100012161200 [0,2,0,0,0,1|1,0,0]=4 20453 B13R1.3787 CC(=O)CCc1c(cccc1Cl)Cl 1458a_100011225048_200000210301 [0,2,0,0,0,1|1,0,0]=4 20454 B13R1.3787 CC(=O)CCc1c(cccc1Cl)F 1458a_100011225049_200000210301 [0,2,0,0,0,1|1,0,0]=4 20455 B13R1.3787 CC(=O)CCc1c(cccc1F)F 1458a_100000738981_200000210301 [0,2,0,0,0,1|1,0,0]=4 20456 B13R1.3787 CC(=O)COc1c(cccc1C)C 1458a_100000184085_200000210301 [0,2,0,0,0,1|1,0,0]=4 20457 B13R1.3787 CC(=O)COc1c(cccc1Cl)Cl 1458a_100000184137_200000210301 [0,2,0,0,0,1|1,0,0]=4 20458 B13R1.3787 CC(=O)CSc1c(cccc1Cl)Cl 1458a_100000184567_200000210301 [0,2,0,0,0,1|1,0,0]=4 20459 B13R1.3787 CC(=O)NCc1c(cccc1Br)F 11a_100012349121_100015343762 [0,2,0,0,0,1|1,0,0]=4 20460 B13R1.3787 CC(=O)NCc1c(cccc1Br)F 1626a_100012349121_100015343762 [0,2,0,0,0,1|1,0,0]=4 20461 B13R1.3787 CC(=O)NCc1c(cccc1Br)F 240690a_100012349121_100015343762 [0,2,0,0,0,1|1,0,0]=4 20462 B13R1.3787 CC(=O)NCc1c(cccc1Br)F 527a_100012349121_100103153847 [0,2,0,0,0,1|1,0,0]=4 20463 B13R1.3787 CC(=O)NCc1c(cccc1C)C 11a_100000689800_100015343762 [0,2,0,0,0,1|1,0,0]=4 20464 B13R1.3787 CC(=O)NCc1c(cccc1C)C 1626a_100000689800_100015343762 [0,2,0,0,0,1|1,0,0]=4 20465 B13R1.3787 CC(=O)NCc1c(cccc1C)C 240690a_100000689800_100015343762 [0,2,0,0,0,1|1,0,0]=4 20466 B13R1.3787 CC(=O)NCc1c(cccc1C)C 527a_100000689800_100103153847 [0,2,0,0,0,1|1,0,0]=4 20467 B13R1.3787 CC(=O)NCc1c(cccc1Cl)Cl 11a_100000174884_100015343762 [0,2,0,0,0,1|1,0,0]=4 20468 B13R1.3787 CC(=O)NCc1c(cccc1Cl)Cl 1626a_100000174884_100015343762 [0,2,0,0,0,1|1,0,0]=4 20469 B13R1.3787 CC(=O)NCc1c(cccc1Cl)Cl 240690a_100000174884_100015343762 [0,2,0,0,0,1|1,0,0]=4 20470 B13R1.3787 CC(=O)NCc1c(cccc1Cl)Cl 527a_100000174884_100103153847 [0,2,0,0,0,1|1,0,0]=4 20471 B13R1.3787 CC(=O)NCc1c(cccc1Cl)F 11a_100000174883_100015343762 [0,2,0,0,0,1|1,0,0]=4 20472 B13R1.3787 CC(=O)NCc1c(cccc1Cl)F 1626a_100000174883_100015343762 [0,2,0,0,0,1|1,0,0]=4 20473 B13R1.3787 CC(=O)NCc1c(cccc1Cl)F 240690a_100000174883_100015343762 [0,2,0,0,0,1|1,0,0]=4 20474 B13R1.3787 CC(=O)NCc1c(cccc1Cl)F 527a_100000174883_100103153847 [0,2,0,0,0,1|1,0,0]=4 20475 B13R1.3787 CC(=O)NCc1c(cccc1F)C 11a_100000762012_100015343762 [0,2,0,0,0,1|1,0,0]=4 20476 B13R1.3787 CC(=O)NCc1c(cccc1F)C 1626a_100000762012_100015343762 [0,2,0,0,0,1|1,0,0]=4 20477 B13R1.3787 CC(=O)NCc1c(cccc1F)C 240690a_100000762012_100015343762 [0,2,0,0,0,1|1,0,0]=4 20478 B13R1.3787 CC(=O)NCc1c(cccc1F)C 527a_100000762012_100103153847 [0,2,0,0,0,1|1,0,0]=4 20479 B13R1.3787 CC(=O)NCc1c(cccc1F)F 11a_100000688400_100015343762 [0,2,0,0,0,1|1,0,0]=4 20480 B13R1.3787 CC(=O)NCc1c(cccc1F)F 1626a_100000688400_100015343762 [0,2,0,0,0,1|1,0,0]=4 20481 B13R1.3787 CC(=O)NCc1c(cccc1F)F 240690a_100000688400_100015343762 [0,2,0,0,0,1|1,0,0]=4 20482 B13R1.3787 CC(=O)NCc1c(cccc1F)F 527a_100000688400_100103153847 [0,2,0,0,0,1|1,0,0]=4 20483 B13R1.3787 Cc1cccc(c1CCC(=O)[13CH3])C 1458a_200011998103_200025704644 [0,2,0,0,0,1|1,0,0]=4 20484 B13R1.3787 Cc1cccc(c1OCC(=O)[13CH3])C 1458a_100000184085_200025704644 [0,2,0,0,0,1|1,0,0]=4 20485 B13R1.3787 [13CH3]C(=O)CCc1c(cccc1Cl)Cl 1458a_100011225048_200025704644 [0,2,0,0,0,1|1,0,0]=4 20486 B13R1.3787 [13CH3]C(=O)CCc1c(cccc1Cl)F 1458a_100011225049_200025704644 [0,2,0,0,0,1|1,0,0]=4 20487 B13R1.3787 [13CH3]C(=O)CCc1c(cccc1F)F 1458a_100000738981_200025704644 [0,2,0,0,0,1|1,0,0]=4 20488 B13R1.3787 [13CH3]C(=O)COc1c(cccc1Cl)Cl 1458a_100000184137_200025704644 [0,2,0,0,0,1|1,0,0]=4 20489 B13R1.3787 [13CH3]C(=O)CSc1c(cccc1Cl)Cl 1458a_100000184567_200025704644 [0,2,0,0,0,1|1,0,0]=4 20490 B13R1.643 C#Cc1cccc(c1)NCC(=C)C 2230a_100000735509_100000748629 [0,2,0,0,0,1|0,0,0]=3 20491 B13R1.643 C#Cc1cccc(c1)NCC(=C)C 34a_100000735509_100000748629 [0,2,0,0,0,1|0,0,0]=3 20492 B13R1.643 C#Cc1cccc(c1)NCC(=C)F 2230a_100000735509_100009893438 [0,2,0,0,0,1|1,0,0]=4 20493 B13R1.643 C#Cc1cccc(c1)NCC(=C)F 34a_100000735509_100009893438 [0,2,0,0,0,1|1,0,0]=4 20494 B13R1.643 C#Cc1cccc(c1)OCC(=C)C 34a_100011216014_100000748629 [0,2,0,0,0,1|0,0,0]=3 20495 B13R1.643 C#Cc1cccc(c1)OCC(=C)C 7a_100011216014_100000748629 [0,2,0,0,0,1|0,0,0]=3 20496 B13R1.643 C#Cc1cccc(c1)OCC(=C)F 34a_100011216014_100009893438 [0,2,0,0,0,1|1,0,0]=4 20497 B13R1.643 C#Cc1cccc(c1)OCC(=C)F 7a_100011216014_100000042424 [0,2,0,0,0,1|1,0,0]=4 20498 B13R1.643 C=C(C)CNc1cc(ccn1)C#N 27a_100000765925_100011291639 [0,2,0,0,0,1|1,0,0]=4 20499 B13R1.643 C=C(C)CNc1cc(ccn1)CC 27a_100000765925_100009817561 [0,2,0,0,0,1|1,0,0]=4 20500 B13R1.643 C=C(C)CNc1cccc(c1)C#N 34a_100000210922_100000748629 [0,2,0,0,0,1|0,0,0]=3 20501 B13R1.643 C=C(C)CNc1cccc(c1)C#N 7a_100000210922_100000748629 [0,2,0,0,0,1|0,0,0]=3 20502 B13R1.643 C=C(C)CNc1cccc(c1)CC 2230a_100000211250_100000748629 [0,2,0,0,0,1|0,0,0]=3 20503 B13R1.643 C=C(C)CNc1cccc(c1)CC 34a_100000211250_100000748629 [0,2,0,0,0,1|0,0,0]=3 20504 B13R1.643 C=C(C)CNc1cccc(c1)CC 7a_100000211250_100000748629 [0,2,0,0,0,1|0,0,0]=3 20505 B13R1.643 C=C(C)CNc1cccc(c1)CF 2230a_100000126320_100000748629 [0,2,0,0,0,1|0,0,0]=3 20506 B13R1.643 C=C(C)CNc1cccc(c1)CF 34a_100000126320_100000748629 [0,2,0,0,0,1|0,0,0]=3 20507 B13R1.643 C=C(C)CNc1cccc(c1)CF 7a_100000126320_100000748629 [0,2,0,0,0,1|0,0,0]=3 20508 B13R1.643 C=C(C)CNc1cccc(c1)CO 2230a_100000211919_100000748629 [0,2,0,0,0,1|0,0,0]=3 20509 B13R1.643 C=C(C)CNc1cccc(c1)CO 34a_100000211919_100000748629 [0,2,0,0,0,1|0,0,0]=3 20510 B13R1.643 C=C(C)CNc1cccc(c1)OC 34a_100000210024_100000748629 [0,2,0,0,0,1|0,0,0]=3 20511 B13R1.643 C=C(C)CNc1cccc(c1)SC 2230a_100000210049_100000748629 [0,2,0,0,0,1|0,0,0]=3 20512 B13R1.643 C=C(C)CNc1cccc(c1)SC 34a_100000210049_100000748629 [0,2,0,0,0,1|0,0,0]=3 20513 B13R1.643 C=C(C)CNc1cccc(n1)C#N 27a_100000765925_100011934037 [0,2,0,0,0,1|1,0,0]=4 20514 B13R1.643 C=C(C)CNc1ccnc(c1)C#N 27a_100000765925_100000685610 [0,2,0,0,0,1|1,0,0]=4 20515 B13R1.643 C=C(C)CNc1ccnc(c1)CC 27a_100000765925_100009820011 [0,2,0,0,0,1|1,0,0]=4 20516 B13R1.643 C=C(C)CNc1ccnc(c1)CO 27a_100000765925_100000748867 [0,2,0,0,0,1|1,0,0]=4 20517 B13R1.643 C=C(C)COc1cc(ccn1)CN 34a_100000748557_100000748629 [0,2,0,0,0,1|1,0,0]=4 20518 B13R1.643 C=C(C)COc1ccc[n+](c1)CC 34a_100000731997_100000748629 [0,2,0,0,0,1|1,0,0]=4 20519 B13R1.643 C=C(C)COc1ccc[n+](c1)CC 7a_100000731997_100000748629 [0,2,0,0,0,1|1,0,0]=4 20520 B13R1.643 C=C(C)COc1cccc(c1)C#N 34a_100000184713_100000748629 [0,2,0,0,0,1|0,0,0]=3 20521 B13R1.643 C=C(C)COc1cccc(c1)C#N 7a_100000184713_100000748629 [0,2,0,0,0,1|0,0,0]=3 20522 B13R1.643 C=C(C)COc1cccc(c1)CBr 34a_100011660834_100000748629 [0,2,0,0,0,1|0,0,0]=3 20523 B13R1.643 C=C(C)COc1cccc(c1)CBr 7a_100011660834_100000748629 [0,2,0,0,0,1|0,0,0]=3 20524 B13R1.643 C=C(C)COc1cccc(c1)CC 34a_100000211550_100000748629 [0,2,0,0,0,1|0,0,0]=3 20525 B13R1.643 C=C(C)COc1cccc(c1)CC 7a_100000211550_100000748629 [0,2,0,0,0,1|0,0,0]=3 20526 B13R1.643 C=C(C)COc1cccc(c1)CCl 34a_100000084143_100000748629 [0,2,0,0,0,1|0,0,0]=3 20527 B13R1.643 C=C(C)COc1cccc(c1)CCl 7a_100000084143_100000748629 [0,2,0,0,0,1|0,0,0]=3 20528 B13R1.643 C=C(C)COc1cccc(c1)CN 34a_100000743036_100000748629 [0,2,0,0,0,1|0,0,0]=3 20529 B13R1.643 C=C(C)COc1cccc(c1)CO 34a_100011214949_100000748629 [0,2,0,0,0,1|0,0,0]=3 20530 B13R1.643 C=C(C)COc1cccc(c1)CO 7a_100011214949_100000748629 [0,2,0,0,0,1|0,0,0]=3 20531 B13R1.643 C=C(C)COc1cccc(c1)NC 2230a_100000243820_200000210301 [0,2,0,0,0,1|0,0,0]=3 20532 B13R1.643 C=C(C)COc1cccc(c1)NC 34a_100000243820_200000210301 [0,2,0,0,0,1|0,0,0]=3 20533 B13R1.643 C=C(C)COc1cccc(c1)NC 34a_100000756613_100000748629 [0,2,0,0,0,1|0,0,0]=3 20534 B13R1.643 C=C(C)COc1cccc(c1)NC 7a_100000243820_200000210301 [0,2,0,0,0,1|0,0,0]=3 20535 B13R1.643 C=C(C)COc1cccc(c1)NC 7a_100000756613_100000748629 [0,2,0,0,0,1|0,0,0]=3 20536 B13R1.643 C=C(C)COc1cccc(c1)N[13CH3] 2230a_100000243820_200025704644 [0,2,0,0,0,1|0,0,0]=3 20537 B13R1.643 C=C(C)COc1cccc(c1)N[13CH3] 34a_100000243820_200025704644 [0,2,0,0,0,1|0,0,0]=3 20538 B13R1.643 C=C(C)COc1cccc(c1)N[13CH3] 7a_100000243820_200025704644 [0,2,0,0,0,1|0,0,0]=3 20539 B13R1.643 C=C(C)COc1cccc(c1)OC 34a_100000211255_100000748629 [0,2,0,0,0,1|0,0,0]=3 20540 B13R1.643 C=C(C)COc1cccc(c1)OC 7a_100000211255_100000748629 [0,2,0,0,0,1|0,0,0]=3 20541 B13R1.643 C=C(C)COc1cccc(c1)SC 34a_100011265683_100000748629 [0,2,0,0,0,1|0,0,0]=3 20542 B13R1.643 C=C(C)COc1cccc(c1)SC 7a_100011265683_100000748629 [0,2,0,0,0,1|0,0,0]=3 20543 B13R1.643 C=C(C)COc1ccnc(c1)C#N 34a_100011777083_100000748629 [0,2,0,0,0,1|1,0,0]=4 20544 B13R1.643 C=C(C)COc1ccnc(c1)C#N 7a_100011777083_100000748629 [0,2,0,0,0,1|1,0,0]=4 20545 B13R1.643 C=C(C)COc1ccnc(c1)OC 34a_100012181050_100000748629 [0,2,0,0,0,1|1,0,0]=4 20546 B13R1.643 C=C(C)COc1cncc(c1)C#N 34a_100012002025_100000748629 [0,2,0,0,0,1|1,0,0]=4 20547 B13R1.643 C=C(C)COc1cncc(c1)C#N 7a_100012002025_100000748629 [0,2,0,0,0,1|1,0,0]=4 20548 B13R1.643 C=C(C)COc1cncc(c1)CC 34a_200009861530_100000748629 [0,2,0,0,0,1|1,0,0]=4 20549 B13R1.643 C=C(C)COc1cncc(c1)CC 7a_200009861530_100000748629 [0,2,0,0,0,1|1,0,0]=4 20550 B13R1.643 C=C(C)COc1cncc(c1)OC 34a_100000084572_100000748629 [0,2,0,0,0,1|1,0,0]=4 20551 B13R1.643 C=C(C)COc1cncc(c1)OC 7a_100000084572_100000748629 [0,2,0,0,0,1|1,0,0]=4 20552 B13R1.643 C=C(C)CSc1cc(ccn1)C#N 62a_100000748629_100011291639 [0,2,0,0,0,1|1,0,0]=4 20553 B13R1.643 C=C(C)CSc1cc(ccn1)C=O 62a_100000748629_100011290808 [0,2,0,0,0,1|1,0,0]=4 20554 B13R1.643 C=C(C)CSc1cc(ccn1)C=O 62a_100011290808_100000211660 [0,2,0,0,0,1|1,0,0]=4 20555 B13R1.643 C=C(C)CSc1cc(ccn1)CC 62a_100000748629_100009817561 [0,2,0,0,0,1|1,0,0]=4 20556 B13R1.643 C=C(C)CSc1cc(ccn1)CC 62a_100009817561_100000211660 [0,2,0,0,0,1|1,0,0]=4 20557 B13R1.643 C=C(C)CSc1cc(ccn1)CN 62a_100000748629_100025757509 [0,2,0,0,0,1|1,0,0]=4 20558 B13R1.643 C=C(C)CSc1cc(ccn1)CN 62a_100025757509_100000211660 [0,2,0,0,0,1|1,0,0]=4 20559 B13R1.643 C=C(C)CSc1cc(ccn1)CO 62a_100000748629_100009814636 [0,2,0,0,0,1|1,0,0]=4 20560 B13R1.643 C=C(C)CSc1cc(ccn1)CO 62a_100009814636_100000211660 [0,2,0,0,0,1|1,0,0]=4 20561 B13R1.643 C=C(C)CSc1cc(ccn1)NC 62a_100000748629_100009869472 [0,2,0,0,0,1|1,0,0]=4 20562 B13R1.643 C=C(C)CSc1cc(ccn1)NC 62a_100009869472_100000211660 [0,2,0,0,0,1|1,0,0]=4 20563 B13R1.643 C=C(C)CSc1cc(ccn1)NN 62a_100000089018_100000211660 [0,2,0,0,0,1|1,0,0]=4 20564 B13R1.643 C=C(C)CSc1cc(ccn1)NN 62a_100000748629_100000089018 [0,2,0,0,0,1|1,0,0]=4 20565 B13R1.643 C=C(C)CSc1cc(ccn1)OC 62a_100000748629_100011216251 [0,2,0,0,0,1|1,0,0]=4 20566 B13R1.643 C=C(C)CSc1cc(ccn1)OC 62a_100009817693_100000211660 [0,2,0,0,0,1|1,0,0]=4 20567 B13R1.643 C=C(C)CSc1cc(ccn1)SC 62a_100000748629_100010883326 [0,2,0,0,0,1|1,0,0]=4 20568 B13R1.643 C=C(C)CSc1cc(ccn1)SC 62a_100010883326_100000211660 [0,2,0,0,0,1|1,0,0]=4 20569 B13R1.643 C=C(C)CSc1cccc(c1)C#N 62a_100000748629_100000189340 [0,2,0,0,0,1|0,0,0]=3 20570 B13R1.643 C=C(C)CSc1cccc(c1)C=O 62a_100000014684_100000211660 [0,2,0,0,0,1|0,0,0]=3 20571 B13R1.643 C=C(C)CSc1cccc(c1)C=O 62a_100000748629_100000014684 [0,2,0,0,0,1|0,0,0]=3 20572 B13R1.643 C=C(C)CSc1cccc(c1)CC 62a_100000748629_100011263222 [0,2,0,0,0,1|0,0,0]=3 20573 B13R1.643 C=C(C)CSc1cccc(c1)CC 62a_100011263222_100000211660 [0,2,0,0,0,1|0,0,0]=3 20574 B13R1.643 C=C(C)CSc1cccc(c1)CF 62a_100000748629_100010878472 [0,2,0,0,0,1|0,0,0]=3 20575 B13R1.643 C=C(C)CSc1cccc(c1)CF 62a_100010878472_100000211660 [0,2,0,0,0,1|0,0,0]=3 20576 B13R1.643 C=C(C)CSc1cccc(c1)CN 62a_100000106179_100000211660 [0,2,0,0,0,1|0,0,0]=3 20577 B13R1.643 C=C(C)CSc1cccc(c1)CN 62a_100000748629_100000106179 [0,2,0,0,0,1|0,0,0]=3 20578 B13R1.643 C=C(C)CSc1cccc(c1)CO 62a_100000687537_100000211660 [0,2,0,0,0,1|0,0,0]=3 20579 B13R1.643 C=C(C)CSc1cccc(c1)CO 62a_100000748629_100000687537 [0,2,0,0,0,1|0,0,0]=3 20580 B13R1.643 C=C(C)CSc1cccc(c1)NC 62a_100000219648_100000211660 [0,2,0,0,0,1|0,0,0]=3 20581 B13R1.643 C=C(C)CSc1cccc(c1)NC 62a_100000748629_100000219648 [0,2,0,0,0,1|0,0,0]=3 20582 B13R1.643 C=C(C)CSc1cccc(c1)NN 62a_100000217339_100000211660 [0,2,0,0,0,1|0,0,0]=3 20583 B13R1.643 C=C(C)CSc1cccc(c1)NN 62a_100000748629_100000217339 [0,2,0,0,0,1|0,0,0]=3 20584 B13R1.643 C=C(C)CSc1cccc(c1)OC 62a_100000748629_100000170001 [0,2,0,0,0,1|0,0,0]=3 20585 B13R1.643 C=C(C)CSc1cccc(c1)SC 62a_100000748629_100011215954 [0,2,0,0,0,1|0,0,0]=3 20586 B13R1.643 C=C(C)CSc1cccc(c1)SC 62a_100011215954_100000211660 [0,2,0,0,0,1|0,0,0]=3 20587 B13R1.643 C=C(C)CSc1cccc(n1)C#N 62a_100000748629_100011934037 [0,2,0,0,0,1|1,0,0]=4 20588 B13R1.643 C=C(C)CSc1cccc(n1)C=O 62a_100000688028_100000211660 [0,2,0,0,0,1|1,0,0]=4 20589 B13R1.643 C=C(C)CSc1cccc(n1)C=O 62a_100000748629_100000688028 [0,2,0,0,0,1|1,0,0]=4 20590 B13R1.643 C=C(C)CSc1cccc(n1)CC 62a_100000748629_100009856026 [0,2,0,0,0,1|1,0,0]=4 20591 B13R1.643 C=C(C)CSc1cccc(n1)CC 62a_100009856026_100000211660 [0,2,0,0,0,1|1,0,0]=4 20592 B13R1.643 C=C(C)CSc1cccc(n1)CN 62a_100000748629_100016990191 [0,2,0,0,0,1|1,0,0]=4 20593 B13R1.643 C=C(C)CSc1cccc(n1)CN 62a_100016990191_100000211660 [0,2,0,0,0,1|1,0,0]=4 20594 B13R1.643 C=C(C)CSc1cccc(n1)CO 62a_100000694195_100000211660 [0,2,0,0,0,1|1,0,0]=4 20595 B13R1.643 C=C(C)CSc1cccc(n1)CO 62a_100000748629_100000694195 [0,2,0,0,0,1|1,0,0]=4 20596 B13R1.643 C=C(C)CSc1cccc(n1)NC 62a_100000703281_100000211660 [0,2,0,0,0,1|1,0,0]=4 20597 B13R1.643 C=C(C)CSc1cccc(n1)NC 62a_100000748629_100000703281 [0,2,0,0,0,1|1,0,0]=4 20598 B13R1.643 C=C(C)CSc1cccc(n1)NN 62a_100000748629_100009817029 [0,2,0,0,0,1|1,0,0]=4 20599 B13R1.643 C=C(C)CSc1cccc(n1)NN 62a_100009817029_100000211660 [0,2,0,0,0,1|1,0,0]=4 20600 B13R1.643 C=C(C)CSc1cccc(n1)OC 62a_100000748629_100000760917 [0,2,0,0,0,1|1,0,0]=4 20601 B13R1.643 C=C(C)CSc1cccc(n1)OC 62a_100000760917_100000211660 [0,2,0,0,0,1|1,0,0]=4 20602 B13R1.643 C=C(C)CSc1cccc(n1)SC 62a_100000748629_100011960944 [0,2,0,0,0,1|1,0,0]=4 20603 B13R1.643 C=C(C)CSc1cccc(n1)SC 62a_100011960944_100000211660 [0,2,0,0,0,1|1,0,0]=4 20604 B13R1.643 C=C(C)CSc1ccnc(c1)C#N 62a_100000748629_100000685610 [0,2,0,0,0,1|1,0,0]=4 20605 B13R1.643 C=C(C)CSc1ccnc(c1)C=O 62a_100000748629_100011998288 [0,2,0,0,0,1|1,0,0]=4 20606 B13R1.643 C=C(C)CSc1ccnc(c1)C=O 62a_100011998288_100000211660 [0,2,0,0,0,1|1,0,0]=4 20607 B13R1.643 C=C(C)CSc1ccnc(c1)CC 62a_100000748629_100009820011 [0,2,0,0,0,1|1,0,0]=4 20608 B13R1.643 C=C(C)CSc1ccnc(c1)CC 62a_100009820011_100000211660 [0,2,0,0,0,1|1,0,0]=4 20609 B13R1.643 C=C(C)CSc1ccnc(c1)CN 62a_100000085674_100000211660 [0,2,0,0,0,1|1,0,0]=4 20610 B13R1.643 C=C(C)CSc1ccnc(c1)CN 62a_100000748629_100000085674 [0,2,0,0,0,1|1,0,0]=4 20611 B13R1.643 C=C(C)CSc1ccnc(c1)CO 62a_100000748629_100000748867 [0,2,0,0,0,1|1,0,0]=4 20612 B13R1.643 C=C(C)CSc1ccnc(c1)CO 62a_100000748867_100000211660 [0,2,0,0,0,1|1,0,0]=4 20613 B13R1.643 C=C(C)CSc1ccnc(c1)NC 62a_100000748629_100009819592 [0,2,0,0,0,1|1,0,0]=4 20614 B13R1.643 C=C(C)CSc1ccnc(c1)NC 62a_100009819592_100000211660 [0,2,0,0,0,1|1,0,0]=4 20615 B13R1.643 C=C(C)CSc1ccnc(c1)NN 62a_100000748629_100000764631 [0,2,0,0,0,1|1,0,0]=4 20616 B13R1.643 C=C(C)CSc1ccnc(c1)NN 62a_100000764631_100000211660 [0,2,0,0,0,1|1,0,0]=4 20617 B13R1.643 C=C(C)CSc1ccnc(c1)OC 62a_100000117307_100000211660 [0,2,0,0,0,1|1,0,0]=4 20618 B13R1.643 C=C(C)CSc1ccnc(c1)OC 62a_100000748629_100000117307 [0,2,0,0,0,1|1,0,0]=4 20619 B13R1.643 C=C(C)CSc1cncc(c1)C#N 62a_100000748629_100000686085 [0,2,0,0,0,1|1,0,0]=4 20620 B13R1.643 C=C(C)CSc1cncc(c1)C=O 62a_100000687066_100000211660 [0,2,0,0,0,1|1,0,0]=4 20621 B13R1.643 C=C(C)CSc1cncc(c1)C=O 62a_100000748629_100000687066 [0,2,0,0,0,1|1,0,0]=4 20622 B13R1.643 C=C(C)CSc1cncc(c1)CC 62a_100000748629_200009819073 [0,2,0,0,0,1|1,0,0]=4 20623 B13R1.643 C=C(C)CSc1cncc(c1)CC 62a_200009819073_100000211660 [0,2,0,0,0,1|1,0,0]=4 20624 B13R1.643 C=C(C)CSc1cncc(c1)CN 62a_100000748629_100011249555 [0,2,0,0,0,1|1,0,0]=4 20625 B13R1.643 C=C(C)CSc1cncc(c1)CN 62a_100011249555_100000211660 [0,2,0,0,0,1|1,0,0]=4 20626 B13R1.643 C=C(C)CSc1cncc(c1)CO 62a_100000748629_100011259137 [0,2,0,0,0,1|1,0,0]=4 20627 B13R1.643 C=C(C)CSc1cncc(c1)CO 62a_100011259137_100000211660 [0,2,0,0,0,1|1,0,0]=4 20628 B13R1.643 C=C(C)CSc1cncc(c1)NC 62a_100000748629_100012184536 [0,2,0,0,0,1|1,0,0]=4 20629 B13R1.643 C=C(C)CSc1cncc(c1)NC 62a_100012184536_100000211660 [0,2,0,0,0,1|1,0,0]=4 20630 B13R1.643 C=C(C)CSc1cncc(c1)NN 62a_100000727789_100000211660 [0,2,0,0,0,1|1,0,0]=4 20631 B13R1.643 C=C(C)CSc1cncc(c1)NN 62a_100000748629_100000727789 [0,2,0,0,0,1|1,0,0]=4 20632 B13R1.643 C=C(C)CSc1cncc(c1)OC 62a_100000050176_100000211660 [0,2,0,0,0,1|1,0,0]=4 20633 B13R1.643 C=C(C)CSc1cncc(c1)OC 62a_100000748629_100000050176 [0,2,0,0,0,1|1,0,0]=4 20634 B13R1.643 C=C(C)CSc1cncc(c1)SC 62a_100000748629_100009816972 [0,2,0,0,0,1|1,0,0]=4 20635 B13R1.643 C=C(C)CSc1cncc(c1)SC 62a_100009816972_100000211660 [0,2,0,0,0,1|1,0,0]=4 20636 B13R1.643 C=C(F)CNc1cccc(c1)C#N 34a_100000210922_100009893438 [0,2,0,0,0,1|1,0,0]=4 20637 B13R1.643 C=C(F)CNc1cccc(c1)C#N 7a_100000210922_100000042424 [0,2,0,0,0,1|1,0,0]=4 20638 B13R1.643 C=C(F)CNc1cccc(c1)CC 2230a_100000211250_100009893438 [0,2,0,0,0,1|1,0,0]=4 20639 B13R1.643 C=C(F)CNc1cccc(c1)CC 34a_100000211250_100009893438 [0,2,0,0,0,1|1,0,0]=4 20640 B13R1.643 C=C(F)CNc1cccc(c1)CC 7a_100000211250_100000042424 [0,2,0,0,0,1|1,0,0]=4 20641 B13R1.643 C=C(F)CNc1cccc(c1)CF 2230a_100000126320_100009893438 [0,2,0,0,0,1|1,0,0]=4 20642 B13R1.643 C=C(F)CNc1cccc(c1)CF 34a_100000126320_100009893438 [0,2,0,0,0,1|1,0,0]=4 20643 B13R1.643 C=C(F)CNc1cccc(c1)CF 7a_100000126320_100000042424 [0,2,0,0,0,1|1,0,0]=4 20644 B13R1.643 C=C(F)CNc1cccc(c1)CO 2230a_100000211919_100009893438 [0,2,0,0,0,1|1,0,0]=4 20645 B13R1.643 C=C(F)CNc1cccc(c1)CO 34a_100000211919_100009893438 [0,2,0,0,0,1|1,0,0]=4 20646 B13R1.643 C=C(F)CNc1cccc(c1)OC 34a_100000210024_100009893438 [0,2,0,0,0,1|1,0,0]=4 20647 B13R1.643 C=C(F)CNc1cccc(c1)SC 2230a_100000210049_100009893438 [0,2,0,0,0,1|1,0,0]=4 20648 B13R1.643 C=C(F)CNc1cccc(c1)SC 34a_100000210049_100009893438 [0,2,0,0,0,1|1,0,0]=4 20649 B13R1.643 C=C(F)COc1cccc(c1)C#N 34a_100000184713_100009893438 [0,2,0,0,0,1|1,0,0]=4 20650 B13R1.643 C=C(F)COc1cccc(c1)C#N 7a_100000184713_100000042424 [0,2,0,0,0,1|1,0,0]=4 20651 B13R1.643 C=C(F)COc1cccc(c1)CBr 34a_100011660834_100009893438 [0,2,0,0,0,1|1,0,0]=4 20652 B13R1.643 C=C(F)COc1cccc(c1)CBr 7a_100011660834_100000042424 [0,2,0,0,0,1|1,0,0]=4 20653 B13R1.643 C=C(F)COc1cccc(c1)CC 34a_100000211550_100009893438 [0,2,0,0,0,1|1,0,0]=4 20654 B13R1.643 C=C(F)COc1cccc(c1)CC 7a_100000211550_100000042424 [0,2,0,0,0,1|1,0,0]=4 20655 B13R1.643 C=C(F)COc1cccc(c1)CCl 34a_100000084143_100009893438 [0,2,0,0,0,1|1,0,0]=4 20656 B13R1.643 C=C(F)COc1cccc(c1)CCl 7a_100000084143_100000042424 [0,2,0,0,0,1|1,0,0]=4 20657 B13R1.643 C=C(F)COc1cccc(c1)CN 34a_100000743036_100009893438 [0,2,0,0,0,1|1,0,0]=4 20658 B13R1.643 C=C(F)COc1cccc(c1)CO 34a_100011214949_100009893438 [0,2,0,0,0,1|1,0,0]=4 20659 B13R1.643 C=C(F)COc1cccc(c1)CO 7a_100011214949_100000042424 [0,2,0,0,0,1|1,0,0]=4 20660 B13R1.643 C=C(F)COc1cccc(c1)NC 34a_100000756613_100009893438 [0,2,0,0,0,1|1,0,0]=4 20661 B13R1.643 C=C(F)COc1cccc(c1)NC 7a_100000756613_100000042424 [0,2,0,0,0,1|1,0,0]=4 20662 B13R1.643 C=C(F)COc1cccc(c1)OC 34a_100000211255_100009893438 [0,2,0,0,0,1|1,0,0]=4 20663 B13R1.643 C=C(F)COc1cccc(c1)OC 7a_100000211255_100000042424 [0,2,0,0,0,1|1,0,0]=4 20664 B13R1.643 C=C(F)COc1cccc(c1)SC 34a_100011265683_100009893438 [0,2,0,0,0,1|1,0,0]=4 20665 B13R1.643 C=C(F)COc1cccc(c1)SC 7a_100011265683_100000042424 [0,2,0,0,0,1|1,0,0]=4 20666 B13R1.643 C=C(F)CSc1cccc(c1)C#N 62a_100000042424_100000189340 [0,2,0,0,0,1|1,0,0]=4 20667 B13R1.643 C=C(F)CSc1cccc(c1)C=O 62a_100000014684_100000042424 [0,2,0,0,0,1|1,0,0]=4 20668 B13R1.643 C=C(F)CSc1cccc(c1)C=O 62a_100000042424_100000014684 [0,2,0,0,0,1|1,0,0]=4 20669 B13R1.643 C=C(F)CSc1cccc(c1)CC 62a_100000042424_100011263222 [0,2,0,0,0,1|1,0,0]=4 20670 B13R1.643 C=C(F)CSc1cccc(c1)CC 62a_100011263222_100000042424 [0,2,0,0,0,1|1,0,0]=4 20671 B13R1.643 C=C(F)CSc1cccc(c1)CF 62a_100000042424_100010878472 [0,2,0,0,0,1|1,0,0]=4 20672 B13R1.643 C=C(F)CSc1cccc(c1)CF 62a_100010878472_100000042424 [0,2,0,0,0,1|1,0,0]=4 20673 B13R1.643 C=C(F)CSc1cccc(c1)CN 62a_100000042424_100000106179 [0,2,0,0,0,1|1,0,0]=4 20674 B13R1.643 C=C(F)CSc1cccc(c1)CN 62a_100000106179_100000042424 [0,2,0,0,0,1|1,0,0]=4 20675 B13R1.643 C=C(F)CSc1cccc(c1)CO 62a_100000042424_100000687537 [0,2,0,0,0,1|1,0,0]=4 20676 B13R1.643 C=C(F)CSc1cccc(c1)CO 62a_100000687537_100000042424 [0,2,0,0,0,1|1,0,0]=4 20677 B13R1.643 C=C(F)CSc1cccc(c1)NC 62a_100000042424_100000219648 [0,2,0,0,0,1|1,0,0]=4 20678 B13R1.643 C=C(F)CSc1cccc(c1)NC 62a_100000219648_100000042424 [0,2,0,0,0,1|1,0,0]=4 20679 B13R1.643 C=C(F)CSc1cccc(c1)NN 62a_100000042424_100000217339 [0,2,0,0,0,1|1,0,0]=4 20680 B13R1.643 C=C(F)CSc1cccc(c1)NN 62a_100000217339_100000042424 [0,2,0,0,0,1|1,0,0]=4 20681 B13R1.643 C=C(F)CSc1cccc(c1)OC 62a_100000042424_100000170001 [0,2,0,0,0,1|1,0,0]=4 20682 B13R1.643 C=C(F)CSc1cccc(c1)SC 62a_100000042424_100011215954 [0,2,0,0,0,1|1,0,0]=4 20683 B13R1.643 C=C(F)CSc1cccc(c1)SC 62a_100011215954_100000042424 [0,2,0,0,0,1|1,0,0]=4 20684 B13R1.643 C=Cc1cc(ccn1)SCC(=C)C 62a_100000748629_100009845566 [0,2,0,0,0,1|1,0,0]=4 20685 B13R1.643 C=Cc1cc(ccn1)SCC(=C)C 62a_100009845566_100000211660 [0,2,0,0,0,1|1,0,0]=4 20686 B13R1.643 C=Cc1cccc(c1)CCC(=O)C 271570a_100011290941_100011279149 [0,2,0,0,0,1|1,0,0]=4 20687 B13R1.643 C=Cc1cccc(c1)CNC(=O)C 271570a_100011290941_100000766983 [0,2,0,0,0,1|1,0,0]=4 20688 B13R1.643 C=Cc1cccc(c1)NCC(=C)C 34a_100011827668_100000748629 [0,2,0,0,0,1|0,0,0]=3 20689 B13R1.643 C=Cc1cccc(c1)NCC(=C)F 34a_100011827668_100009893438 [0,2,0,0,0,1|1,0,0]=4 20690 B13R1.643 C=Cc1cccc(c1)OCC(=C)C 34a_100011309434_100000748629 [0,2,0,0,0,1|0,0,0]=3 20691 B13R1.643 C=Cc1cccc(c1)OCC(=C)C 7a_100011309434_100000748629 [0,2,0,0,0,1|0,0,0]=3 20692 B13R1.643 C=Cc1cccc(c1)OCC(=C)F 34a_100011309434_100009893438 [0,2,0,0,0,1|1,0,0]=4 20693 B13R1.643 C=Cc1cccc(c1)OCC(=C)F 7a_100011309434_100000042424 [0,2,0,0,0,1|1,0,0]=4 20694 B13R1.643 C=Cc1cccc(c1)SCC(=C)C 62a_100000748629_100011215241 [0,2,0,0,0,1|0,0,0]=3 20695 B13R1.643 C=Cc1cccc(c1)SCC(=C)C 62a_100011215241_100000211660 [0,2,0,0,0,1|0,0,0]=3 20696 B13R1.643 C=Cc1cccc(c1)SCC(=C)F 62a_100000042424_100011215241 [0,2,0,0,0,1|1,0,0]=4 20697 B13R1.643 C=Cc1cccc(c1)SCC(=C)F 62a_100011215241_100000042424 [0,2,0,0,0,1|1,0,0]=4 20698 B13R1.643 C=Cc1cncc(c1)SCC(=C)C 62a_100000748629_200012180632 [0,2,0,0,0,1|1,0,0]=4 20699 B13R1.643 C=Cc1cncc(c1)SCC(=C)C 62a_200012180632_100000211660 [0,2,0,0,0,1|1,0,0]=4 20700 B13R1.643 CC(=O)CCc1cccc(c1)C#N 1458a_100011998624_200000210301 [0,2,0,0,0,1|1,0,0]=4 20701 B13R1.643 CC(=O)CCc1cccc(c1)S[13CH3] 62a_100011279149_200025704644 [0,2,0,0,0,1|1,0,0]=4 20702 B13R1.643 CC(=O)CCc1cccc(c1)S[13CH3] 62a_200025704644_100011279149 [0,2,0,0,0,1|1,0,0]=4 20703 B13R1.643 CC(=O)COc1cccc(c1)C#N 1458a_100000230692_200000210301 [0,2,0,0,0,1|1,0,0]=4 20704 B13R1.643 CC(=O)NCc1cccc(c1)C#N 11a_100000755147_100015343762 [0,2,0,0,0,1|1,0,0]=4 20705 B13R1.643 CC(=O)NCc1cccc(c1)C#N 1626a_100000755147_100015343762 [0,2,0,0,0,1|1,0,0]=4 20706 B13R1.643 CC(=O)NCc1cccc(c1)C#N 240690a_100000755147_100015343762 [0,2,0,0,0,1|1,0,0]=4 20707 B13R1.643 CC(=O)NCc1cccc(c1)C#N 527a_100000755147_100103153847 [0,2,0,0,0,1|1,0,0]=4 20708 B13R1.643 CC(=O)NCc1cccc(c1)CO 240690a_100011269909_100015343762 [0,2,0,0,0,1|1,0,0]=4 20709 B13R1.643 CC(=O)NCc1cccc(c1)CO 527a_100011269909_100103153847 [0,2,0,0,0,1|1,0,0]=4 20710 B13R1.643 CC(=O)NCc1cccc(c1)S[13CH3] 62a_100000766983_200025704644 [0,2,0,0,0,1|1,0,0]=4 20711 B13R1.643 CC(=O)NCc1cccc(c1)S[13CH3] 62a_200025704644_100000766983 [0,2,0,0,0,1|1,0,0]=4 20712 B13R1.643 COc1cccc(c1)CCC(=O)C 1458a_100000070787_100011713679 [0,2,0,0,0,1|1,0,0]=4 20713 B13R1.643 COc1cccc(c1)CCC(=O)C 1458a_100000234931_200000210301 [0,2,0,0,0,1|1,0,0]=4 20714 B13R1.643 COc1cccc(c1)CCC(=O)[13CH3] 1458a_100000234931_200025704644 [0,2,0,0,0,1|1,0,0]=4 20715 B13R1.643 COc1cccc(c1)CNC(=O)C 11a_100000174954_100015343762 [0,2,0,0,0,1|1,0,0]=4 20716 B13R1.643 COc1cccc(c1)CNC(=O)C 1626a_100000174954_100015343762 [0,2,0,0,0,1|1,0,0]=4 20717 B13R1.643 COc1cccc(c1)CNC(=O)C 240690a_100000174954_100015343762 [0,2,0,0,0,1|1,0,0]=4 20718 B13R1.643 COc1cccc(c1)CNC(=O)C 527a_100000174954_100103153847 [0,2,0,0,0,1|1,0,0]=4 20719 B13R1.643 COc1cccc(c1)OCC(=O)C 1458a_100000182123_200000210301 [0,2,0,0,0,1|1,0,0]=4 20720 B13R1.643 COc1cccc(c1)OCC(=O)[13CH3] 1458a_100000182123_200025704644 [0,2,0,0,0,1|1,0,0]=4 20721 B13R1.643 COc1cccc(c1)SCC(=O)C 1458a_100000741315_200000210301 [0,2,0,0,0,1|1,0,0]=4 20722 B13R1.643 COc1cccc(c1)SCC(=O)[13CH3] 1458a_100000741315_200025704644 [0,2,0,0,0,1|1,0,0]=4 20723 B13R1.643 CSc1cccc(c1)CCC(=O)C 62a_100011279149_200000210301 [0,2,0,0,0,1|1,0,0]=4 20724 B13R1.643 CSc1cccc(c1)CCC(=O)C 62a_200000210301_100011279149 [0,2,0,0,0,1|1,0,0]=4 20725 B13R1.643 CSc1cccc(c1)CNC(=O)C 62a_100000766983_200000210301 [0,2,0,0,0,1|1,0,0]=4 20726 B13R1.643 CSc1cccc(c1)CNC(=O)C 62a_200000210301_100000766983 [0,2,0,0,0,1|1,0,0]=4 20727 B13R1.643 [13CH3]C(=O)CCc1cccc(c1)C#N 1458a_100011998624_200025704644 [0,2,0,0,0,1|1,0,0]=4 20728 B13R1.643 [13CH3]C(=O)COc1cccc(c1)C#N 1458a_100000230692_200025704644 [0,2,0,0,0,1|1,0,0]=4 20729 B13R1.3420 C=C(C)CNc1cc([nH]c(=O)c1)C 27a_100000765925_100009861981 [0,2,0,0,0,1|1,0,0]=4 20730 B13R1.3420 C=C(C)CNc1cc(cc(c1)Br)Br 27a_100000765925_100009814770 [0,2,0,0,0,1|0,0,0]=3 20731 B13R1.3420 C=C(C)CNc1cc(cc(c1)Br)Br 34a_100012047176_100000748629 [0,2,0,0,0,1|0,0,0]=3 20732 B13R1.3420 C=C(C)CNc1cc(cc(c1)Br)Br 7a_100012047176_100000748629 [0,2,0,0,0,1|0,0,0]=3 20733 B13R1.3420 C=C(C)CNc1cc(cc(c1)Br)C 34a_100000695972_100000748629 [0,2,0,0,0,1|0,0,0]=3 20734 B13R1.3420 C=C(C)CNc1cc(cc(c1)Br)C 7a_100000695972_100000748629 [0,2,0,0,0,1|0,0,0]=3 20735 B13R1.3420 C=C(C)CNc1cc(cc(c1)Br)Cl 34a_100011934539_100000748629 [0,2,0,0,0,1|0,0,0]=3 20736 B13R1.3420 C=C(C)CNc1cc(cc(c1)Br)Cl 7a_100011934539_100000748629 [0,2,0,0,0,1|0,0,0]=3 20737 B13R1.3420 C=C(C)CNc1cc(cc(c1)Br)F 34a_100000705686_100000748629 [0,2,0,0,0,1|0,0,0]=3 20738 B13R1.3420 C=C(C)CNc1cc(cc(c1)Br)F 7a_100000705686_100000748629 [0,2,0,0,0,1|0,0,0]=3 20739 B13R1.3420 C=C(C)CNc1cc(cc(c1)C)C 2230a_100000210930_100000748629 [0,2,0,0,0,1|0,0,0]=3 20740 B13R1.3420 C=C(C)CNc1cc(cc(c1)C)C 34a_100000210930_100000748629 [0,2,0,0,0,1|0,0,0]=3 20741 B13R1.3420 C=C(C)CNc1cc(cc(c1)C)C 7a_100000210930_100000748629 [0,2,0,0,0,1|0,0,0]=3 20742 B13R1.3420 C=C(C)CNc1cc(cc(c1)Cl)C 2230a_100012022512_100000748629 [0,2,0,0,0,1|0,0,0]=3 20743 B13R1.3420 C=C(C)CNc1cc(cc(c1)Cl)C 34a_100012022512_100000748629 [0,2,0,0,0,1|0,0,0]=3 20744 B13R1.3420 C=C(C)CNc1cc(cc(c1)Cl)C 7a_100012022512_100000748629 [0,2,0,0,0,1|0,0,0]=3 20745 B13R1.3420 C=C(C)CNc1cc(cc(c1)Cl)Cl 34a_100000210456_100000748629 [0,2,0,0,0,1|0,0,0]=3 20746 B13R1.3420 C=C(C)CNc1cc(cc(c1)Cl)Cl 7a_100000210456_100000748629 [0,2,0,0,0,1|0,0,0]=3 20747 B13R1.3420 C=C(C)CNc1cc(cc(c1)Cl)F 34a_100000686136_100000748629 [0,2,0,0,0,1|0,0,0]=3 20748 B13R1.3420 C=C(C)CNc1cc(cc(c1)Cl)F 7a_100000686136_100000748629 [0,2,0,0,0,1|0,0,0]=3 20749 B13R1.3420 C=C(C)CNc1cc(cc(c1)Cl)O 34a_100000123917_100000748629 [0,2,0,0,0,1|0,0,0]=3 20750 B13R1.3420 C=C(C)CNc1cc(cc(c1)Cl)O 7a_100000123917_100000748629 [0,2,0,0,0,1|0,0,0]=3 20751 B13R1.3420 C=C(C)CNc1cc(cc(c1)F)C 2230a_100000742734_100000748629 [0,2,0,0,0,1|0,0,0]=3 20752 B13R1.3420 C=C(C)CNc1cc(cc(c1)F)C 34a_100000742734_100000748629 [0,2,0,0,0,1|0,0,0]=3 20753 B13R1.3420 C=C(C)CNc1cc(cc(c1)F)C 7a_100000742734_100000748629 [0,2,0,0,0,1|0,0,0]=3 20754 B13R1.3420 C=C(C)CNc1cc(cc(c1)F)F 34a_100000233717_100000748629 [0,2,0,0,0,1|0,0,0]=3 20755 B13R1.3420 C=C(C)CNc1cc(cc(c1)F)F 7a_100000233717_100000748629 [0,2,0,0,0,1|0,0,0]=3 20756 B13R1.3420 C=C(C)CNc1cc(cc(c1)I)Br 7a_100009814763_100000748629 [0,2,0,0,0,1|0,0,0]=3 20757 B13R1.3420 C=C(C)CNc1cc(cc(c1)I)Cl 7a_100010147676_100000748629 [0,2,0,0,0,1|0,0,0]=3 20758 B13R1.3420 C=C(C)CNc1cc(cc(c1)I)F 34a_100011356972_100000748629 [0,2,0,0,0,1|0,0,0]=3 20759 B13R1.3420 C=C(C)CNc1cc(cc(c1)I)F 7a_100011356972_100000748629 [0,2,0,0,0,1|0,0,0]=3 20760 B13R1.3420 C=C(C)CNc1cc(cc(c1)I)I 7a_200000696836_100000748629 [0,2,0,0,0,1|0,0,0]=3 20761 B13R1.3420 C=C(C)CNc1cc(cc(c1)O)C 34a_100011995906_100000748629 [0,2,0,0,0,1|0,0,0]=3 20762 B13R1.3420 C=C(C)CNc1cc(cc(c1)O)C 7a_100011995906_100000748629 [0,2,0,0,0,1|0,0,0]=3 20763 B13R1.3420 C=C(C)CNc1cc(cc(c1)O)O 34a_100000043371_100000748629 [0,2,0,0,0,1|0,0,0]=3 20764 B13R1.3420 C=C(C)CNc1cc(cc(n1)C)C 27a_100000765925_100000069240 [0,2,0,0,0,1|1,0,0]=4 20765 B13R1.3420 C=C(C)CNc1cc(cc(n1)F)C 27a_100000765925_100009819601 [0,2,0,0,0,1|1,0,0]=4 20766 B13R1.3420 C=C(C)CNc1cc(nc(c1)C)C 27a_100000765925_100000066820 [0,2,0,0,0,1|1,0,0]=4 20767 B13R1.3420 C=C(C)CNc1cc(nc(c1)Cl)C 27a_100000765925_100010068023 [0,2,0,0,0,1|1,0,0]=4 20768 B13R1.3420 C=C(C)CNc1cc(nc(c1)Cl)F 27a_100000765925_100011069727 [0,2,0,0,0,1|1,0,0]=4 20769 B13R1.3420 C=C(C)CNc1cc(nc(c1)F)C 27a_100000765925_100010006595 [0,2,0,0,0,1|1,0,0]=4 20770 B13R1.3420 C=C(C)CNc1cc(nc(c1)F)F 27a_100000765925_100000049587 [0,2,0,0,0,1|1,0,0]=4 20771 B13R1.3420 C=C(C)COc1cc(=O)cc(o1)C 34a_100016989201_100000748629 [0,2,0,0,0,1|1,0,0]=4 20772 B13R1.3420 C=C(C)COc1cc([nH]c(=O)c1)C 34a_100000039070_100000748629 [0,2,0,0,0,1|1,0,0]=4 20773 B13R1.3420 C=C(C)COc1cc(cc(c1)Br)Br 34a_100010167048_100000748629 [0,2,0,0,0,1|0,0,0]=3 20774 B13R1.3420 C=C(C)COc1cc(cc(c1)Br)Br 7a_100010167048_100000748629 [0,2,0,0,0,1|0,0,0]=3 20775 B13R1.3420 C=C(C)COc1cc(cc(c1)Br)C 34a_100011999630_100000748629 [0,2,0,0,0,1|0,0,0]=3 20776 B13R1.3420 C=C(C)COc1cc(cc(c1)Br)C 7a_100011999630_100000748629 [0,2,0,0,0,1|0,0,0]=3 20777 B13R1.3420 C=C(C)COc1cc(cc(c1)Br)Cl 34a_100010185897_100000748629 [0,2,0,0,0,1|0,0,0]=3 20778 B13R1.3420 C=C(C)COc1cc(cc(c1)Br)Cl 7a_100010185897_100000748629 [0,2,0,0,0,1|0,0,0]=3 20779 B13R1.3420 C=C(C)COc1cc(cc(c1)Br)F 34a_100000688818_100000748629 [0,2,0,0,0,1|0,0,0]=3 20780 B13R1.3420 C=C(C)COc1cc(cc(c1)Br)F 7a_100000688818_100000748629 [0,2,0,0,0,1|0,0,0]=3 20781 B13R1.3420 C=C(C)COc1cc(cc(c1)C)C 34a_100000210933_100000748629 [0,2,0,0,0,1|0,0,0]=3 20782 B13R1.3420 C=C(C)COc1cc(cc(c1)C)C 7a_100000210933_100000748629 [0,2,0,0,0,1|0,0,0]=3 20783 B13R1.3420 C=C(C)COc1cc(cc(c1)Cl)C 34a_100000087485_100000748629 [0,2,0,0,0,1|0,0,0]=3 20784 B13R1.3420 C=C(C)COc1cc(cc(c1)Cl)C 7a_100000087485_100000748629 [0,2,0,0,0,1|0,0,0]=3 20785 B13R1.3420 C=C(C)COc1cc(cc(c1)Cl)Cl 34a_100000181315_100000748629 [0,2,0,0,0,1|0,0,0]=3 20786 B13R1.3420 C=C(C)COc1cc(cc(c1)Cl)Cl 7a_100000181315_100000748629 [0,2,0,0,0,1|0,0,0]=3 20787 B13R1.3420 C=C(C)COc1cc(cc(c1)Cl)F 34a_100011219751_100000748629 [0,2,0,0,0,1|0,0,0]=3 20788 B13R1.3420 C=C(C)COc1cc(cc(c1)Cl)F 7a_100011219751_100000748629 [0,2,0,0,0,1|0,0,0]=3 20789 B13R1.3420 C=C(C)COc1cc(cc(c1)Cl)N 34a_100000123917_100000748629 [0,2,0,0,0,1|0,0,0]=3 20790 B13R1.3420 C=C(C)COc1cc(cc(c1)Cl)N 7a_100000123917_100000748629 [0,2,0,0,0,1|0,0,0]=3 20791 B13R1.3420 C=C(C)COc1cc(cc(c1)F)C 34a_100011830401_100000748629 [0,2,0,0,0,1|0,0,0]=3 20792 B13R1.3420 C=C(C)COc1cc(cc(c1)F)C 7a_100011830401_100000748629 [0,2,0,0,0,1|0,0,0]=3 20793 B13R1.3420 C=C(C)COc1cc(cc(c1)F)F 34a_100000747503_100000748629 [0,2,0,0,0,1|0,0,0]=3 20794 B13R1.3420 C=C(C)COc1cc(cc(c1)F)F 7a_100000747503_100000748629 [0,2,0,0,0,1|0,0,0]=3 20795 B13R1.3420 C=C(C)COc1cc(cc(c1)I)Br 34a_100010068917_100000748629 [0,2,0,0,0,1|0,0,0]=3 20796 B13R1.3420 C=C(C)COc1cc(cc(c1)I)Br 7a_100010068917_100000748629 [0,2,0,0,0,1|0,0,0]=3 20797 B13R1.3420 C=C(C)COc1cc(cc(c1)I)Cl 34a_100010068924_100000748629 [0,2,0,0,0,1|0,0,0]=3 20798 B13R1.3420 C=C(C)COc1cc(cc(c1)I)Cl 7a_100010068924_100000748629 [0,2,0,0,0,1|0,0,0]=3 20799 B13R1.3420 C=C(C)COc1cc(cc(c1)I)F 34a_100000717995_100000748629 [0,2,0,0,0,1|0,0,0]=3 20800 B13R1.3420 C=C(C)COc1cc(cc(c1)I)F 7a_100000717995_100000748629 [0,2,0,0,0,1|0,0,0]=3 20801 B13R1.3420 C=C(C)COc1cc(cc(c1)N)C 34a_100011995906_100000748629 [0,2,0,0,0,1|0,0,0]=3 20802 B13R1.3420 C=C(C)COc1cc(cc(c1)N)C 7a_100011995906_100000748629 [0,2,0,0,0,1|0,0,0]=3 20803 B13R1.3420 C=C(C)COc1cc(nc(c1)Br)Br 34a_100010172823_100000748629 [0,2,0,0,0,1|1,0,0]=4 20804 B13R1.3420 C=C(C)COc1cc(nc(c1)Br)Br 7a_100010172823_100000748629 [0,2,0,0,0,1|1,0,0]=4 20805 B13R1.3420 C=C(C)COc1cc(oc(=O)c1)C 34a_100000210952_100000748629 [0,2,0,0,0,1|1,0,0]=4 20806 B13R1.3420 C=C(C)COc1cc(oc(=O)c1)C 7a_100000210952_100000748629 [0,2,0,0,0,1|1,0,0]=4 20807 B13R1.3420 C=C(C)CSc1cc([nH]c(=O)c1)C 62a_100000748629_100009861981 [0,2,0,0,0,1|1,0,0]=4 20808 B13R1.3420 C=C(C)CSc1cc([nH]c(=O)c1)C 62a_100009861981_100000211660 [0,2,0,0,0,1|1,0,0]=4 20809 B13R1.3420 C=C(C)CSc1cc(cc(c1)Br)Br 62a_100000748629_100009814770 [0,2,0,0,0,1|0,0,0]=3 20810 B13R1.3420 C=C(C)CSc1cc(cc(c1)Br)Br 62a_100009814770_100000211660 [0,2,0,0,0,1|0,0,0]=3 20811 B13R1.3420 C=C(C)CSc1cc(cc(c1)Br)Cl 62a_100000748629_100009814755 [0,2,0,0,0,1|0,0,0]=3 20812 B13R1.3420 C=C(C)CSc1cc(cc(c1)Br)Cl 62a_100009814755_100000211660 [0,2,0,0,0,1|0,0,0]=3 20813 B13R1.3420 C=C(C)CSc1cc(cc(c1)Br)F 62a_100000748629_100009814764 [0,2,0,0,0,1|0,0,0]=3 20814 B13R1.3420 C=C(C)CSc1cc(cc(c1)Br)F 62a_100009814764_100000211660 [0,2,0,0,0,1|0,0,0]=3 20815 B13R1.3420 C=C(C)CSc1cc(cc(c1)Br)N 62a_100000748629_100009814763 [0,2,0,0,0,1|0,0,0]=3 20816 B13R1.3420 C=C(C)CSc1cc(cc(c1)Br)N 62a_100009814763_100000211660 [0,2,0,0,0,1|0,0,0]=3 20817 B13R1.3420 C=C(C)CSc1cc(cc(c1)Br)O 62a_100000748629_100010068917 [0,2,0,0,0,1|0,0,0]=3 20818 B13R1.3420 C=C(C)CSc1cc(cc(c1)Br)O 62a_100010068917_100000211660 [0,2,0,0,0,1|0,0,0]=3 20819 B13R1.3420 C=C(C)CSc1cc(cc(c1)C)C 62a_100000748629_100011215608 [0,2,0,0,0,1|0,0,0]=3 20820 B13R1.3420 C=C(C)CSc1cc(cc(c1)C)C 62a_100011215608_100000211660 [0,2,0,0,0,1|0,0,0]=3 20821 B13R1.3420 C=C(C)CSc1cc(cc(c1)Cl)C 62a_100000748629_100010172791 [0,2,0,0,0,1|0,0,0]=3 20822 B13R1.3420 C=C(C)CSc1cc(cc(c1)Cl)C 62a_100010172791_100000211660 [0,2,0,0,0,1|0,0,0]=3 20823 B13R1.3420 C=C(C)CSc1cc(cc(c1)Cl)Cl 62a_100000747138_100000211660 [0,2,0,0,0,1|0,0,0]=3 20824 B13R1.3420 C=C(C)CSc1cc(cc(c1)Cl)Cl 62a_100000748629_100000747138 [0,2,0,0,0,1|0,0,0]=3 20825 B13R1.3420 C=C(C)CSc1cc(cc(c1)Cl)F 62a_100000748629_100013859453 [0,2,0,0,0,1|0,0,0]=3 20826 B13R1.3420 C=C(C)CSc1cc(cc(c1)Cl)F 62a_100013859453_100000211660 [0,2,0,0,0,1|0,0,0]=3 20827 B13R1.3420 C=C(C)CSc1cc(cc(c1)Cl)N 62a_100000748629_100010147676 [0,2,0,0,0,1|0,0,0]=3 20828 B13R1.3420 C=C(C)CSc1cc(cc(c1)Cl)N 62a_100010147676_100000211660 [0,2,0,0,0,1|0,0,0]=3 20829 B13R1.3420 C=C(C)CSc1cc(cc(c1)Cl)O 62a_100000748629_100010068924 [0,2,0,0,0,1|0,0,0]=3 20830 B13R1.3420 C=C(C)CSc1cc(cc(c1)Cl)O 62a_100010068924_100000211660 [0,2,0,0,0,1|0,0,0]=3 20831 B13R1.3420 C=C(C)CSc1cc(cc(c1)F)C 62a_100000748629_100011356977 [0,2,0,0,0,1|0,0,0]=3 20832 B13R1.3420 C=C(C)CSc1cc(cc(c1)F)C 62a_100011356977_100000211660 [0,2,0,0,0,1|0,0,0]=3 20833 B13R1.3420 C=C(C)CSc1cc(cc(c1)F)F 62a_100000233788_100000211660 [0,2,0,0,0,1|0,0,0]=3 20834 B13R1.3420 C=C(C)CSc1cc(cc(c1)F)F 62a_100000748629_100000233788 [0,2,0,0,0,1|0,0,0]=3 20835 B13R1.3420 C=C(C)CSc1cc(cc(c1)F)N 62a_100000748629_100011356972 [0,2,0,0,0,1|0,0,0]=3 20836 B13R1.3420 C=C(C)CSc1cc(cc(c1)F)N 62a_100011356972_100000211660 [0,2,0,0,0,1|0,0,0]=3 20837 B13R1.3420 C=C(C)CSc1cc(cc(c1)F)O 62a_100000688818_100000211660 [0,2,0,0,0,1|0,0,0]=3 20838 B13R1.3420 C=C(C)CSc1cc(cc(c1)F)O 62a_100000748629_100000688818 [0,2,0,0,0,1|0,0,0]=3 20839 B13R1.3420 C=C(C)CSc1cc(cc(c1)N)C 62a_100000695972_100000211660 [0,2,0,0,0,1|0,0,0]=3 20840 B13R1.3420 C=C(C)CSc1cc(cc(c1)N)C 62a_100000748629_100000695972 [0,2,0,0,0,1|0,0,0]=3 20841 B13R1.3420 C=C(C)CSc1cc(cc(c1)N)N 62a_100000748629_100011999608 [0,2,0,0,0,1|0,0,0]=3 20842 B13R1.3420 C=C(C)CSc1cc(cc(c1)N)N 62a_100011999608_100000211660 [0,2,0,0,0,1|0,0,0]=3 20843 B13R1.3420 C=C(C)CSc1cc(cc(c1)O)C 62a_100000748629_100011999630 [0,2,0,0,0,1|0,0,0]=3 20844 B13R1.3420 C=C(C)CSc1cc(cc(c1)O)O 62a_100000748629_100009868816 [0,2,0,0,0,1|0,0,0]=3 20845 B13R1.3420 C=C(C)CSc1cc(cc(n1)C)C 62a_100000069240_100000211660 [0,2,0,0,0,1|1,0,0]=4 20846 B13R1.3420 C=C(C)CSc1cc(cc(n1)C)C 62a_100000748629_100000069240 [0,2,0,0,0,1|1,0,0]=4 20847 B13R1.3420 C=C(C)CSc1cc(cc(n1)C)N 62a_100000071261_100000211660 [0,2,0,0,0,1|1,0,0]=4 20848 B13R1.3420 C=C(C)CSc1cc(cc(n1)C)N 62a_100000748629_100000071261 [0,2,0,0,0,1|1,0,0]=4 20849 B13R1.3420 C=C(C)CSc1cc(cc(n1)F)C 62a_100000748629_100009819601 [0,2,0,0,0,1|1,0,0]=4 20850 B13R1.3420 C=C(C)CSc1cc(cc(n1)F)C 62a_100009819601_100000211660 [0,2,0,0,0,1|1,0,0]=4 20851 B13R1.3420 C=C(C)CSc1cc(cc(n1)N)C 62a_100000748629_100009819863 [0,2,0,0,0,1|1,0,0]=4 20852 B13R1.3420 C=C(C)CSc1cc(cc(n1)N)C 62a_100009819863_100000211660 [0,2,0,0,0,1|1,0,0]=4 20853 B13R1.3420 C=C(C)CSc1cc(cc(n1)O)N 62a_100000748629_200012179554 [0,2,0,0,0,1|1,0,0]=4 20854 B13R1.3420 C=C(C)CSc1cc(nc(c1)C)C 62a_100000066820_100000211660 [0,2,0,0,0,1|1,0,0]=4 20855 B13R1.3420 C=C(C)CSc1cc(nc(c1)C)C 62a_100000748629_100000066820 [0,2,0,0,0,1|1,0,0]=4 20856 B13R1.3420 C=C(C)CSc1cc(nc(c1)Cl)C 62a_100000748629_100010068023 [0,2,0,0,0,1|1,0,0]=4 20857 B13R1.3420 C=C(C)CSc1cc(nc(c1)Cl)C 62a_100010068023_100000211660 [0,2,0,0,0,1|1,0,0]=4 20858 B13R1.3420 C=C(C)CSc1cc(nc(c1)Cl)Cl 62a_100000062418_100000211660 [0,2,0,0,0,1|1,0,0]=4 20859 B13R1.3420 C=C(C)CSc1cc(nc(c1)Cl)Cl 62a_100000748629_100000062418 [0,2,0,0,0,1|1,0,0]=4 20860 B13R1.3420 C=C(C)CSc1cc(nc(c1)Cl)F 62a_100000748629_100011069727 [0,2,0,0,0,1|1,0,0]=4 20861 B13R1.3420 C=C(C)CSc1cc(nc(c1)Cl)F 62a_100011069727_100000211660 [0,2,0,0,0,1|1,0,0]=4 20862 B13R1.3420 C=C(C)CSc1cc(nc(c1)Cl)N 62a_100000748629_200011084131 [0,2,0,0,0,1|1,0,0]=4 20863 B13R1.3420 C=C(C)CSc1cc(nc(c1)Cl)N 62a_200011084131_100000211660 [0,2,0,0,0,1|1,0,0]=4 20864 B13R1.3420 C=C(C)CSc1cc(nc(c1)F)C 62a_100000748629_100010006595 [0,2,0,0,0,1|1,0,0]=4 20865 B13R1.3420 C=C(C)CSc1cc(nc(c1)F)C 62a_100010006595_100000211660 [0,2,0,0,0,1|1,0,0]=4 20866 B13R1.3420 C=C(C)CSc1cc(nc(c1)F)F 62a_100000049587_100000211660 [0,2,0,0,0,1|1,0,0]=4 20867 B13R1.3420 C=C(C)CSc1cc(nc(c1)F)F 62a_100000748629_100000049587 [0,2,0,0,0,1|1,0,0]=4 20868 B13R1.3420 C=C(C)CSc1cc(nc(c1)N)C 62a_100000076705_100000211660 [0,2,0,0,0,1|1,0,0]=4 20869 B13R1.3420 C=C(C)CSc1cc(nc(c1)N)C 62a_100000748629_100000076705 [0,2,0,0,0,1|1,0,0]=4 20870 B13R1.3420 C=C(C)CSc1cc(nc(c1)N)N 62a_100009816676_100000211660 [0,2,0,0,0,1|1,0,0]=4 20871 B13R1.3420 C=C(F)CNc1cc(cc(c1)Br)Br 34a_100012047176_100009893438 [0,2,0,0,0,1|1,0,0]=4 20872 B13R1.3420 C=C(F)CNc1cc(cc(c1)Br)Br 7a_100012047176_100000042424 [0,2,0,0,0,1|1,0,0]=4 20873 B13R1.3420 C=C(F)CNc1cc(cc(c1)Br)C 34a_100000695972_100009893438 [0,2,0,0,0,1|1,0,0]=4 20874 B13R1.3420 C=C(F)CNc1cc(cc(c1)Br)C 7a_100000695972_100000042424 [0,2,0,0,0,1|1,0,0]=4 20875 B13R1.3420 C=C(F)CNc1cc(cc(c1)Br)Cl 34a_100011934539_100009893438 [0,2,0,0,0,1|1,0,0]=4 20876 B13R1.3420 C=C(F)CNc1cc(cc(c1)Br)Cl 7a_100011934539_100000042424 [0,2,0,0,0,1|1,0,0]=4 20877 B13R1.3420 C=C(F)CNc1cc(cc(c1)Br)F 34a_100000705686_100009893438 [0,2,0,0,0,1|1,0,0]=4 20878 B13R1.3420 C=C(F)CNc1cc(cc(c1)Br)F 7a_100000705686_100000042424 [0,2,0,0,0,1|1,0,0]=4 20879 B13R1.3420 C=C(F)CNc1cc(cc(c1)C)C 2230a_100000210930_100009893438 [0,2,0,0,0,1|1,0,0]=4 20880 B13R1.3420 C=C(F)CNc1cc(cc(c1)C)C 34a_100000210930_100009893438 [0,2,0,0,0,1|1,0,0]=4 20881 B13R1.3420 C=C(F)CNc1cc(cc(c1)C)C 7a_100000210930_100000042424 [0,2,0,0,0,1|1,0,0]=4 20882 B13R1.3420 C=C(F)CNc1cc(cc(c1)Cl)C 2230a_100012022512_100009893438 [0,2,0,0,0,1|1,0,0]=4 20883 B13R1.3420 C=C(F)CNc1cc(cc(c1)Cl)C 34a_100012022512_100009893438 [0,2,0,0,0,1|1,0,0]=4 20884 B13R1.3420 C=C(F)CNc1cc(cc(c1)Cl)C 7a_100012022512_100000042424 [0,2,0,0,0,1|1,0,0]=4 20885 B13R1.3420 C=C(F)CNc1cc(cc(c1)Cl)Cl 34a_100000210456_100009893438 [0,2,0,0,0,1|1,0,0]=4 20886 B13R1.3420 C=C(F)CNc1cc(cc(c1)Cl)Cl 7a_100000210456_100000042424 [0,2,0,0,0,1|1,0,0]=4 20887 B13R1.3420 C=C(F)CNc1cc(cc(c1)Cl)F 34a_100000686136_100009893438 [0,2,0,0,0,1|1,0,0]=4 20888 B13R1.3420 C=C(F)CNc1cc(cc(c1)Cl)F 7a_100000686136_100000042424 [0,2,0,0,0,1|1,0,0]=4 20889 B13R1.3420 C=C(F)CNc1cc(cc(c1)Cl)O 34a_100000123917_100009893438 [0,2,0,0,0,1|1,0,0]=4 20890 B13R1.3420 C=C(F)CNc1cc(cc(c1)Cl)O 7a_100000123917_100000042424 [0,2,0,0,0,1|1,0,0]=4 20891 B13R1.3420 C=C(F)CNc1cc(cc(c1)F)C 2230a_100000742734_100009893438 [0,2,0,0,0,1|1,0,0]=4 20892 B13R1.3420 C=C(F)CNc1cc(cc(c1)F)C 34a_100000742734_100009893438 [0,2,0,0,0,1|1,0,0]=4 20893 B13R1.3420 C=C(F)CNc1cc(cc(c1)F)C 7a_100000742734_100000042424 [0,2,0,0,0,1|1,0,0]=4 20894 B13R1.3420 C=C(F)CNc1cc(cc(c1)F)F 34a_100000233717_100009893438 [0,2,0,0,0,1|1,0,0]=4 20895 B13R1.3420 C=C(F)CNc1cc(cc(c1)F)F 7a_100000233717_100000042424 [0,2,0,0,0,1|1,0,0]=4 20896 B13R1.3420 C=C(F)CNc1cc(cc(c1)I)Br 7a_100009814763_100000042424 [0,2,0,0,0,1|1,0,0]=4 20897 B13R1.3420 C=C(F)CNc1cc(cc(c1)I)Cl 7a_100010147676_100000042424 [0,2,0,0,0,1|1,0,0]=4 20898 B13R1.3420 C=C(F)CNc1cc(cc(c1)I)F 34a_100011356972_100009893438 [0,2,0,0,0,1|1,0,0]=4 20899 B13R1.3420 C=C(F)CNc1cc(cc(c1)I)F 7a_100011356972_100000042424 [0,2,0,0,0,1|1,0,0]=4 20900 B13R1.3420 C=C(F)CNc1cc(cc(c1)I)I 7a_200000696836_100000042424 [0,2,0,0,0,1|1,0,0]=4 20901 B13R1.3420 C=C(F)CNc1cc(cc(c1)O)C 34a_100011995906_100009893438 [0,2,0,0,0,1|1,0,0]=4 20902 B13R1.3420 C=C(F)CNc1cc(cc(c1)O)C 7a_100011995906_100000042424 [0,2,0,0,0,1|1,0,0]=4 20903 B13R1.3420 C=C(F)CNc1cc(cc(c1)O)O 34a_100000043371_100009893438 [0,2,0,0,0,1|1,0,0]=4 20904 B13R1.3420 C=C(F)COc1cc(cc(c1)Br)Br 34a_100010167048_100009893438 [0,2,0,0,0,1|1,0,0]=4 20905 B13R1.3420 C=C(F)COc1cc(cc(c1)Br)Br 7a_100010167048_100000042424 [0,2,0,0,0,1|1,0,0]=4 20906 B13R1.3420 C=C(F)COc1cc(cc(c1)Br)C 34a_100011999630_100009893438 [0,2,0,0,0,1|1,0,0]=4 20907 B13R1.3420 C=C(F)COc1cc(cc(c1)Br)C 7a_100011999630_100000042424 [0,2,0,0,0,1|1,0,0]=4 20908 B13R1.3420 C=C(F)COc1cc(cc(c1)Br)Cl 34a_100010185897_100009893438 [0,2,0,0,0,1|1,0,0]=4 20909 B13R1.3420 C=C(F)COc1cc(cc(c1)Br)Cl 7a_100010185897_100000042424 [0,2,0,0,0,1|1,0,0]=4 20910 B13R1.3420 C=C(F)COc1cc(cc(c1)Br)F 34a_100000688818_100009893438 [0,2,0,0,0,1|1,0,0]=4 20911 B13R1.3420 C=C(F)COc1cc(cc(c1)Br)F 7a_100000688818_100000042424 [0,2,0,0,0,1|1,0,0]=4 20912 B13R1.3420 C=C(F)COc1cc(cc(c1)C)C 34a_100000210933_100009893438 [0,2,0,0,0,1|1,0,0]=4 20913 B13R1.3420 C=C(F)COc1cc(cc(c1)C)C 7a_100000210933_100000042424 [0,2,0,0,0,1|1,0,0]=4 20914 B13R1.3420 C=C(F)COc1cc(cc(c1)Cl)C 34a_100000087485_100009893438 [0,2,0,0,0,1|1,0,0]=4 20915 B13R1.3420 C=C(F)COc1cc(cc(c1)Cl)C 7a_100000087485_100000042424 [0,2,0,0,0,1|1,0,0]=4 20916 B13R1.3420 C=C(F)COc1cc(cc(c1)Cl)Cl 34a_100000181315_100009893438 [0,2,0,0,0,1|1,0,0]=4 20917 B13R1.3420 C=C(F)COc1cc(cc(c1)Cl)Cl 7a_100000181315_100000042424 [0,2,0,0,0,1|1,0,0]=4 20918 B13R1.3420 C=C(F)COc1cc(cc(c1)Cl)F 34a_100011219751_100009893438 [0,2,0,0,0,1|1,0,0]=4 20919 B13R1.3420 C=C(F)COc1cc(cc(c1)Cl)F 7a_100011219751_100000042424 [0,2,0,0,0,1|1,0,0]=4 20920 B13R1.3420 C=C(F)COc1cc(cc(c1)Cl)N 34a_100000123917_100009893438 [0,2,0,0,0,1|1,0,0]=4 20921 B13R1.3420 C=C(F)COc1cc(cc(c1)Cl)N 7a_100000123917_100000042424 [0,2,0,0,0,1|1,0,0]=4 20922 B13R1.3420 C=C(F)COc1cc(cc(c1)F)C 34a_100011830401_100009893438 [0,2,0,0,0,1|1,0,0]=4 20923 B13R1.3420 C=C(F)COc1cc(cc(c1)F)C 7a_100011830401_100000042424 [0,2,0,0,0,1|1,0,0]=4 20924 B13R1.3420 C=C(F)COc1cc(cc(c1)F)F 34a_100000747503_100009893438 [0,2,0,0,0,1|1,0,0]=4 20925 B13R1.3420 C=C(F)COc1cc(cc(c1)F)F 7a_100000747503_100000042424 [0,2,0,0,0,1|1,0,0]=4 20926 B13R1.3420 C=C(F)COc1cc(cc(c1)I)Br 34a_100010068917_100009893438 [0,2,0,0,0,1|1,0,0]=4 20927 B13R1.3420 C=C(F)COc1cc(cc(c1)I)Br 7a_100010068917_100000042424 [0,2,0,0,0,1|1,0,0]=4 20928 B13R1.3420 C=C(F)COc1cc(cc(c1)I)Cl 34a_100010068924_100009893438 [0,2,0,0,0,1|1,0,0]=4 20929 B13R1.3420 C=C(F)COc1cc(cc(c1)I)Cl 7a_100010068924_100000042424 [0,2,0,0,0,1|1,0,0]=4 20930 B13R1.3420 C=C(F)COc1cc(cc(c1)I)F 34a_100000717995_100009893438 [0,2,0,0,0,1|1,0,0]=4 20931 B13R1.3420 C=C(F)COc1cc(cc(c1)I)F 7a_100000717995_100000042424 [0,2,0,0,0,1|1,0,0]=4 20932 B13R1.3420 C=C(F)COc1cc(cc(c1)N)C 34a_100011995906_100009893438 [0,2,0,0,0,1|1,0,0]=4 20933 B13R1.3420 C=C(F)COc1cc(cc(c1)N)C 7a_100011995906_100000042424 [0,2,0,0,0,1|1,0,0]=4 20934 B13R1.3420 C=C(F)CSc1cc(cc(c1)Br)Br 62a_100000042424_100009814770 [0,2,0,0,0,1|1,0,0]=4 20935 B13R1.3420 C=C(F)CSc1cc(cc(c1)Br)Br 62a_100009814770_100000042424 [0,2,0,0,0,1|1,0,0]=4 20936 B13R1.3420 C=C(F)CSc1cc(cc(c1)Br)Cl 62a_100000042424_100009814755 [0,2,0,0,0,1|1,0,0]=4 20937 B13R1.3420 C=C(F)CSc1cc(cc(c1)Br)Cl 62a_100009814755_100000042424 [0,2,0,0,0,1|1,0,0]=4 20938 B13R1.3420 C=C(F)CSc1cc(cc(c1)Br)F 62a_100000042424_100009814764 [0,2,0,0,0,1|1,0,0]=4 20939 B13R1.3420 C=C(F)CSc1cc(cc(c1)Br)F 62a_100009814764_100000042424 [0,2,0,0,0,1|1,0,0]=4 20940 B13R1.3420 C=C(F)CSc1cc(cc(c1)Br)N 62a_100000042424_100009814763 [0,2,0,0,0,1|1,0,0]=4 20941 B13R1.3420 C=C(F)CSc1cc(cc(c1)Br)N 62a_100009814763_100000042424 [0,2,0,0,0,1|1,0,0]=4 20942 B13R1.3420 C=C(F)CSc1cc(cc(c1)Br)O 62a_100000042424_100010068917 [0,2,0,0,0,1|1,0,0]=4 20943 B13R1.3420 C=C(F)CSc1cc(cc(c1)Br)O 62a_100010068917_100000042424 [0,2,0,0,0,1|1,0,0]=4 20944 B13R1.3420 C=C(F)CSc1cc(cc(c1)C)C 62a_100000042424_100011215608 [0,2,0,0,0,1|1,0,0]=4 20945 B13R1.3420 C=C(F)CSc1cc(cc(c1)C)C 62a_100011215608_100000042424 [0,2,0,0,0,1|1,0,0]=4 20946 B13R1.3420 C=C(F)CSc1cc(cc(c1)Cl)C 62a_100000042424_100010172791 [0,2,0,0,0,1|1,0,0]=4 20947 B13R1.3420 C=C(F)CSc1cc(cc(c1)Cl)C 62a_100010172791_100000042424 [0,2,0,0,0,1|1,0,0]=4 20948 B13R1.3420 C=C(F)CSc1cc(cc(c1)Cl)Cl 62a_100000042424_100000747138 [0,2,0,0,0,1|1,0,0]=4 20949 B13R1.3420 C=C(F)CSc1cc(cc(c1)Cl)Cl 62a_100000747138_100000042424 [0,2,0,0,0,1|1,0,0]=4 20950 B13R1.3420 C=C(F)CSc1cc(cc(c1)Cl)F 62a_100000042424_100013859453 [0,2,0,0,0,1|1,0,0]=4 20951 B13R1.3420 C=C(F)CSc1cc(cc(c1)Cl)F 62a_100013859453_100000042424 [0,2,0,0,0,1|1,0,0]=4 20952 B13R1.3420 C=C(F)CSc1cc(cc(c1)Cl)N 62a_100000042424_100010147676 [0,2,0,0,0,1|1,0,0]=4 20953 B13R1.3420 C=C(F)CSc1cc(cc(c1)Cl)N 62a_100010147676_100000042424 [0,2,0,0,0,1|1,0,0]=4 20954 B13R1.3420 C=C(F)CSc1cc(cc(c1)Cl)O 62a_100000042424_100010068924 [0,2,0,0,0,1|1,0,0]=4 20955 B13R1.3420 C=C(F)CSc1cc(cc(c1)Cl)O 62a_100010068924_100000042424 [0,2,0,0,0,1|1,0,0]=4 20956 B13R1.3420 C=C(F)CSc1cc(cc(c1)F)C 62a_100000042424_100011356977 [0,2,0,0,0,1|1,0,0]=4 20957 B13R1.3420 C=C(F)CSc1cc(cc(c1)F)C 62a_100011356977_100000042424 [0,2,0,0,0,1|1,0,0]=4 20958 B13R1.3420 C=C(F)CSc1cc(cc(c1)F)F 62a_100000042424_100000233788 [0,2,0,0,0,1|1,0,0]=4 20959 B13R1.3420 C=C(F)CSc1cc(cc(c1)F)F 62a_100000233788_100000042424 [0,2,0,0,0,1|1,0,0]=4 20960 B13R1.3420 C=C(F)CSc1cc(cc(c1)F)N 62a_100000042424_100011356972 [0,2,0,0,0,1|1,0,0]=4 20961 B13R1.3420 C=C(F)CSc1cc(cc(c1)F)N 62a_100011356972_100000042424 [0,2,0,0,0,1|1,0,0]=4 20962 B13R1.3420 C=C(F)CSc1cc(cc(c1)F)O 62a_100000042424_100000688818 [0,2,0,0,0,1|1,0,0]=4 20963 B13R1.3420 C=C(F)CSc1cc(cc(c1)F)O 62a_100000688818_100000042424 [0,2,0,0,0,1|1,0,0]=4 20964 B13R1.3420 C=C(F)CSc1cc(cc(c1)N)C 62a_100000042424_100000695972 [0,2,0,0,0,1|1,0,0]=4 20965 B13R1.3420 C=C(F)CSc1cc(cc(c1)N)C 62a_100000695972_100000042424 [0,2,0,0,0,1|1,0,0]=4 20966 B13R1.3420 C=C(F)CSc1cc(cc(c1)N)N 62a_100000042424_100011999608 [0,2,0,0,0,1|1,0,0]=4 20967 B13R1.3420 C=C(F)CSc1cc(cc(c1)N)N 62a_100011999608_100000042424 [0,2,0,0,0,1|1,0,0]=4 20968 B13R1.3420 C=C(F)CSc1cc(cc(c1)O)C 62a_100000042424_100011999630 [0,2,0,0,0,1|1,0,0]=4 20969 B13R1.3420 C=C(F)CSc1cc(cc(c1)O)O 62a_100000042424_100009868816 [0,2,0,0,0,1|1,0,0]=4 20970 B13R1.3420 CC(=O)CCc1cc(cc(c1)Br)Br 1458a_100010253072_200000210301 [0,2,0,0,0,1|1,0,0]=4 20971 B13R1.3420 CC(=O)CCc1cc(cc(c1)Br)F 1458a_100012357547_200000210301 [0,2,0,0,0,1|1,0,0]=4 20972 B13R1.3420 CC(=O)CCc1cc(cc(c1)C)C 1458a_100000688337_200000210301 [0,2,0,0,0,1|1,0,0]=4 20973 B13R1.3420 CC(=O)CCc1cc(cc(c1)Cl)Cl 1458a_100000070787_100000691793 [0,2,0,0,0,1|1,0,0]=4 20974 B13R1.3420 CC(=O)CCc1cc(cc(c1)Cl)Cl 1458a_100000689174_200000210301 [0,2,0,0,0,1|1,0,0]=4 20975 B13R1.3420 CC(=O)CCc1cc(cc(c1)F)F 1458a_100000070787_100011754442 [0,2,0,0,0,1|1,0,0]=4 20976 B13R1.3420 CC(=O)CCc1cc(cc(c1)F)F 1458a_100011934504_200000210301 [0,2,0,0,0,1|1,0,0]=4 20977 B13R1.3420 CC(=O)COc1cc(cc(c1)Br)Cl 1458a_100010899942_200000210301 [0,2,0,0,0,1|1,0,0]=4 20978 B13R1.3420 CC(=O)COc1cc(cc(c1)C)C 1458a_100000182991_200000210301 [0,2,0,0,0,1|1,0,0]=4 20979 B13R1.3420 CC(=O)COc1cc(cc(c1)Cl)Cl 1458a_100000764634_200000210301 [0,2,0,0,0,1|1,0,0]=4 20980 B13R1.3420 CC(=O)NCc1cc(cc(c1)Br)Br 11a_100015211796_100015343762 [0,2,0,0,0,1|1,0,0]=4 20981 B13R1.3420 CC(=O)NCc1cc(cc(c1)Br)Br 240690a_100015211796_100015343762 [0,2,0,0,0,1|1,0,0]=4 20982 B13R1.3420 CC(=O)NCc1cc(cc(c1)Br)Br 527a_100015211796_100103153847 [0,2,0,0,0,1|1,0,0]=4 20983 B13R1.3420 CC(=O)NCc1cc(cc(c1)Br)F 11a_100020611034_100015343762 [0,2,0,0,0,1|1,0,0]=4 20984 B13R1.3420 CC(=O)NCc1cc(cc(c1)Br)F 1626a_100020611034_100015343762 [0,2,0,0,0,1|1,0,0]=4 20985 B13R1.3420 CC(=O)NCc1cc(cc(c1)Br)F 240690a_100020611034_100015343762 [0,2,0,0,0,1|1,0,0]=4 20986 B13R1.3420 CC(=O)NCc1cc(cc(c1)Br)F 527a_100020611034_100103153847 [0,2,0,0,0,1|1,0,0]=4 20987 B13R1.3420 CC(=O)NCc1cc(cc(c1)C)C 11a_100020591340_100015343762 [0,2,0,0,0,1|1,0,0]=4 20988 B13R1.3420 CC(=O)NCc1cc(cc(c1)C)C 1626a_100020591340_100015343762 [0,2,0,0,0,1|1,0,0]=4 20989 B13R1.3420 CC(=O)NCc1cc(cc(c1)C)C 240690a_100020591340_100015343762 [0,2,0,0,0,1|1,0,0]=4 20990 B13R1.3420 CC(=O)NCc1cc(cc(c1)C)C 527a_100020591340_100103153847 [0,2,0,0,0,1|1,0,0]=4 20991 B13R1.3420 CC(=O)NCc1cc(cc(c1)Cl)Cl 11a_100011211636_100015343762 [0,2,0,0,0,1|1,0,0]=4 20992 B13R1.3420 CC(=O)NCc1cc(cc(c1)Cl)Cl 1626a_100011211636_100015343762 [0,2,0,0,0,1|1,0,0]=4 20993 B13R1.3420 CC(=O)NCc1cc(cc(c1)Cl)Cl 240690a_100011211636_100015343762 [0,2,0,0,0,1|1,0,0]=4 20994 B13R1.3420 CC(=O)NCc1cc(cc(c1)Cl)Cl 527a_100011211636_100103153847 [0,2,0,0,0,1|1,0,0]=4 20995 B13R1.3420 CC(=O)NCc1cc(cc(c1)Cl)F 11a_100137329012_100015343762 [0,2,0,0,0,1|1,0,0]=4 20996 B13R1.3420 CC(=O)NCc1cc(cc(c1)Cl)F 1626a_100137329012_100015343762 [0,2,0,0,0,1|1,0,0]=4 20997 B13R1.3420 CC(=O)NCc1cc(cc(c1)Cl)F 240690a_100137329012_100015343762 [0,2,0,0,0,1|1,0,0]=4 20998 B13R1.3420 CC(=O)NCc1cc(cc(c1)Cl)F 527a_100137329012_100103153847 [0,2,0,0,0,1|1,0,0]=4 20999 B13R1.3420 CC(=O)NCc1cc(cc(c1)Cl)O 240690a_107254831445_100015343762 [0,2,0,0,0,1|1,0,0]=4 21000 B13R1.3420 CC(=O)NCc1cc(cc(c1)Cl)O 527a_107254831445_100103153847 [0,2,0,0,0,1|1,0,0]=4 21001 B13R1.3420 CC(=O)NCc1cc(cc(c1)F)C 11a_100011830484_100015343762 [0,2,0,0,0,1|1,0,0]=4 21002 B13R1.3420 CC(=O)NCc1cc(cc(c1)F)C 1626a_100011830484_100015343762 [0,2,0,0,0,1|1,0,0]=4 21003 B13R1.3420 CC(=O)NCc1cc(cc(c1)F)C 240690a_100011830484_100015343762 [0,2,0,0,0,1|1,0,0]=4 21004 B13R1.3420 CC(=O)NCc1cc(cc(c1)F)C 527a_100011830484_100103153847 [0,2,0,0,0,1|1,0,0]=4 21005 B13R1.3420 CC(=O)NCc1cc(cc(c1)F)F 11a_100000737602_100015343762 [0,2,0,0,0,1|1,0,0]=4 21006 B13R1.3420 CC(=O)NCc1cc(cc(c1)F)F 1626a_100000737602_100015343762 [0,2,0,0,0,1|1,0,0]=4 21007 B13R1.3420 CC(=O)NCc1cc(cc(c1)F)F 240690a_100000737602_100015343762 [0,2,0,0,0,1|1,0,0]=4 21008 B13R1.3420 CC(=O)NCc1cc(cc(c1)F)F 527a_100000737602_100103153847 [0,2,0,0,0,1|1,0,0]=4 21009 B13R1.3420 CC(=O)NCc1cc(cc(c1)F)O 240690a_100160469513_100015343762 [0,2,0,0,0,1|1,0,0]=4 21010 B13R1.3420 CC(=O)NCc1cc(cc(c1)F)O 527a_100160469513_100103153847 [0,2,0,0,0,1|1,0,0]=4 21011 B13R1.3420 CC(=O)NCc1cc(cc(c1)O)O 240690a_100159270720_100015343762 [0,2,0,0,0,1|1,0,0]=4 21012 B13R1.3420 CC(=O)NCc1cc(cc(c1)O)O 527a_100159270720_100103153847 [0,2,0,0,0,1|1,0,0]=4 21013 B13R1.3420 Cc1cc(cc(c1)CCC(=O)[13CH3])C 1458a_100000688337_200025704644 [0,2,0,0,0,1|1,0,0]=4 21014 B13R1.3420 Cc1cc(cc(c1)OCC(=O)[13CH3])C 1458a_100000182991_200025704644 [0,2,0,0,0,1|1,0,0]=4 21015 B13R1.3420 [13CH3]C(=O)CCc1cc(cc(c1)Br)Br 1458a_100010253072_200025704644 [0,2,0,0,0,1|1,0,0]=4 21016 B13R1.3420 [13CH3]C(=O)CCc1cc(cc(c1)Br)F 1458a_100012357547_200025704644 [0,2,0,0,0,1|1,0,0]=4 21017 B13R1.3420 [13CH3]C(=O)CCc1cc(cc(c1)Cl)Cl 1458a_100000689174_200025704644 [0,2,0,0,0,1|1,0,0]=4 21018 B13R1.3420 [13CH3]C(=O)CCc1cc(cc(c1)F)F 1458a_100011934504_200025704644 [0,2,0,0,0,1|1,0,0]=4 21019 B13R1.3420 [13CH3]C(=O)COc1cc(cc(c1)Br)Cl 1458a_100010899942_200025704644 [0,2,0,0,0,1|1,0,0]=4 21020 B13R1.3420 [13CH3]C(=O)COc1cc(cc(c1)Cl)Cl 1458a_100000764634_200025704644 [0,2,0,0,0,1|1,0,0]=4 21021 B13R1.5 C#Cc1ccc(cc1)CC(=O)C=C 1458a_100000185746_100000140223 [0,3,0,0,0,0|1,0,0]=4 21022 B13R1.5 C#Cc1ccc(cc1)CC(=O)CC 1458a_100000210414_100000140223 [0,3,0,0,0,0|1,0,0]=4 21023 B13R1.5 C#Cc1ccc(cc1)CC(=O)CC 1458a_200009884166_100000210202 [0,3,0,0,0,0|1,0,0]=4 21024 B13R1.5 C#Cc1ccc(cc1)CC(=O)CF 1458a_200009884166_100015361967 [0,3,0,0,0,0|1,0,0]=4 21025 B13R1.5 C#Cc1ccc(cc1)CC(=O)CO 1458a_100000210174_100000140223 [0,3,0,0,0,0|1,0,0]=4 21026 B13R1.5 C#Cc1ccc(cc1)CC(=O)NC 11a_106832991635_200009884166 [0,3,0,0,0,0|1,0,0]=4 21027 B13R1.5 C#Cc1ccc(cc1)CC(=O)NC 1626a_100102657272_200009884166 [0,3,0,0,0,0|1,0,0]=4 21028 B13R1.5 C#Cc1ccc(cc1)CC(=O)NC 240690a_100102657272_200009884166 [0,3,0,0,0,0|1,0,0]=4 21029 B13R1.5 C#Cc1ccc(cc1)CC(=O)NC 527a_100102657272_200009884166 [0,3,0,0,0,0|1,0,0]=4 21030 B13R1.5 C=CC(=O)Cc1ccc(cc1)C#N 1458a_100000185746_100000184898 [0,3,0,0,0,0|1,0,0]=4 21031 B13R1.5 C=CC(=O)Cc1ccc(cc1)C=C 1458a_100000185746_100000034074 [0,3,0,0,0,0|1,0,0]=4 21032 B13R1.5 C=CC(=O)Cc1ccc(cc1)C=O 1458a_100000185746_100000075337 [0,3,0,0,0,0|1,0,0]=4 21033 B13R1.5 C=CC(=O)Cc1ccc(cc1)CC 1458a_100000185746_100000747183 [0,3,0,0,0,0|1,0,0]=4 21034 B13R1.5 C=CC(=O)Cc1ccc(cc1)CO 1458a_100000185746_100000067286 [0,3,0,0,0,0|1,0,0]=4 21035 B13R1.5 C=CC(=O)Cc1ccc(cc1)SC 1458a_100000185746_100000181263 [0,3,0,0,0,0|1,0,0]=4 21036 B13R1.5 C=Cc1ccc(cc1)CC(=O)CC 1458a_100000210414_100000034074 [0,3,0,0,0,0|1,0,0]=4 21037 B13R1.5 C=Cc1ccc(cc1)CC(=O)CO 1458a_100000210174_100000034074 [0,3,0,0,0,0|1,0,0]=4 21038 B13R1.5 C=Cc1ccc(cc1)CC(=O)NC 271570a_100011290941_100000155101 [0,3,0,0,0,0|1,0,0]=4 21039 B13R1.5 C=Cc1ccc(cc1)CC(=O)OC 271570a_100011290941_100000149743 [0,3,0,0,0,0|1,0,0]=4 21040 B13R1.5 CCC(=O)Cc1ccc(cc1)C#N 1458a_100000210414_100000184898 [0,3,0,0,0,0|1,0,0]=4 21041 B13R1.5 CCC(=O)Cc1ccc(cc1)C#N 1458a_100000748677_100000210202 [0,3,0,0,0,0|1,0,0]=4 21042 B13R1.5 CCC(=O)Cc1ccc(cc1)C=O 1458a_100000210414_100000075337 [0,3,0,0,0,0|1,0,0]=4 21043 B13R1.5 CCC(=O)Cc1ccc(cc1)CC 1458a_100000210414_100000747183 [0,3,0,0,0,0|1,0,0]=4 21044 B13R1.5 CCC(=O)Cc1ccc(cc1)CC 1458a_200000759805_100000210202 [0,3,0,0,0,0|1,0,0]=4 21045 B13R1.5 CCC(=O)Cc1ccc(cc1)CO 1458a_100000210414_100000067286 [0,3,0,0,0,0|1,0,0]=4 21046 B13R1.5 CCC(=O)Cc1ccc(cc1)CO 1458a_100011356463_100000210202 [0,3,0,0,0,0|1,0,0]=4 21047 B13R1.5 CCC(=O)Cc1ccc(cc1)OC 1458a_100000210706_100000210202 [0,3,0,0,0,0|1,0,0]=4 21048 B13R1.5 CCC(=O)Cc1ccc(cc1)SC 1458a_100000210414_100000181263 [0,3,0,0,0,0|1,0,0]=4 21049 B13R1.5 CCC(=O)Cc1ccc(cc1)SC 1458a_100000756958_100000210202 [0,3,0,0,0,0|1,0,0]=4 21050 B13R1.5 CCc1ccc(cc1)CC(=O)CF 1458a_200000759805_100015361967 [0,3,0,0,0,0|1,0,0]=4 21051 B13R1.5 CCc1ccc(cc1)CC(=O)CO 1458a_100000210174_100000747183 [0,3,0,0,0,0|1,0,0]=4 21052 B13R1.5 CCc1ccc(cc1)CC(=O)NC 11a_106832991635_200000759805 [0,3,0,0,0,0|1,0,0]=4 21053 B13R1.5 CCc1ccc(cc1)CC(=O)NC 1626a_100102657272_200000759805 [0,3,0,0,0,0|1,0,0]=4 21054 B13R1.5 CCc1ccc(cc1)CC(=O)NC 240690a_100102657272_200000759805 [0,3,0,0,0,0|1,0,0]=4 21055 B13R1.5 CCc1ccc(cc1)CC(=O)NC 527a_100102657272_200000759805 [0,3,0,0,0,0|1,0,0]=4 21056 B13R1.5 CNC(=O)Cc1ccc(cc1)C#N 11a_106832991635_100000748677 [0,3,0,0,0,0|1,0,0]=4 21057 B13R1.5 CNC(=O)Cc1ccc(cc1)C#N 1626a_100102657272_100000748677 [0,3,0,0,0,0|1,0,0]=4 21058 B13R1.5 CNC(=O)Cc1ccc(cc1)C#N 240690a_100102657272_100000748677 [0,3,0,0,0,0|1,0,0]=4 21059 B13R1.5 CNC(=O)Cc1ccc(cc1)C#N 527a_100102657272_100000748677 [0,3,0,0,0,0|1,0,0]=4 21060 B13R1.5 CNC(=O)Cc1ccc(cc1)CO 240690a_100102657272_100011356463 [0,3,0,0,0,0|1,0,0]=4 21061 B13R1.5 CNC(=O)Cc1ccc(cc1)NC 2230a_100000736799_200000210301 [0,3,0,0,0,0|1,0,0]=4 21062 B13R1.5 CNC(=O)Cc1ccc(cc1)NC 34a_100000736799_200000210301 [0,3,0,0,0,0|1,0,0]=4 21063 B13R1.5 CNC(=O)Cc1ccc(cc1)N[13CH3] 2230a_100000736799_200025704644 [0,3,0,0,0,0|1,0,0]=4 21064 B13R1.5 CNC(=O)Cc1ccc(cc1)N[13CH3] 34a_100000736799_200025704644 [0,3,0,0,0,0|1,0,0]=4 21065 B13R1.5 CNC(=O)Cc1ccc(cc1)OC 11a_106832991635_100000210706 [0,3,0,0,0,0|1,0,0]=4 21066 B13R1.5 CNC(=O)Cc1ccc(cc1)OC 240690a_100102657272_100000210706 [0,3,0,0,0,0|1,0,0]=4 21067 B13R1.5 CNC(=O)Cc1ccc(cc1)OC 34a_200000020795_200000210301 [0,3,0,0,0,0|1,0,0]=4 21068 B13R1.5 CNC(=O)Cc1ccc(cc1)OC 527a_100102657272_100000210706 [0,3,0,0,0,0|1,0,0]=4 21069 B13R1.5 CNC(=O)Cc1ccc(cc1)O[13CH3] 34a_200000020795_200025704644 [0,3,0,0,0,0|1,0,0]=4 21070 B13R1.5 CNC(=O)Cc1ccc(cc1)SC 11a_106832991635_100000756958 [0,3,0,0,0,0|1,0,0]=4 21071 B13R1.5 CNC(=O)Cc1ccc(cc1)SC 1626a_100102657272_100000756958 [0,3,0,0,0,0|1,0,0]=4 21072 B13R1.5 CNC(=O)Cc1ccc(cc1)SC 240690a_100102657272_100000756958 [0,3,0,0,0,0|1,0,0]=4 21073 B13R1.5 CNC(=O)Cc1ccc(cc1)SC 527a_100102657272_100000756958 [0,3,0,0,0,0|1,0,0]=4 21074 B13R1.5 CNC(=O)Cc1ccc(cc1)SC 62a_100000155101_200000210301 [0,3,0,0,0,0|1,0,0]=4 21075 B13R1.5 CNC(=O)Cc1ccc(cc1)SC 62a_200000210301_100000155101 [0,3,0,0,0,0|1,0,0]=4 21076 B13R1.5 CNC(=O)Cc1ccc(cc1)S[13CH3] 62a_100000155101_200025704644 [0,3,0,0,0,0|1,0,0]=4 21077 B13R1.5 CNC(=O)Cc1ccc(cc1)S[13CH3] 62a_200025704644_100000155101 [0,3,0,0,0,0|1,0,0]=4 21078 B13R1.5 COC(=O)Cc1ccc(cc1)OC 34a_100000211648_200000210301 [0,3,0,0,0,0|1,0,0]=4 21079 B13R1.5 COC(=O)Cc1ccc(cc1)O[13CH3] 34a_100000211648_200025704644 [0,3,0,0,0,0|1,0,0]=4 21080 B13R1.5 COC(=O)Cc1ccc(cc1)SC 62a_100000149743_200000210301 [0,3,0,0,0,0|1,0,0]=4 21081 B13R1.5 COC(=O)Cc1ccc(cc1)SC 62a_200000210301_100000149743 [0,3,0,0,0,0|1,0,0]=4 21082 B13R1.5 COC(=O)Cc1ccc(cc1)S[13CH3] 62a_100000149743_200025704644 [0,3,0,0,0,0|1,0,0]=4 21083 B13R1.5 COC(=O)Cc1ccc(cc1)S[13CH3] 62a_200025704644_100000149743 [0,3,0,0,0,0|1,0,0]=4 21084 B13R1.5 COc1ccc(cc1)CC(=O)CF 1458a_100000210706_100015361967 [0,3,0,0,0,0|1,0,0]=4 21085 B13R1.5 CSc1ccc(cc1)CC(=O)CF 1458a_100000756958_100015361967 [0,3,0,0,0,0|1,0,0]=4 21086 B13R1.5 CSc1ccc(cc1)CC(=O)CO 1458a_100000210174_100000181263 [0,3,0,0,0,0|1,0,0]=4 21087 B13R1.5 N#Cc1ccc(cc1)CC(=O)CF 1458a_100000748677_100015361967 [0,3,0,0,0,0|1,0,0]=4 21088 B13R1.5 N#Cc1ccc(cc1)CC(=O)CO 1458a_100000210174_100000184898 [0,3,0,0,0,0|1,0,0]=4 21089 B13R1.5 O=C(CF)Cc1ccc(cc1)CO 1458a_100011356463_100015361967 [0,3,0,0,0,0|1,0,0]=4 21090 B13R1.5 O=C(CO)Cc1ccc(cc1)CO 1458a_100000210174_100000067286 [0,3,0,0,0,0|1,0,0]=4 21091 B13R1.5 O=Cc1ccc(cc1)CC(=O)CO 1458a_100000210174_100000075337 [0,3,0,0,0,0|1,0,0]=4 21092 B13R1.35 CC(=O)Cc1ccc(c(c1)Br)C#N 1458a_100000070787_100012355662 [0,3,0,0,0,0|1,0,0]=4 21093 B13R1.35 CC(=O)Cc1ccc(c(c1)Br)O[13CH3] 34a_100010141077_200025704644 [0,3,0,0,0,0|1,0,0]=4 21094 B13R1.35 CC(=O)Cc1ccc(c(c1)Br)O[13CH3] 7a_100010141077_200025704644 [0,3,0,0,0,0|1,0,0]=4 21095 B13R1.35 CC(=O)Cc1ccc(c(c1)C)O[13CH3] 34a_200000080089_200025704644 [0,3,0,0,0,0|1,0,0]=4 21096 B13R1.35 CC(=O)Cc1ccc(c(c1)C)O[13CH3] 7a_200000080089_200025704644 [0,3,0,0,0,0|1,0,0]=4 21097 B13R1.35 CC(=O)Cc1ccc(c(c1)Cl)C#N 1458a_100000070787_100010147163 [0,3,0,0,0,0|1,0,0]=4 21098 B13R1.35 CC(=O)Cc1ccc(c(c1)Cl)O[13CH3] 34a_200000080078_200025704644 [0,3,0,0,0,0|1,0,0]=4 21099 B13R1.35 CC(=O)Cc1ccc(c(c1)Cl)O[13CH3] 7a_200000080078_200025704644 [0,3,0,0,0,0|1,0,0]=4 21100 B13R1.35 CC(=O)Cc1ccc(c(c1)F)C#N 1458a_100000070787_100011217145 [0,3,0,0,0,0|1,0,0]=4 21101 B13R1.35 CC(=O)Cc1ccc(c(c1)F)C#N 1458a_100009864126_200000210301 [0,3,0,0,0,0|1,0,0]=4 21102 B13R1.35 CC(=O)Cc1ccc(c(c1)F)C=O 1458a_100000070787_100010142638 [0,3,0,0,0,0|1,0,0]=4 21103 B13R1.35 COc1ccc(cc1Br)CC(=O)C 1458a_100000070787_200011397701 [0,3,0,0,0,0|1,0,0]=4 21104 B13R1.35 COc1ccc(cc1Br)CC(=O)C 1458a_100011202338_200000210301 [0,3,0,0,0,0|1,0,0]=4 21105 B13R1.35 COc1ccc(cc1Br)CC(=O)C 34a_100010141077_200000210301 [0,3,0,0,0,0|1,0,0]=4 21106 B13R1.35 COc1ccc(cc1Br)CC(=O)C 7a_100010141077_200000210301 [0,3,0,0,0,0|1,0,0]=4 21107 B13R1.35 COc1ccc(cc1Br)CC(=O)[13CH3] 1458a_100011202338_200025704644 [0,3,0,0,0,0|1,0,0]=4 21108 B13R1.35 COc1ccc(cc1C)CC(=O)C 1458a_100000070787_200011290836 [0,3,0,0,0,0|1,0,0]=4 21109 B13R1.35 COc1ccc(cc1C)CC(=O)C 1458a_100011356478_200000210301 [0,3,0,0,0,0|1,0,0]=4 21110 B13R1.35 COc1ccc(cc1C)CC(=O)C 34a_200000080089_200000210301 [0,3,0,0,0,0|1,0,0]=4 21111 B13R1.35 COc1ccc(cc1C)CC(=O)C 7a_200000080089_200000210301 [0,3,0,0,0,0|1,0,0]=4 21112 B13R1.35 COc1ccc(cc1C)CC(=O)[13CH3] 1458a_100011356478_200025704644 [0,3,0,0,0,0|1,0,0]=4 21113 B13R1.35 COc1ccc(cc1Cl)CC(=O)C 1458a_100000070787_100000693707 [0,3,0,0,0,0|1,0,0]=4 21114 B13R1.35 COc1ccc(cc1Cl)CC(=O)C 1458a_100012026953_200000210301 [0,3,0,0,0,0|1,0,0]=4 21115 B13R1.35 COc1ccc(cc1Cl)CC(=O)C 34a_200000080078_200000210301 [0,3,0,0,0,0|1,0,0]=4 21116 B13R1.35 COc1ccc(cc1Cl)CC(=O)C 7a_200000080078_200000210301 [0,3,0,0,0,0|1,0,0]=4 21117 B13R1.35 COc1ccc(cc1Cl)CC(=O)[13CH3] 1458a_100012026953_200025704644 [0,3,0,0,0,0|1,0,0]=4 21118 B13R1.35 COc1ccc(cc1F)CC(=O)C 1458a_100000070787_100000189595 [0,3,0,0,0,0|1,0,0]=4 21119 B13R1.35 COc1ccc(cc1F)CC(=O)C 1458a_100000204603_200000210301 [0,3,0,0,0,0|1,0,0]=4 21120 B13R1.35 COc1ccc(cc1F)CC(=O)[13CH3] 1458a_100000204603_200025704644 [0,3,0,0,0,0|1,0,0]=4 21121 B13R1.35 COc1ccc(cc1O)CC(=O)C 1458a_100000049095_200000210301 [0,3,0,0,0,0|1,0,0]=4 21122 B13R1.35 COc1ccc(cc1O)CC(=O)C 271570a_203496583355_100011493462 [0,3,0,0,0,0|1,0,0]=4 21123 B13R1.35 COc1ccc(cc1O)CC(=O)[13CH3] 1458a_100000049095_200025704644 [0,3,0,0,0,0|1,0,0]=4 21124 B13R1.35 [13CH3]C(=O)Cc1ccc(c(c1)F)C#N 1458a_100009864126_200025704644 [0,3,0,0,0,0|1,0,0]=4 21125 B13R1.36 COc1ccc(cc1)C(C)C(=O)C 1458a_100000753396_200000210301 [0,3,0,0,0,0|1,0,0]=4 21126 B13R1.36 COc1ccc(cc1)C(C)C(=O)[13CH3] 1458a_100000753396_200025704644 [0,3,0,0,0,0|1,0,0]=4 21127 B13R1.36 COc1ccc(cc1)C(O)C(=O)C 1458a_100011218652_200000210301 [0,3,0,0,0,0|1,0,0]=4 21128 B13R1.36 COc1ccc(cc1)C(O)C(=O)[13CH3] 1458a_100011218652_200025704644 [0,3,0,0,0,0|1,0,0]=4 21129 B13R1.142 C=C=Cc1ccc(cc1)CC(=O)C 271570a_100015277604_100000691760 [0,3,0,0,0,0|1,0,0]=4 21130 B13R1.142 CC(=O)Cc1ccc(cc1)N=[N+]=[N-] 1458a_100010395652_200000210301 [0,3,0,0,0,0|1,0,0]=4 21131 B13R1.142 CC(=O)Cc1ccc(cc1)OCF 34a_100011218180_100015361967 [0,3,0,0,0,0|1,0,0]=4 21132 B13R1.142 CC(=O)Cc1ccc(cc1)OCF 7a_100011218180_100015361967 [0,3,0,0,0,0|1,0,0]=4 21133 B13R1.142 CC(=O)Cc1ccc(cc1)SCF 62a_100000691760_100015361967 [0,3,0,0,0,0|1,0,0]=4 21134 B13R1.142 CC(=O)Cc1ccc(cc1)SCF 62a_100015361967_100000691760 [0,3,0,0,0,0|1,0,0]=4 21135 B13R1.142 CC=Cc1ccc(cc1)CC(=O)C 271570a_100016259895_100000691760 [0,3,0,0,0,0|1,0,0]=4 21136 B13R1.142 CCCc1ccc(cc1)CC(=O)C 1458a_100000070787_100011982809 [0,3,0,0,0,0|1,0,0]=4 21137 B13R1.142 CCCc1ccc(cc1)CC(=O)C 1458a_100000186164_200000210301 [0,3,0,0,0,0|1,0,0]=4 21138 B13R1.142 CCCc1ccc(cc1)CC(=O)[13CH3] 1458a_100000186164_200025704644 [0,3,0,0,0,0|1,0,0]=4 21139 B13R1.142 CCOc1ccc(cc1)CC(=O)C 1458a_100000183096_200000210301 [0,3,0,0,0,0|1,0,0]=4 21140 B13R1.142 CCOc1ccc(cc1)CC(=O)C 34a_100011218180_100000210202 [0,3,0,0,0,0|1,0,0]=4 21141 B13R1.142 CCOc1ccc(cc1)CC(=O)C 7a_100011218180_100000210202 [0,3,0,0,0,0|1,0,0]=4 21142 B13R1.142 CCOc1ccc(cc1)CC(=O)[13CH3] 1458a_100000183096_200025704644 [0,3,0,0,0,0|1,0,0]=4 21143 B13R1.142 CCSc1ccc(cc1)CC(=O)C 62a_100000210202_100000691760 [0,3,0,0,0,0|1,0,0]=4 21144 B13R1.142 CCSc1ccc(cc1)CC(=O)C 62a_100000691760_100000210202 [0,3,0,0,0,0|1,0,0]=4 21145 B13R1.142 COCc1ccc(cc1)CC(=O)C 1458a_100011290826_200000210301 [0,3,0,0,0,0|1,0,0]=4 21146 B13R1.142 COCc1ccc(cc1)CC(=O)[13CH3] 1458a_100011290826_200025704644 [0,3,0,0,0,0|1,0,0]=4 21147 B13R1.142 [13CH3]C(=O)Cc1ccc(cc1)N=[N+]=[N-] 1458a_100010395652_200025704644 [0,3,0,0,0,0|1,0,0]=4 21148 B13R1.585 C=C(C)c1ccc(cc1)CC(=O)C 271570a_100000694244_100000691760 [0,3,0,0,0,0|1,0,0]=4 21149 B13R1.585 CC(=O)Cc1ccc(cc1)B(O)O 1458a_100000070787_100009813762 [0,3,0,0,0,0|1,0,0]=4 21150 B13R1.585 CC(=O)Cc1ccc(cc1)C(=O)C 1458a_100000070787_100000756337 [0,3,0,0,0,0|1,0,0]=4 21151 B13R1.585 CC(=O)Cc1ccc(cc1)C(=O)N 1458a_100000070787_100000231043 [0,3,0,0,0,0|1,0,0]=4 21152 B13R1.585 CC(=O)Cc1ccc(cc1)C(C)C 1458a_100000070787_100000181262 [0,3,0,0,0,0|1,0,0]=4 21153 B13R1.585 CC(=O)Cc1ccc(cc1)C(C)C 1458a_100000689720_200000210301 [0,3,0,0,0,0|1,0,0]=4 21154 B13R1.585 CC(=O)Cc1ccc(cc1)C(F)F 1458a_100000070787_200012343607 [0,3,0,0,0,0|1,0,0]=4 21155 B13R1.585 CC(=O)Cc1ccc(cc1)N(C)C 1458a_100011218386_200000210301 [0,3,0,0,0,0|1,0,0]=4 21156 B13R1.585 CC(=O)Cc1ccc(cc1)[N+](=O)[O-] 1458a_100000070787_100000181861 [0,3,0,0,0,0|1,0,0]=4 21157 B13R1.585 CC(=O)Cc1ccc(cc1)[N+](=O)[O-] 1458a_100000210908_200000210301 [0,3,0,0,0,0|1,0,0]=4 21158 B13R1.585 CC(C)c1ccc(cc1)CC(=O)[13CH3] 1458a_100000689720_200025704644 [0,3,0,0,0,0|1,0,0]=4 21159 B13R1.585 CN(C)c1ccc(cc1)CC(=O)[13CH3] 1458a_100011218386_200025704644 [0,3,0,0,0,0|1,0,0]=4 21160 B13R1.585 [13CH3]C(=O)Cc1ccc(cc1)[N+](=O)[O-] 1458a_100000210908_200025704644 [0,3,0,0,0,0|1,0,0]=4 21161 B13R1.653 CC(=O)Cc1ccc(cc1Br)C#N 1458a_100000070787_100000694769 [0,3,0,0,0,0|1,0,0]=4 21162 B13R1.653 CC(=O)Cc1ccc(cc1Cl)C#N 1458a_100000070787_100000709902 [0,3,0,0,0,0|1,0,0]=4 21163 B13R1.653 CC(=O)Cc1ccc(cc1Cl)O[13CH3] 34a_200000084595_200025704644 [0,3,0,0,0,0|1,0,0]=4 21164 B13R1.653 CC(=O)Cc1ccc(cc1Cl)O[13CH3] 7a_200000084595_200025704644 [0,3,0,0,0,0|1,0,0]=4 21165 B13R1.653 CC(=O)Cc1ccc(cc1F)C#N 1458a_100000070787_100000239720 [0,3,0,0,0,0|1,0,0]=4 21166 B13R1.653 CC(=O)Cc1ccc(cc1I)C#N 1458a_100000070787_100010079267 [0,3,0,0,0,0|1,0,0]=4 21167 B13R1.653 COc1ccc(c(c1)Br)CC(=O)C 1458a_100000070787_100011982828 [0,3,0,0,0,0|1,0,0]=4 21168 B13R1.653 COc1ccc(c(c1)Br)CC(=O)C 1458a_100000238646_200000210301 [0,3,0,0,0,0|1,0,0]=4 21169 B13R1.653 COc1ccc(c(c1)Br)CC(=O)[13CH3] 1458a_100000238646_200025704644 [0,3,0,0,0,0|1,0,0]=4 21170 B13R1.653 COc1ccc(c(c1)C)CC(=O)C 1458a_100011996676_200000210301 [0,3,0,0,0,0|1,0,0]=4 21171 B13R1.653 COc1ccc(c(c1)C)CC(=O)[13CH3] 1458a_100011996676_200025704644 [0,3,0,0,0,0|1,0,0]=4 21172 B13R1.653 COc1ccc(c(c1)Cl)CC(=O)C 1458a_100000070787_200011830453 [0,3,0,0,0,0|1,0,0]=4 21173 B13R1.653 COc1ccc(c(c1)Cl)CC(=O)C 1458a_100000688043_200000210301 [0,3,0,0,0,0|1,0,0]=4 21174 B13R1.653 COc1ccc(c(c1)Cl)CC(=O)C 34a_200000084595_200000210301 [0,3,0,0,0,0|1,0,0]=4 21175 B13R1.653 COc1ccc(c(c1)Cl)CC(=O)C 7a_200000084595_200000210301 [0,3,0,0,0,0|1,0,0]=4 21176 B13R1.653 COc1ccc(c(c1)Cl)CC(=O)[13CH3] 1458a_100000688043_200025704644 [0,3,0,0,0,0|1,0,0]=4 21177 B13R1.653 COc1ccc(c(c1)F)CC(=O)C 1458a_100000070787_100011260761 [0,3,0,0,0,0|1,0,0]=4 21178 B13R1.653 COc1ccc(c(c1)F)CC(=O)C 1458a_100000709196_200000210301 [0,3,0,0,0,0|1,0,0]=4 21179 B13R1.653 COc1ccc(c(c1)F)CC(=O)[13CH3] 1458a_100000709196_200025704644 [0,3,0,0,0,0|1,0,0]=4 21180 B13R1.52 C=Cc1cc(ccc1O)CC(=O)C 271570a_100011290941_100010141077 [0,3,0,0,0,0|1,0,0]=4 21181 B13R1.52 CC(=O)Cc1ccc(c(c1)C#N)Br 1458a_100000070787_100010128727 [0,3,0,0,0,0|1,0,0]=4 21182 B13R1.52 CC(=O)Cc1ccc(c(c1)C#N)Cl 1458a_100000070787_100010147165 [0,3,0,0,0,0|1,0,0]=4 21183 B13R1.52 CC(=O)Cc1ccc(c(c1)C#N)F 1458a_100000070787_100000687583 [0,3,0,0,0,0|1,0,0]=4 21184 B13R1.52 CC(=O)Cc1ccc(c(c1)C#N)F 1458a_100011218018_200000210301 [0,3,0,0,0,0|1,0,0]=4 21185 B13R1.52 CC(=O)Cc1ccc(c(c1)S[13CH3])O 62a_100010141077_200025704644 [0,3,0,0,0,0|1,0,0]=4 21186 B13R1.52 CC(=O)Cc1ccc(c(c1)S[13CH3])O 62a_200025704644_100010141077 [0,3,0,0,0,0|1,0,0]=4 21187 B13R1.52 COc1cc(ccc1Br)CC(=O)C 1458a_100000070787_100010110085 [0,3,0,0,0,0|1,0,0]=4 21188 B13R1.52 COc1cc(ccc1Br)CC(=O)C 1458a_200010002685_200000210301 [0,3,0,0,0,0|1,0,0]=4 21189 B13R1.52 COc1cc(ccc1Br)CC(=O)[13CH3] 1458a_200010002685_200025704644 [0,3,0,0,0,0|1,0,0]=4 21190 B13R1.52 COc1cc(ccc1Cl)CC(=O)C 1458a_100000070787_200010214485 [0,3,0,0,0,0|1,0,0]=4 21191 B13R1.52 COc1cc(ccc1F)CC(=O)C 1458a_100000070787_100012349856 [0,3,0,0,0,0|1,0,0]=4 21192 B13R1.52 COc1cc(ccc1F)CC(=O)C 1458a_100000117344_200000210301 [0,3,0,0,0,0|1,0,0]=4 21193 B13R1.52 COc1cc(ccc1F)CC(=O)[13CH3] 1458a_100000117344_200025704644 [0,3,0,0,0,0|1,0,0]=4 21194 B13R1.52 COc1cc(ccc1O)CC(=O)C 1458a_100000032101_200000210301 [0,3,0,0,0,0|1,0,0]=4 21195 B13R1.52 COc1cc(ccc1O)CC(=O)[13CH3] 1458a_100000032101_200025704644 [0,3,0,0,0,0|1,0,0]=4 21196 B13R1.52 CSc1cc(ccc1O)CC(=O)C 62a_100010141077_200000210301 [0,3,0,0,0,0|1,0,0]=4 21197 B13R1.52 CSc1cc(ccc1O)CC(=O)C 62a_200000210301_100010141077 [0,3,0,0,0,0|1,0,0]=4 21198 B13R1.52 [13CH3]C(=O)Cc1ccc(c(c1)C#N)F 1458a_100011218018_200025704644 [0,3,0,0,0,0|1,0,0]=4 21199 B13R1.510 CC(=O)C(O)c1ccc(c(c1)F)F 1458a_100011217530_200000210301 [0,3,0,0,0,0|1,0,0]=4 21200 B13R1.510 CC(=O)C(O)c1ccc(c(c1)O)O 1458a_200000032065_200000210301 [0,3,0,0,0,0|1,0,0]=4 21201 B13R1.510 [13CH3]C(=O)C(O)c1ccc(c(c1)F)F 1458a_100011217530_200025704644 [0,3,0,0,0,0|1,0,0]=4 21202 B13R1.510 [13CH3]C(=O)C(O)c1ccc(c(c1)O)O 1458a_200000032065_200025704644 [0,3,0,0,0,0|1,0,0]=4 21203 B13R1.876 CC(=O)Cc1cc(c(cc1Br)F)F 1458a_100000070787_100010077255 [0,3,0,0,0,0|1,0,0]=4 21204 B13R1.876 CC(=O)Cc1cc(c(cc1Br)F)F 1458a_100009828490_200000210301 [0,3,0,0,0,0|1,0,0]=4 21205 B13R1.876 CC(=O)Cc1cc(c(cc1Cl)Cl)Cl 1458a_100000070787_100010220947 [0,3,0,0,0,0|1,0,0]=4 21206 B13R1.876 CC(=O)Cc1cc(c(cc1Cl)Cl)F 1458a_100000070787_100009813697 [0,3,0,0,0,0|1,0,0]=4 21207 B13R1.876 CC(=O)Cc1cc(c(cc1Cl)Cl)F 1458a_100011219564_200000210301 [0,3,0,0,0,0|1,0,0]=4 21208 B13R1.876 CC(=O)Cc1cc(c(cc1Cl)F)F 1458a_100000062174_200000210301 [0,3,0,0,0,0|1,0,0]=4 21209 B13R1.876 CC(=O)Cc1cc(c(cc1Cl)F)F 1458a_100000070787_100011830393 [0,3,0,0,0,0|1,0,0]=4 21210 B13R1.876 CC(=O)Cc1cc(c(cc1F)Br)F 1458a_100000070787_100012024439 [0,3,0,0,0,0|1,0,0]=4 21211 B13R1.876 CC(=O)Cc1cc(c(cc1F)Br)F 1458a_100010245136_200000210301 [0,3,0,0,0,0|1,0,0]=4 21212 B13R1.876 CC(=O)Cc1cc(c(cc1F)Cl)F 1458a_100000070787_200012361342 [0,3,0,0,0,0|1,0,0]=4 21213 B13R1.876 CC(=O)Cc1cc(c(cc1F)F)C 1458a_100000070787_100012347589 [0,3,0,0,0,0|1,0,0]=4 21214 B13R1.876 CC(=O)Cc1cc(c(cc1F)F)Cl 1458a_100000070787_100010994231 [0,3,0,0,0,0|1,0,0]=4 21215 B13R1.876 CC(=O)Cc1cc(c(cc1F)F)Cl 1458a_100010154639_200000210301 [0,3,0,0,0,0|1,0,0]=4 21216 B13R1.876 CC(=O)Cc1cc(c(cc1F)F)F 1458a_100000070787_100011218792 [0,3,0,0,0,0|1,0,0]=4 21217 B13R1.876 CC(=O)Cc1cc(c(cc1F)F)F 1458a_100000690282_200000210301 [0,3,0,0,0,0|1,0,0]=4 21218 B13R1.876 CC(=O)Cc1cc(c(cc1F)F)I 1458a_100000070787_100019984567 [0,3,0,0,0,0|1,0,0]=4 21219 B13R1.876 [13CH3]C(=O)Cc1cc(c(cc1Br)F)F 1458a_100009828490_200025704644 [0,3,0,0,0,0|1,0,0]=4 21220 B13R1.876 [13CH3]C(=O)Cc1cc(c(cc1Cl)Cl)F 1458a_100011219564_200025704644 [0,3,0,0,0,0|1,0,0]=4 21221 B13R1.876 [13CH3]C(=O)Cc1cc(c(cc1Cl)F)F 1458a_100000062174_200025704644 [0,3,0,0,0,0|1,0,0]=4 21222 B13R1.876 [13CH3]C(=O)Cc1cc(c(cc1F)Br)F 1458a_100010245136_200025704644 [0,3,0,0,0,0|1,0,0]=4 21223 B13R1.876 [13CH3]C(=O)Cc1cc(c(cc1F)F)Cl 1458a_100010154639_200025704644 [0,3,0,0,0,0|1,0,0]=4 21224 B13R1.876 [13CH3]C(=O)Cc1cc(c(cc1F)F)F 1458a_100000690282_200025704644 [0,3,0,0,0,0|1,0,0]=4 21225 B13R1.2879 C=CC(=O)Cc1ccc(c(c1)Br)Br 1458a_100000185746_100012353900 [0,3,0,0,0,0|1,0,0]=4 21226 B13R1.2879 C=CC(=O)Cc1ccc(c(c1)Br)C 1458a_100000185746_100012232412 [0,3,0,0,0,0|1,0,0]=4 21227 B13R1.2879 C=CC(=O)Cc1ccc(c(c1)Br)Cl 1458a_100000185746_100012353894 [0,3,0,0,0,0|1,0,0]=4 21228 B13R1.2879 C=CC(=O)Cc1ccc(c(c1)Br)F 1458a_100000185746_100011206884 [0,3,0,0,0,0|1,0,0]=4 21229 B13R1.2879 C=CC(=O)Cc1ccc(c(c1)C)Br 1458a_100000185746_100000727479 [0,3,0,0,0,0|1,0,0]=4 21230 B13R1.2879 C=CC(=O)Cc1ccc(c(c1)C)C 1458a_100000185746_100000742320 [0,3,0,0,0,0|1,0,0]=4 21231 B13R1.2879 C=CC(=O)Cc1ccc(c(c1)C)Cl 1458a_100000185746_100012184735 [0,3,0,0,0,0|1,0,0]=4 21232 B13R1.2879 C=CC(=O)Cc1ccc(c(c1)C)F 1458a_100000185746_100011216667 [0,3,0,0,0,0|1,0,0]=4 21233 B13R1.2879 C=CC(=O)Cc1ccc(c(c1)Cl)Br 1458a_100000185746_100012353895 [0,3,0,0,0,0|1,0,0]=4 21234 B13R1.2879 C=CC(=O)Cc1ccc(c(c1)Cl)C 1458a_100000185746_100011823929 [0,3,0,0,0,0|1,0,0]=4 21235 B13R1.2879 C=CC(=O)Cc1ccc(c(c1)Cl)Cl 1458a_100000185746_100000184707 [0,3,0,0,0,0|1,0,0]=4 21236 B13R1.2879 C=CC(=O)Cc1ccc(c(c1)Cl)F 1458a_100000185746_100000717365 [0,3,0,0,0,0|1,0,0]=4 21237 B13R1.2879 C=CC(=O)Cc1ccc(c(c1)Cl)I 1458a_100000185746_100012349665 [0,3,0,0,0,0|1,0,0]=4 21238 B13R1.2879 C=CC(=O)Cc1ccc(c(c1)F)Br 1458a_100000185746_100000767054 [0,3,0,0,0,0|1,0,0]=4 21239 B13R1.2879 C=CC(=O)Cc1ccc(c(c1)F)C 1458a_100000185746_100011217369 [0,3,0,0,0,0|1,0,0]=4 21240 B13R1.2879 C=CC(=O)Cc1ccc(c(c1)F)Cl 1458a_100000185746_100000716492 [0,3,0,0,0,0|1,0,0]=4 21241 B13R1.2879 C=CC(=O)Cc1ccc(c(c1)F)F 1458a_100000185746_100000757363 [0,3,0,0,0,0|1,0,0]=4 21242 B13R1.2879 C=CC(=O)Cc1ccc(c(c1)F)I 1458a_100000185746_100010149604 [0,3,0,0,0,0|1,0,0]=4 21243 B13R1.2879 C=CC(=O)Cc1ccc(c(c1)I)Br 1458a_100000185746_100010146616 [0,3,0,0,0,0|1,0,0]=4 21244 B13R1.2879 C=CC(=O)Cc1ccc(c(c1)I)C 1458a_100000185746_100010206137 [0,3,0,0,0,0|1,0,0]=4 21245 B13R1.2879 C=CC(=O)Cc1ccc(c(c1)I)F 1458a_100000185746_100010188208 [0,3,0,0,0,0|1,0,0]=4 21246 B13R1.2879 CCC(=O)Cc1ccc(c(c1)Br)Br 1458a_100000210414_100012353900 [0,3,0,0,0,0|1,0,0]=4 21247 B13R1.2879 CCC(=O)Cc1ccc(c(c1)Br)C 1458a_100000210414_100012232412 [0,3,0,0,0,0|1,0,0]=4 21248 B13R1.2879 CCC(=O)Cc1ccc(c(c1)Br)C 1458a_100000709925_100000210202 [0,3,0,0,0,0|1,0,0]=4 21249 B13R1.2879 CCC(=O)Cc1ccc(c(c1)Br)Cl 1458a_100000210414_100012353894 [0,3,0,0,0,0|1,0,0]=4 21250 B13R1.2879 CCC(=O)Cc1ccc(c(c1)Br)Cl 1458a_100012349508_100000210202 [0,3,0,0,0,0|1,0,0]=4 21251 B13R1.2879 CCC(=O)Cc1ccc(c(c1)Br)F 1458a_100000210414_100011206884 [0,3,0,0,0,0|1,0,0]=4 21252 B13R1.2879 CCC(=O)Cc1ccc(c(c1)Br)F 1458a_100000742997_100000210202 [0,3,0,0,0,0|1,0,0]=4 21253 B13R1.2879 CCC(=O)Cc1ccc(c(c1)Br)O 1458a_100009990404_100000210202 [0,3,0,0,0,0|1,0,0]=4 21254 B13R1.2879 CCC(=O)Cc1ccc(c(c1)C)Br 1458a_100000210414_100000727479 [0,3,0,0,0,0|1,0,0]=4 21255 B13R1.2879 CCC(=O)Cc1ccc(c(c1)C)Br 1458a_100012340274_100000210202 [0,3,0,0,0,0|1,0,0]=4 21256 B13R1.2879 CCC(=O)Cc1ccc(c(c1)C)C 1458a_100000184070_100000210202 [0,3,0,0,0,0|1,0,0]=4 21257 B13R1.2879 CCC(=O)Cc1ccc(c(c1)C)C 1458a_100000210414_100000742320 [0,3,0,0,0,0|1,0,0]=4 21258 B13R1.2879 CCC(=O)Cc1ccc(c(c1)C)Cl 1458a_100000210414_100012184735 [0,3,0,0,0,0|1,0,0]=4 21259 B13R1.2879 CCC(=O)Cc1ccc(c(c1)C)F 1458a_100000210414_100011216667 [0,3,0,0,0,0|1,0,0]=4 21260 B13R1.2879 CCC(=O)Cc1ccc(c(c1)C)F 1458a_100011667458_100000210202 [0,3,0,0,0,0|1,0,0]=4 21261 B13R1.2879 CCC(=O)Cc1ccc(c(c1)C)O 1458a_100000083968_100000210202 [0,3,0,0,0,0|1,0,0]=4 21262 B13R1.2879 CCC(=O)Cc1ccc(c(c1)Cl)Br 1458a_100000210414_100012353895 [0,3,0,0,0,0|1,0,0]=4 21263 B13R1.2879 CCC(=O)Cc1ccc(c(c1)Cl)Br 1458a_100000766880_100000210202 [0,3,0,0,0,0|1,0,0]=4 21264 B13R1.2879 CCC(=O)Cc1ccc(c(c1)Cl)C 1458a_100000210414_100011823929 [0,3,0,0,0,0|1,0,0]=4 21265 B13R1.2879 CCC(=O)Cc1ccc(c(c1)Cl)Cl 1458a_100000210414_100000184707 [0,3,0,0,0,0|1,0,0]=4 21266 B13R1.2879 CCC(=O)Cc1ccc(c(c1)Cl)Cl 1458a_100000210702_100000210202 [0,3,0,0,0,0|1,0,0]=4 21267 B13R1.2879 CCC(=O)Cc1ccc(c(c1)Cl)F 1458a_100000210414_100000717365 [0,3,0,0,0,0|1,0,0]=4 21268 B13R1.2879 CCC(=O)Cc1ccc(c(c1)Cl)F 1458a_100011217296_100000210202 [0,3,0,0,0,0|1,0,0]=4 21269 B13R1.2879 CCC(=O)Cc1ccc(c(c1)Cl)I 1458a_100000210414_100012349665 [0,3,0,0,0,0|1,0,0]=4 21270 B13R1.2879 CCC(=O)Cc1ccc(c(c1)Cl)O 1458a_100000035197_100000210202 [0,3,0,0,0,0|1,0,0]=4 21271 B13R1.2879 CCC(=O)Cc1ccc(c(c1)F)Br 1458a_100000210414_100000767054 [0,3,0,0,0,0|1,0,0]=4 21272 B13R1.2879 CCC(=O)Cc1ccc(c(c1)F)Br 1458a_100000691132_100000210202 [0,3,0,0,0,0|1,0,0]=4 21273 B13R1.2879 CCC(=O)Cc1ccc(c(c1)F)C 1458a_100000210414_100011217369 [0,3,0,0,0,0|1,0,0]=4 21274 B13R1.2879 CCC(=O)Cc1ccc(c(c1)F)C 1458a_100011217375_100000210202 [0,3,0,0,0,0|1,0,0]=4 21275 B13R1.2879 CCC(=O)Cc1ccc(c(c1)F)Cl 1458a_100000210414_100000716492 [0,3,0,0,0,0|1,0,0]=4 21276 B13R1.2879 CCC(=O)Cc1ccc(c(c1)F)Cl 1458a_100000722404_100000210202 [0,3,0,0,0,0|1,0,0]=4 21277 B13R1.2879 CCC(=O)Cc1ccc(c(c1)F)F 1458a_100000210414_100000757363 [0,3,0,0,0,0|1,0,0]=4 21278 B13R1.2879 CCC(=O)Cc1ccc(c(c1)F)F 1458a_100000684721_100000210202 [0,3,0,0,0,0|1,0,0]=4 21279 B13R1.2879 CCC(=O)Cc1ccc(c(c1)F)I 1458a_100000210414_100010149604 [0,3,0,0,0,0|1,0,0]=4 21280 B13R1.2879 CCC(=O)Cc1ccc(c(c1)F)I 1458a_100010149632_100000210202 [0,3,0,0,0,0|1,0,0]=4 21281 B13R1.2879 CCC(=O)Cc1ccc(c(c1)F)O 1458a_100000039761_100000210202 [0,3,0,0,0,0|1,0,0]=4 21282 B13R1.2879 CCC(=O)Cc1ccc(c(c1)I)Br 1458a_100000210414_100010146616 [0,3,0,0,0,0|1,0,0]=4 21283 B13R1.2879 CCC(=O)Cc1ccc(c(c1)I)C 1458a_100000210414_100010206137 [0,3,0,0,0,0|1,0,0]=4 21284 B13R1.2879 CCC(=O)Cc1ccc(c(c1)I)F 1458a_100000210414_100010188208 [0,3,0,0,0,0|1,0,0]=4 21285 B13R1.2879 CCC(=O)Cc1ccc(c(c1)O)C 1458a_100000082272_100000210202 [0,3,0,0,0,0|1,0,0]=4 21286 B13R1.2879 CCC(=O)Cc1ccc(c(c1)O)O 1458a_100000031429_100000210202 [0,3,0,0,0,0|1,0,0]=4 21287 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Br)C 11a_106832991635_100000709925 [0,3,0,0,0,0|1,0,0]=4 21288 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Br)C 240690a_100102657272_100000709925 [0,3,0,0,0,0|1,0,0]=4 21289 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Br)C 527a_100102657272_100000709925 [0,3,0,0,0,0|1,0,0]=4 21290 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Br)Cl 11a_106832991635_100012349508 [0,3,0,0,0,0|1,0,0]=4 21291 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Br)Cl 240690a_100102657272_100012349508 [0,3,0,0,0,0|1,0,0]=4 21292 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Br)Cl 527a_100102657272_100012349508 [0,3,0,0,0,0|1,0,0]=4 21293 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Br)F 11a_106832991635_100000742997 [0,3,0,0,0,0|1,0,0]=4 21294 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Br)F 240690a_100102657272_100000742997 [0,3,0,0,0,0|1,0,0]=4 21295 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Br)F 527a_100102657272_100000742997 [0,3,0,0,0,0|1,0,0]=4 21296 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Br)O 240690a_100102657272_100009990404 [0,3,0,0,0,0|1,0,0]=4 21297 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Br)O 527a_100102657272_100009990404 [0,3,0,0,0,0|1,0,0]=4 21298 B13R1.2879 CNC(=O)Cc1ccc(c(c1)C)Br 11a_106832991635_100012340274 [0,3,0,0,0,0|1,0,0]=4 21299 B13R1.2879 CNC(=O)Cc1ccc(c(c1)C)Br 240690a_100102657272_100012340274 [0,3,0,0,0,0|1,0,0]=4 21300 B13R1.2879 CNC(=O)Cc1ccc(c(c1)C)Br 527a_100102657272_100012340274 [0,3,0,0,0,0|1,0,0]=4 21301 B13R1.2879 CNC(=O)Cc1ccc(c(c1)C)C 11a_106832991635_100000184070 [0,3,0,0,0,0|1,0,0]=4 21302 B13R1.2879 CNC(=O)Cc1ccc(c(c1)C)C 240690a_100102657272_100000184070 [0,3,0,0,0,0|1,0,0]=4 21303 B13R1.2879 CNC(=O)Cc1ccc(c(c1)C)C 527a_100102657272_100000184070 [0,3,0,0,0,0|1,0,0]=4 21304 B13R1.2879 CNC(=O)Cc1ccc(c(c1)C)F 11a_106832991635_100011667458 [0,3,0,0,0,0|1,0,0]=4 21305 B13R1.2879 CNC(=O)Cc1ccc(c(c1)C)F 240690a_100102657272_100011667458 [0,3,0,0,0,0|1,0,0]=4 21306 B13R1.2879 CNC(=O)Cc1ccc(c(c1)C)F 527a_100102657272_100011667458 [0,3,0,0,0,0|1,0,0]=4 21307 B13R1.2879 CNC(=O)Cc1ccc(c(c1)C)O 240690a_100102657272_100000083968 [0,3,0,0,0,0|1,0,0]=4 21308 B13R1.2879 CNC(=O)Cc1ccc(c(c1)C)O 527a_100102657272_100000083968 [0,3,0,0,0,0|1,0,0]=4 21309 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Cl)Br 11a_106832991635_100000766880 [0,3,0,0,0,0|1,0,0]=4 21310 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Cl)Br 240690a_100102657272_100000766880 [0,3,0,0,0,0|1,0,0]=4 21311 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Cl)Br 527a_100102657272_100000766880 [0,3,0,0,0,0|1,0,0]=4 21312 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Cl)Cl 11a_106832991635_100000210702 [0,3,0,0,0,0|1,0,0]=4 21313 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Cl)Cl 240690a_100102657272_100000210702 [0,3,0,0,0,0|1,0,0]=4 21314 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Cl)Cl 527a_100102657272_100000210702 [0,3,0,0,0,0|1,0,0]=4 21315 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Cl)F 11a_106832991635_100011217296 [0,3,0,0,0,0|1,0,0]=4 21316 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Cl)F 1626a_100102657272_100011217296 [0,3,0,0,0,0|1,0,0]=4 21317 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Cl)F 240690a_100102657272_100011217296 [0,3,0,0,0,0|1,0,0]=4 21318 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Cl)F 527a_100102657272_100011217296 [0,3,0,0,0,0|1,0,0]=4 21319 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Cl)O 240690a_100102657272_100000035197 [0,3,0,0,0,0|1,0,0]=4 21320 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Cl)O 527a_100102657272_100000035197 [0,3,0,0,0,0|1,0,0]=4 21321 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)Br 11a_106832991635_100000691132 [0,3,0,0,0,0|1,0,0]=4 21322 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)Br 240690a_100102657272_100000691132 [0,3,0,0,0,0|1,0,0]=4 21323 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)Br 527a_100102657272_100000691132 [0,3,0,0,0,0|1,0,0]=4 21324 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)C 11a_106832991635_100011217375 [0,3,0,0,0,0|1,0,0]=4 21325 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)C 240690a_100102657272_100011217375 [0,3,0,0,0,0|1,0,0]=4 21326 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)C 527a_100102657272_100011217375 [0,3,0,0,0,0|1,0,0]=4 21327 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)Cl 11a_106832991635_100000722404 [0,3,0,0,0,0|1,0,0]=4 21328 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)Cl 240690a_100102657272_100000722404 [0,3,0,0,0,0|1,0,0]=4 21329 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)Cl 527a_100102657272_100000722404 [0,3,0,0,0,0|1,0,0]=4 21330 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)F 11a_106832991635_100000684721 [0,3,0,0,0,0|1,0,0]=4 21331 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)F 1626a_100102657272_100000684721 [0,3,0,0,0,0|1,0,0]=4 21332 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)F 240690a_100102657272_100000684721 [0,3,0,0,0,0|1,0,0]=4 21333 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)F 527a_100102657272_100000684721 [0,3,0,0,0,0|1,0,0]=4 21334 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)I 11a_106832991635_100010149632 [0,3,0,0,0,0|1,0,0]=4 21335 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)I 1626a_100102657272_100010149632 [0,3,0,0,0,0|1,0,0]=4 21336 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)I 240690a_100102657272_100010149632 [0,3,0,0,0,0|1,0,0]=4 21337 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)I 527a_100102657272_100010149632 [0,3,0,0,0,0|1,0,0]=4 21338 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)O 240690a_100102657272_100000039761 [0,3,0,0,0,0|1,0,0]=4 21339 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)O 527a_100102657272_100000039761 [0,3,0,0,0,0|1,0,0]=4 21340 B13R1.2879 CNC(=O)Cc1ccc(c(c1)O)C 11a_106832991635_100000082272 [0,3,0,0,0,0|1,0,0]=4 21341 B13R1.2879 CNC(=O)Cc1ccc(c(c1)O)C 240690a_100102657272_100000082272 [0,3,0,0,0,0|1,0,0]=4 21342 B13R1.2879 CNC(=O)Cc1ccc(c(c1)O)C 527a_100102657272_100000082272 [0,3,0,0,0,0|1,0,0]=4 21343 B13R1.2879 CNC(=O)Cc1ccc(c(c1)O)O 527a_100102657272_100000031429 [0,3,0,0,0,0|1,0,0]=4 21344 B13R1.2879 COC(=O)Cc1ccc(c(c1)F)O 271570a_203496583355_100010371902 [0,3,0,0,0,0|1,0,0]=4 21345 B13R1.2879 COC(=O)Cc1ccc(c(c1)O)F 271570a_203496583355_100011435807 [0,3,0,0,0,0|1,0,0]=4 21346 B13R1.2879 COC(=O)Cc1ccc(c(c1)O)O 271570a_203496583355_100010222482 [0,3,0,0,0,0|1,0,0]=4 21347 B13R1.2879 Cc1cc(ccc1Br)CC(=O)CF 1458a_100012340274_100015361967 [0,3,0,0,0,0|1,0,0]=4 21348 B13R1.2879 Cc1cc(ccc1Br)CC(=O)CO 1458a_100000210174_100000727479 [0,3,0,0,0,0|1,0,0]=4 21349 B13R1.2879 Cc1cc(ccc1Cl)CC(=O)CO 1458a_100000210174_100012184735 [0,3,0,0,0,0|1,0,0]=4 21350 B13R1.2879 Cc1cc(ccc1F)CC(=O)CF 1458a_100011667458_100015361967 [0,3,0,0,0,0|1,0,0]=4 21351 B13R1.2879 Cc1cc(ccc1F)CC(=O)CO 1458a_100000210174_100011216667 [0,3,0,0,0,0|1,0,0]=4 21352 B13R1.2879 Cc1cc(ccc1O)CC(=O)CF 1458a_100000083968_100015361967 [0,3,0,0,0,0|1,0,0]=4 21353 B13R1.2879 Cc1ccc(cc1Br)CC(=O)CF 1458a_100000709925_100015361967 [0,3,0,0,0,0|1,0,0]=4 21354 B13R1.2879 Cc1ccc(cc1Br)CC(=O)CO 1458a_100000210174_100012232412 [0,3,0,0,0,0|1,0,0]=4 21355 B13R1.2879 Cc1ccc(cc1C)CC(=O)CF 1458a_100000184070_100015361967 [0,3,0,0,0,0|1,0,0]=4 21356 B13R1.2879 Cc1ccc(cc1C)CC(=O)CO 1458a_100000210174_100000742320 [0,3,0,0,0,0|1,0,0]=4 21357 B13R1.2879 Cc1ccc(cc1Cl)CC(=O)CO 1458a_100000210174_100011823929 [0,3,0,0,0,0|1,0,0]=4 21358 B13R1.2879 Cc1ccc(cc1F)CC(=O)CF 1458a_100011217375_100015361967 [0,3,0,0,0,0|1,0,0]=4 21359 B13R1.2879 Cc1ccc(cc1F)CC(=O)CO 1458a_100000210174_100011217369 [0,3,0,0,0,0|1,0,0]=4 21360 B13R1.2879 Cc1ccc(cc1I)CC(=O)CO 1458a_100000210174_100010206137 [0,3,0,0,0,0|1,0,0]=4 21361 B13R1.2879 Cc1ccc(cc1O)CC(=O)CF 1458a_100000082272_100015361967 [0,3,0,0,0,0|1,0,0]=4 21362 B13R1.2879 O=C(CF)Cc1ccc(c(c1)Br)Cl 1458a_100012349508_100015361967 [0,3,0,0,0,0|1,0,0]=4 21363 B13R1.2879 O=C(CF)Cc1ccc(c(c1)Br)F 1458a_100000742997_100015361967 [0,3,0,0,0,0|1,0,0]=4 21364 B13R1.2879 O=C(CF)Cc1ccc(c(c1)Br)O 1458a_100009990404_100015361967 [0,3,0,0,0,0|1,0,0]=4 21365 B13R1.2879 O=C(CF)Cc1ccc(c(c1)Cl)Br 1458a_100000766880_100015361967 [0,3,0,0,0,0|1,0,0]=4 21366 B13R1.2879 O=C(CF)Cc1ccc(c(c1)Cl)Cl 1458a_100000210702_100015361967 [0,3,0,0,0,0|1,0,0]=4 21367 B13R1.2879 O=C(CF)Cc1ccc(c(c1)Cl)F 1458a_100011217296_100015361967 [0,3,0,0,0,0|1,0,0]=4 21368 B13R1.2879 O=C(CF)Cc1ccc(c(c1)Cl)O 1458a_100000035197_100015361967 [0,3,0,0,0,0|1,0,0]=4 21369 B13R1.2879 O=C(CF)Cc1ccc(c(c1)F)Br 1458a_100000691132_100015361967 [0,3,0,0,0,0|1,0,0]=4 21370 B13R1.2879 O=C(CF)Cc1ccc(c(c1)F)Cl 1458a_100000722404_100015361967 [0,3,0,0,0,0|1,0,0]=4 21371 B13R1.2879 O=C(CF)Cc1ccc(c(c1)F)F 1458a_100000684721_100015361967 [0,3,0,0,0,0|1,0,0]=4 21372 B13R1.2879 O=C(CF)Cc1ccc(c(c1)F)I 1458a_100010149632_100015361967 [0,3,0,0,0,0|1,0,0]=4 21373 B13R1.2879 O=C(CF)Cc1ccc(c(c1)F)O 1458a_100000039761_100015361967 [0,3,0,0,0,0|1,0,0]=4 21374 B13R1.2879 O=C(CF)Cc1ccc(c(c1)O)O 1458a_100000031429_100015361967 [0,3,0,0,0,0|1,0,0]=4 21375 B13R1.2879 O=C(CO)Cc1ccc(c(c1)Br)Br 1458a_100000210174_100012353900 [0,3,0,0,0,0|1,0,0]=4 21376 B13R1.2879 O=C(CO)Cc1ccc(c(c1)Br)Cl 1458a_100000210174_100012353894 [0,3,0,0,0,0|1,0,0]=4 21377 B13R1.2879 O=C(CO)Cc1ccc(c(c1)Br)F 1458a_100000210174_100011206884 [0,3,0,0,0,0|1,0,0]=4 21378 B13R1.2879 O=C(CO)Cc1ccc(c(c1)Cl)Br 1458a_100000210174_100012353895 [0,3,0,0,0,0|1,0,0]=4 21379 B13R1.2879 O=C(CO)Cc1ccc(c(c1)Cl)Cl 1458a_100000210174_100000184707 [0,3,0,0,0,0|1,0,0]=4 21380 B13R1.2879 O=C(CO)Cc1ccc(c(c1)Cl)F 1458a_100000210174_100000717365 [0,3,0,0,0,0|1,0,0]=4 21381 B13R1.2879 O=C(CO)Cc1ccc(c(c1)Cl)I 1458a_100000210174_100012349665 [0,3,0,0,0,0|1,0,0]=4 21382 B13R1.2879 O=C(CO)Cc1ccc(c(c1)F)Br 1458a_100000210174_100000767054 [0,3,0,0,0,0|1,0,0]=4 21383 B13R1.2879 O=C(CO)Cc1ccc(c(c1)F)Cl 1458a_100000210174_100000716492 [0,3,0,0,0,0|1,0,0]=4 21384 B13R1.2879 O=C(CO)Cc1ccc(c(c1)F)F 1458a_100000210174_100000757363 [0,3,0,0,0,0|1,0,0]=4 21385 B13R1.2879 O=C(CO)Cc1ccc(c(c1)F)I 1458a_100000210174_100010149604 [0,3,0,0,0,0|1,0,0]=4 21386 B13R1.2879 O=C(CO)Cc1ccc(c(c1)I)Br 1458a_100000210174_100010146616 [0,3,0,0,0,0|1,0,0]=4 21387 B13R1.2879 O=C(CO)Cc1ccc(c(c1)I)F 1458a_100000210174_100010188208 [0,3,0,0,0,0|1,0,0]=4 21388 B13R1.3528 CC(=O)Cc1ccc(c(c1Br)F)F 1458a_100000070787_100016216887 [0,3,0,0,0,0|1,0,0]=4 21389 B13R1.3528 CC(=O)Cc1ccc(c(c1Br)F)F 1458a_200015693364_200000210301 [0,3,0,0,0,0|1,0,0]=4 21390 B13R1.3528 CC(=O)Cc1ccc(c(c1Cl)F)F 1458a_200010154634_200000210301 [0,3,0,0,0,0|1,0,0]=4 21391 B13R1.3528 CC(=O)Cc1ccc(c(c1F)Cl)F 1458a_100000062224_200000210301 [0,3,0,0,0,0|1,0,0]=4 21392 B13R1.3528 CC(=O)Cc1ccc(c(c1F)Cl)F 1458a_100000070787_100009814552 [0,3,0,0,0,0|1,0,0]=4 21393 B13R1.3528 CC(=O)Cc1ccc(c(c1F)F)C 1458a_100000070787_100009813564 [0,3,0,0,0,0|1,0,0]=4 21394 B13R1.3528 CC(=O)Cc1ccc(c(c1F)F)C 1458a_100011217901_200000210301 [0,3,0,0,0,0|1,0,0]=4 21395 B13R1.3528 CC(=O)Cc1ccc(c(c1F)F)F 1458a_100000070787_100011218744 [0,3,0,0,0,0|1,0,0]=4 21396 B13R1.3528 CC(=O)Cc1ccc(c(c1F)F)F 1458a_100011217297_200000210301 [0,3,0,0,0,0|1,0,0]=4 21397 B13R1.3528 Cc1ccc(c(c1F)F)CC(=O)[13CH3] 1458a_100011217901_200025704644 [0,3,0,0,0,0|1,0,0]=4 21398 B13R1.3528 [13CH3]C(=O)Cc1ccc(c(c1Br)F)F 1458a_200015693364_200025704644 [0,3,0,0,0,0|1,0,0]=4 21399 B13R1.3528 [13CH3]C(=O)Cc1ccc(c(c1Cl)F)F 1458a_200010154634_200025704644 [0,3,0,0,0,0|1,0,0]=4 21400 B13R1.3528 [13CH3]C(=O)Cc1ccc(c(c1F)Cl)F 1458a_100000062224_200025704644 [0,3,0,0,0,0|1,0,0]=4 21401 B13R1.3528 [13CH3]C(=O)Cc1ccc(c(c1F)F)F 1458a_100011217297_200025704644 [0,3,0,0,0,0|1,0,0]=4 21402 B13R1.3763 CC(=O)Cc1cc(c(c(c1)Br)O)Br 1458a_100009996861_200000210301 [0,3,0,0,0,0|1,0,0]=4 21403 B13R1.3763 CC(=O)Cc1cc(c(c(c1)C)F)C 1458a_100000069598_200000210301 [0,3,0,0,0,0|1,0,0]=4 21404 B13R1.3763 CC(=O)Cc1cc(c(c(c1)C)F)C 1458a_100000070787_100011352456 [0,3,0,0,0,0|1,0,0]=4 21405 B13R1.3763 CC(=O)Cc1cc(c(c(c1)C)O)C 1458a_200000099080_200000210301 [0,3,0,0,0,0|1,0,0]=4 21406 B13R1.3763 CC(=O)Cc1cc(c(c(c1)F)Cl)F 1458a_100000070787_100010769323 [0,3,0,0,0,0|1,0,0]=4 21407 B13R1.3763 CC(=O)Cc1cc(c(c(c1)F)F)F 1458a_100000070787_100011216845 [0,3,0,0,0,0|1,0,0]=4 21408 B13R1.3763 CC(=O)Cc1cc(c(c(c1)F)F)F 1458a_100011217689_200000210301 [0,3,0,0,0,0|1,0,0]=4 21409 B13R1.3763 Cc1cc(cc(c1F)C)CC(=O)[13CH3] 1458a_100000069598_200025704644 [0,3,0,0,0,0|1,0,0]=4 21410 B13R1.3763 Cc1cc(cc(c1O)C)CC(=O)[13CH3] 1458a_200000099080_200025704644 [0,3,0,0,0,0|1,0,0]=4 21411 B13R1.3763 [13CH3]C(=O)Cc1cc(c(c(c1)Br)O)Br 1458a_100009996861_200025704644 [0,3,0,0,0,0|1,0,0]=4 21412 B13R1.3763 [13CH3]C(=O)Cc1cc(c(c(c1)F)F)F 1458a_100011217689_200025704644 [0,3,0,0,0,0|1,0,0]=4 21413 B13R1.21 C=CC(=O)C(C)c1ccc(cc1)Br 1458a_100000185746_100000755118 [0,3,0,0,0,0|1,0,0]=4 21414 B13R1.21 C=CC(=O)C(C)c1ccc(cc1)C 1458a_100000185746_100011261388 [0,3,0,0,0,0|1,0,0]=4 21415 B13R1.21 C=CC(=O)C(C)c1ccc(cc1)Cl 1458a_100000185746_100000684792 [0,3,0,0,0,0|1,0,0]=4 21416 B13R1.21 C=CC(=O)C(C)c1ccc(cc1)F 1458a_100000185746_100000743420 [0,3,0,0,0,0|1,0,0]=4 21417 B13R1.21 CC(C(=O)CF)c1ccc(cc1)Cl 1458a_100011216001_100015361967 [0,3,0,0,0,0|1,0,0]=4 21418 B13R1.21 CC(C(=O)CF)c1ccc(cc1)F 1458a_100011435297_100015361967 [0,3,0,0,0,0|1,0,0]=4 21419 B13R1.21 CC(C(=O)CF)c1ccc(cc1)O 1458a_100000031422_100015361967 [0,3,0,0,0,0|1,0,0]=4 21420 B13R1.21 CC(C(=O)CO)c1ccc(cc1)Br 1458a_100000210174_100000755118 [0,3,0,0,0,0|1,0,0]=4 21421 B13R1.21 CC(C(=O)CO)c1ccc(cc1)Cl 1458a_100000210174_100000684792 [0,3,0,0,0,0|1,0,0]=4 21422 B13R1.21 CC(C(=O)CO)c1ccc(cc1)F 1458a_100000210174_100000743420 [0,3,0,0,0,0|1,0,0]=4 21423 B13R1.21 CCC(=O)C(C)c1ccc(cc1)Br 1458a_100000210414_100000755118 [0,3,0,0,0,0|1,0,0]=4 21424 B13R1.21 CCC(=O)C(C)c1ccc(cc1)C 1458a_100000210414_100011261388 [0,3,0,0,0,0|1,0,0]=4 21425 B13R1.21 CCC(=O)C(C)c1ccc(cc1)C 1458a_100000751627_100000210202 [0,3,0,0,0,0|1,0,0]=4 21426 B13R1.21 CCC(=O)C(C)c1ccc(cc1)Cl 1458a_100000210414_100000684792 [0,3,0,0,0,0|1,0,0]=4 21427 B13R1.21 CCC(=O)C(C)c1ccc(cc1)Cl 1458a_100011216001_100000210202 [0,3,0,0,0,0|1,0,0]=4 21428 B13R1.21 CCC(=O)C(C)c1ccc(cc1)F 1458a_100000210414_100000743420 [0,3,0,0,0,0|1,0,0]=4 21429 B13R1.21 CCC(=O)C(C)c1ccc(cc1)F 1458a_100011435297_100000210202 [0,3,0,0,0,0|1,0,0]=4 21430 B13R1.21 CCC(=O)C(C)c1ccc(cc1)O 1458a_100000031422_100000210202 [0,3,0,0,0,0|1,0,0]=4 21431 B13R1.21 CCC(=O)C(F)c1ccc(cc1)Cl 1458a_100012277543_100000210202 [0,3,0,0,0,0|1,0,0]=4 21432 B13R1.21 CCC(=O)C(O)c1ccc(cc1)Br 1458a_100000756554_100000210202 [0,3,0,0,0,0|1,0,0]=4 21433 B13R1.21 CCC(=O)C(O)c1ccc(cc1)F 1458a_100000209909_100000210202 [0,3,0,0,0,0|1,0,0]=4 21434 B13R1.21 CCC(=O)C(O)c1ccc(cc1)O 1458a_100011215213_100000210202 [0,3,0,0,0,0|1,0,0]=4 21435 B13R1.21 CCC(=O)[C@H](O)c1ccc(cc1)C 1458a_100009815954_100000210202 [0,3,0,0,0,0|1,0,0]=4 21436 B13R1.21 CCC(=O)[C@H](O)c1ccc(cc1)Cl 1458a_100009817493_100000210202 [0,3,0,0,0,0|1,0,0]=4 21437 B13R1.21 CNC(=O)C(C)c1ccc(cc1)C 11a_106832991635_100000751627 [0,3,0,0,0,0|1,0,0]=4 21438 B13R1.21 CNC(=O)C(C)c1ccc(cc1)C 1626a_100102657272_100000751627 [0,3,0,0,0,0|1,0,0]=4 21439 B13R1.21 CNC(=O)C(C)c1ccc(cc1)C 240690a_100102657272_100000751627 [0,3,0,0,0,0|1,0,0]=4 21440 B13R1.21 CNC(=O)C(C)c1ccc(cc1)C 527a_100102657272_100000751627 [0,3,0,0,0,0|1,0,0]=4 21441 B13R1.21 CNC(=O)C(C)c1ccc(cc1)Cl 11a_106832991635_100011216001 [0,3,0,0,0,0|1,0,0]=4 21442 B13R1.21 CNC(=O)C(C)c1ccc(cc1)Cl 1626a_100102657272_100011216001 [0,3,0,0,0,0|1,0,0]=4 21443 B13R1.21 CNC(=O)C(C)c1ccc(cc1)Cl 240690a_100102657272_100011216001 [0,3,0,0,0,0|1,0,0]=4 21444 B13R1.21 CNC(=O)C(C)c1ccc(cc1)Cl 527a_100102657272_100011216001 [0,3,0,0,0,0|1,0,0]=4 21445 B13R1.21 CNC(=O)C(C)c1ccc(cc1)F 11a_106832991635_100011435297 [0,3,0,0,0,0|1,0,0]=4 21446 B13R1.21 CNC(=O)C(C)c1ccc(cc1)F 1626a_100102657272_100011435297 [0,3,0,0,0,0|1,0,0]=4 21447 B13R1.21 CNC(=O)C(C)c1ccc(cc1)F 240690a_100102657272_100011435297 [0,3,0,0,0,0|1,0,0]=4 21448 B13R1.21 CNC(=O)C(C)c1ccc(cc1)F 527a_100102657272_100011435297 [0,3,0,0,0,0|1,0,0]=4 21449 B13R1.21 CNC(=O)C(C)c1ccc(cc1)O 240690a_100102657272_100000031422 [0,3,0,0,0,0|1,0,0]=4 21450 B13R1.21 CNC(=O)C(F)c1ccc(cc1)Cl 11a_106832991635_100012277543 [0,3,0,0,0,0|1,0,0]=4 21451 B13R1.21 CNC(=O)C(F)c1ccc(cc1)Cl 1626a_100102657272_100012277543 [0,3,0,0,0,0|1,0,0]=4 21452 B13R1.21 CNC(=O)C(F)c1ccc(cc1)Cl 240690a_100102657272_100012277543 [0,3,0,0,0,0|1,0,0]=4 21453 B13R1.21 CNC(=O)C(F)c1ccc(cc1)Cl 527a_100102657272_100012277543 [0,3,0,0,0,0|1,0,0]=4 21454 B13R1.21 CNC(=O)C(O)c1ccc(cc1)Br 240690a_100102657272_100000756554 [0,3,0,0,0,0|1,0,0]=4 21455 B13R1.21 CNC(=O)C(O)c1ccc(cc1)F 240690a_100102657272_100000209909 [0,3,0,0,0,0|1,0,0]=4 21456 B13R1.21 CNC(=O)C(O)c1ccc(cc1)O 240690a_100102657272_100011215213 [0,3,0,0,0,0|1,0,0]=4 21457 B13R1.21 CNC(=O)[C@H](O)c1ccc(cc1)C 240690a_100102657272_100009815954 [0,3,0,0,0,0|1,0,0]=4 21458 B13R1.21 CNC(=O)[C@H](O)c1ccc(cc1)Cl 240690a_100102657272_100009817493 [0,3,0,0,0,0|1,0,0]=4 21459 B13R1.21 COC(=O)C(N)c1ccc(cc1)O 271570a_203496583355_100000747369 [0,3,0,0,0,0|1,0,0]=4 21460 B13R1.21 Cc1ccc(cc1)C(C)C(=O)CF 1458a_100000751627_100015361967 [0,3,0,0,0,0|1,0,0]=4 21461 B13R1.21 Cc1ccc(cc1)C(C)C(=O)CO 1458a_100000210174_100011261388 [0,3,0,0,0,0|1,0,0]=4 21462 B13R1.21 Cc1ccc(cc1)[C@@H](O)C(=O)CF 1458a_100009815954_100015361967 [0,3,0,0,0,0|1,0,0]=4 21463 B13R1.21 O=C(CF)C(F)c1ccc(cc1)Cl 1458a_100012277543_100015361967 [0,3,0,0,0,0|1,0,0]=4 21464 B13R1.21 O=C(CF)C(O)c1ccc(cc1)Br 1458a_100000756554_100015361967 [0,3,0,0,0,0|1,0,0]=4 21465 B13R1.21 O=C(CF)C(O)c1ccc(cc1)F 1458a_100000209909_100015361967 [0,3,0,0,0,0|1,0,0]=4 21466 B13R1.21 O=C(CF)C(O)c1ccc(cc1)O 1458a_100011215213_100015361967 [0,3,0,0,0,0|1,0,0]=4 21467 B13R1.21 O=C(CF)[C@H](O)c1ccc(cc1)Cl 1458a_100009817493_100015361967 [0,3,0,0,0,0|1,0,0]=4 21468 B13R1.163 CC(=O)C(C)c1ccc(cc1Cl)F 1458a_200012359452_200000210301 [0,3,0,0,0,0|1,0,0]=4 21469 B13R1.163 CC(=O)C(O)c1ccc(cc1F)Br 1458a_100011356516_200000210301 [0,3,0,0,0,0|1,0,0]=4 21470 B13R1.163 CC(=O)C(O)c1ccc(cc1F)F 1458a_100011216397_200000210301 [0,3,0,0,0,0|1,0,0]=4 21471 B13R1.163 CC(C(=O)[13CH3])c1ccc(cc1Cl)F 1458a_200012359452_200025704644 [0,3,0,0,0,0|1,0,0]=4 21472 B13R1.163 [13CH3]C(=O)C(O)c1ccc(cc1F)Br 1458a_100011356516_200025704644 [0,3,0,0,0,0|1,0,0]=4 21473 B13R1.163 [13CH3]C(=O)C(O)c1ccc(cc1F)F 1458a_100011216397_200025704644 [0,3,0,0,0,0|1,0,0]=4 21474 B13R1.522 CC(=O)C(C)(C)c1ccc(cc1)Br 1458a_100000740082_200000210301 [0,3,0,0,0,0|1,0,0]=4 21475 B13R1.522 CC(=O)C(C)(C)c1ccc(cc1)C 1458a_100000751694_200000210301 [0,3,0,0,0,0|1,0,0]=4 21476 B13R1.522 CC(=O)C(C)(C)c1ccc(cc1)Cl 1458a_100000742901_200000210301 [0,3,0,0,0,0|1,0,0]=4 21477 B13R1.522 CC(=O)C(C)(C)c1ccc(cc1)F 1458a_100000751650_200000210301 [0,3,0,0,0,0|1,0,0]=4 21478 B13R1.522 CC(=O)C(C)(C)c1ccc(cc1)O 1458a_100000721645_200000210301 [0,3,0,0,0,0|1,0,0]=4 21479 B13R1.522 CC(=O)C(C)(O)c1ccc(cc1)C 1458a_100011434902_200000210301 [0,3,0,0,0,0|1,0,0]=4 21480 B13R1.522 CC(=O)C(C)(O)c1ccc(cc1)Cl 1458a_100000695402_200000210301 [0,3,0,0,0,0|1,0,0]=4 21481 B13R1.522 CC(C)(C(=O)[13CH3])c1ccc(cc1)Br 1458a_100000740082_200025704644 [0,3,0,0,0,0|1,0,0]=4 21482 B13R1.522 CC(C)(C(=O)[13CH3])c1ccc(cc1)Cl 1458a_100000742901_200025704644 [0,3,0,0,0,0|1,0,0]=4 21483 B13R1.522 CC(C)(C(=O)[13CH3])c1ccc(cc1)F 1458a_100000751650_200025704644 [0,3,0,0,0,0|1,0,0]=4 21484 B13R1.522 CC(C)(C(=O)[13CH3])c1ccc(cc1)O 1458a_100000721645_200025704644 [0,3,0,0,0,0|1,0,0]=4 21485 B13R1.522 CC(O)(C(=O)[13CH3])c1ccc(cc1)Cl 1458a_100000695402_200025704644 [0,3,0,0,0,0|1,0,0]=4 21486 B13R1.522 Cc1ccc(cc1)C(C)(C)C(=O)[13CH3] 1458a_100000751694_200025704644 [0,3,0,0,0,0|1,0,0]=4 21487 B13R1.522 Cc1ccc(cc1)C(C)(O)C(=O)[13CH3] 1458a_100011434902_200025704644 [0,3,0,0,0,0|1,0,0]=4 21488 B13R1.706 CCC(C(=O)C)c1ccc(cc1)Br 1458a_100011934198_200000210301 [0,3,0,0,0,0|1,0,0]=4 21489 B13R1.706 CCC(C(=O)[13CH3])c1ccc(cc1)Br 1458a_100011934198_200025704644 [0,3,0,0,0,0|1,0,0]=4 21490 B13R1.706 COC(C(=O)C)c1ccc(cc1)Cl 1458a_100012350483_200000210301 [0,3,0,0,0,0|1,0,0]=4 21491 B13R1.706 COC(C(=O)[13CH3])c1ccc(cc1)Cl 1458a_100012350483_200025704644 [0,3,0,0,0,0|1,0,0]=4 21492 B13R1.19 C#CCC(=O)Cc1ccc(cc1)Br 1458a_100000198978_100000184674 [0,3,0,0,0,0|1,0,0]=4 21493 B13R1.19 C#CCC(=O)Cc1ccc(cc1)Br 1458a_100011220946_100000189115 [0,3,0,0,0,0|1,0,0]=4 21494 B13R1.19 C#CCC(=O)Cc1ccc(cc1)C 1458a_100000212244_100000184674 [0,3,0,0,0,0|1,0,0]=4 21495 B13R1.19 C#CCC(=O)Cc1ccc(cc1)C 1458a_100011220946_100000210814 [0,3,0,0,0,0|1,0,0]=4 21496 B13R1.19 C#CCC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100000184674 [0,3,0,0,0,0|1,0,0]=4 21497 B13R1.19 C#CCC(=O)Cc1ccc(cc1)Cl 1458a_100011220946_100000694040 [0,3,0,0,0,0|1,0,0]=4 21498 B13R1.19 C#CCC(=O)Cc1ccc(cc1)F 1458a_100000210951_100000184674 [0,3,0,0,0,0|1,0,0]=4 21499 B13R1.19 C#CCC(=O)Cc1ccc(cc1)F 1458a_100011220946_100000198546 [0,3,0,0,0,0|1,0,0]=4 21500 B13R1.19 C#CCC(=O)Cc1ccc(cc1)I 1458a_100000688869_100000184674 [0,3,0,0,0,0|1,0,0]=4 21501 B13R1.19 C#CCC(=O)Cc1ccc(cc1)I 1458a_100011220946_100000189116 [0,3,0,0,0,0|1,0,0]=4 21502 B13R1.19 C#CCC(=O)Cc1ccc(cc1)O 1458a_100000198540_100000184674 [0,3,0,0,0,0|1,0,0]=4 21503 B13R1.19 C=CCC(=O)Cc1ccc(cc1)Br 1458a_100000198978_100000210623 [0,3,0,0,0,0|1,0,0]=4 21504 B13R1.19 C=CCC(=O)Cc1ccc(cc1)Br 1458a_100000210193_100000189115 [0,3,0,0,0,0|1,0,0]=4 21505 B13R1.19 C=CCC(=O)Cc1ccc(cc1)C 1458a_100000210193_100000210814 [0,3,0,0,0,0|1,0,0]=4 21506 B13R1.19 C=CCC(=O)Cc1ccc(cc1)C 1458a_100000212244_100000210623 [0,3,0,0,0,0|1,0,0]=4 21507 B13R1.19 C=CCC(=O)Cc1ccc(cc1)Cl 1458a_100000210193_100000694040 [0,3,0,0,0,0|1,0,0]=4 21508 B13R1.19 C=CCC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100000210623 [0,3,0,0,0,0|1,0,0]=4 21509 B13R1.19 C=CCC(=O)Cc1ccc(cc1)F 1458a_100000210193_100000198546 [0,3,0,0,0,0|1,0,0]=4 21510 B13R1.19 C=CCC(=O)Cc1ccc(cc1)F 1458a_100000210951_100000210623 [0,3,0,0,0,0|1,0,0]=4 21511 B13R1.19 C=CCC(=O)Cc1ccc(cc1)I 1458a_100000210193_100000189116 [0,3,0,0,0,0|1,0,0]=4 21512 B13R1.19 C=CCC(=O)Cc1ccc(cc1)I 1458a_100000688869_100000210623 [0,3,0,0,0,0|1,0,0]=4 21513 B13R1.19 C=CCC(=O)Cc1ccc(cc1)O 1458a_100000198540_100000210623 [0,3,0,0,0,0|1,0,0]=4 21514 B13R1.19 C=CCN(C)Cc1ccc(cc1)Br 2230a_100000180866_100000210623 [0,3,0,0,0,0|1,0,0]=4 21515 B13R1.19 C=CCN(C)Cc1ccc(cc1)Br 2230a_100000196220_200000210301 [0,3,0,0,0,0|1,0,0]=4 21516 B13R1.19 C=CCN(C)Cc1ccc(cc1)Br 2230a_100000225617_100011217064 [0,3,0,0,0,0|1,0,0]=4 21517 B13R1.19 C=CCN(C)Cc1ccc(cc1)Br 269982a_100000180866_100000210623 [0,3,0,0,0,0|1,0,0]=4 21518 B13R1.19 C=CCN(C)Cc1ccc(cc1)Br 269982a_100000196220_200000210301 [0,3,0,0,0,0|1,0,0]=4 21519 B13R1.19 C=CCN(C)Cc1ccc(cc1)Br 269982a_100000225617_100011217064 [0,3,0,0,0,0|1,0,0]=4 21520 B13R1.19 C=CCN(C)Cc1ccc(cc1)Br 26a_100000225617_100000185759 [0,3,0,0,0,0|1,0,0]=4 21521 B13R1.19 C=CCN(C)Cc1ccc(cc1)Br 270004a_100000225617_100000186029 [0,3,0,0,0,0|1,0,0]=4 21522 B13R1.19 C=CCN(C)Cc1ccc(cc1)Br 34a_100000196220_200000210301 [0,3,0,0,0,0|1,0,0]=4 21523 B13R1.19 C=CCN(C)Cc1ccc(cc1)C 2230a_100000196234_200000210301 [0,3,0,0,0,0|1,0,0]=4 21524 B13R1.19 C=CCN(C)Cc1ccc(cc1)C 2230a_100000225617_100000210814 [0,3,0,0,0,0|1,0,0]=4 21525 B13R1.19 C=CCN(C)Cc1ccc(cc1)C 2230a_100000744650_100000210623 [0,3,0,0,0,0|1,0,0]=4 21526 B13R1.19 C=CCN(C)Cc1ccc(cc1)C 269982a_100000196234_200000210301 [0,3,0,0,0,0|1,0,0]=4 21527 B13R1.19 C=CCN(C)Cc1ccc(cc1)C 269982a_100000225617_100000210814 [0,3,0,0,0,0|1,0,0]=4 21528 B13R1.19 C=CCN(C)Cc1ccc(cc1)C 269982a_100000744650_100000210623 [0,3,0,0,0,0|1,0,0]=4 21529 B13R1.19 C=CCN(C)Cc1ccc(cc1)C 26a_100000225617_200020625495 [0,3,0,0,0,0|1,0,0]=4 21530 B13R1.19 C=CCN(C)Cc1ccc(cc1)C 270004a_100000225617_100000211033 [0,3,0,0,0,0|1,0,0]=4 21531 B13R1.19 C=CCN(C)Cc1ccc(cc1)C 34a_100000196234_200000210301 [0,3,0,0,0,0|1,0,0]=4 21532 B13R1.19 C=CCN(C)Cc1ccc(cc1)C 34a_100000744650_100015514636 [0,3,0,0,0,0|1,0,0]=4 21533 B13R1.19 C=CCN(C)Cc1ccc(cc1)Cl 2230a_100000184517_100000210623 [0,3,0,0,0,0|1,0,0]=4 21534 B13R1.19 C=CCN(C)Cc1ccc(cc1)Cl 2230a_100000196221_200000210301 [0,3,0,0,0,0|1,0,0]=4 21535 B13R1.19 C=CCN(C)Cc1ccc(cc1)Cl 2230a_100000225617_100000694040 [0,3,0,0,0,0|1,0,0]=4 21536 B13R1.19 C=CCN(C)Cc1ccc(cc1)Cl 269982a_100000184517_100000210623 [0,3,0,0,0,0|1,0,0]=4 21537 B13R1.19 C=CCN(C)Cc1ccc(cc1)Cl 269982a_100000196221_200000210301 [0,3,0,0,0,0|1,0,0]=4 21538 B13R1.19 C=CCN(C)Cc1ccc(cc1)Cl 269982a_100000225617_100000187161 [0,3,0,0,0,0|1,0,0]=4 21539 B13R1.19 C=CCN(C)Cc1ccc(cc1)Cl 270004a_100000225617_100000189385 [0,3,0,0,0,0|1,0,0]=4 21540 B13R1.19 C=CCN(C)Cc1ccc(cc1)Cl 34a_100000184517_100015514636 [0,3,0,0,0,0|1,0,0]=4 21541 B13R1.19 C=CCN(C)Cc1ccc(cc1)Cl 34a_100000196221_200000210301 [0,3,0,0,0,0|1,0,0]=4 21542 B13R1.19 C=CCN(C)Cc1ccc(cc1)F 2230a_100000184576_100000210623 [0,3,0,0,0,0|1,0,0]=4 21543 B13R1.19 C=CCN(C)Cc1ccc(cc1)F 2230a_100000196225_200000210301 [0,3,0,0,0,0|1,0,0]=4 21544 B13R1.19 C=CCN(C)Cc1ccc(cc1)F 2230a_100000225617_100000198546 [0,3,0,0,0,0|1,0,0]=4 21545 B13R1.19 C=CCN(C)Cc1ccc(cc1)F 269982a_100000184576_100000210623 [0,3,0,0,0,0|1,0,0]=4 21546 B13R1.19 C=CCN(C)Cc1ccc(cc1)F 269982a_100000196225_200000210301 [0,3,0,0,0,0|1,0,0]=4 21547 B13R1.19 C=CCN(C)Cc1ccc(cc1)F 269982a_100000225617_100000198546 [0,3,0,0,0,0|1,0,0]=4 21548 B13R1.19 C=CCN(C)Cc1ccc(cc1)F 270004a_100000225617_100000210084 [0,3,0,0,0,0|1,0,0]=4 21549 B13R1.19 C=CCN(C)Cc1ccc(cc1)F 34a_100000184576_100015514636 [0,3,0,0,0,0|1,0,0]=4 21550 B13R1.19 C=CCN(C)Cc1ccc(cc1)F 34a_100000196225_200000210301 [0,3,0,0,0,0|1,0,0]=4 21551 B13R1.19 C=CCN(C)Cc1ccc(cc1)I 2230a_100000225617_100000189116 [0,3,0,0,0,0|1,0,0]=4 21552 B13R1.19 C=CCN(C)Cc1ccc(cc1)I 269982a_100000225617_100000189116 [0,3,0,0,0,0|1,0,0]=4 21553 B13R1.19 C=CCN(C)Cc1ccc(cc1)O 2230a_100000207500_100000210623 [0,3,0,0,0,0|1,0,0]=4 21554 B13R1.19 C=CCN(C)Cc1ccc(cc1)O 269982a_100000207500_100000210623 [0,3,0,0,0,0|1,0,0]=4 21555 B13R1.19 C=CCN([13CH3])Cc1ccc(cc1)Br 2230a_100000196220_200025704644 [0,3,0,0,0,0|1,0,0]=4 21556 B13R1.19 C=CCN([13CH3])Cc1ccc(cc1)Br 269982a_100000196220_200025704644 [0,3,0,0,0,0|1,0,0]=4 21557 B13R1.19 C=CCN([13CH3])Cc1ccc(cc1)Br 34a_100000196220_200025704644 [0,3,0,0,0,0|1,0,0]=4 21558 B13R1.19 C=CCN([13CH3])Cc1ccc(cc1)C 2230a_100000196234_200025704644 [0,3,0,0,0,0|1,0,0]=4 21559 B13R1.19 C=CCN([13CH3])Cc1ccc(cc1)C 269982a_100000196234_200025704644 [0,3,0,0,0,0|1,0,0]=4 21560 B13R1.19 C=CCN([13CH3])Cc1ccc(cc1)C 34a_100000196234_200025704644 [0,3,0,0,0,0|1,0,0]=4 21561 B13R1.19 C=CCN([13CH3])Cc1ccc(cc1)Cl 2230a_100000196221_200025704644 [0,3,0,0,0,0|1,0,0]=4 21562 B13R1.19 C=CCN([13CH3])Cc1ccc(cc1)Cl 269982a_100000196221_200025704644 [0,3,0,0,0,0|1,0,0]=4 21563 B13R1.19 C=CCN([13CH3])Cc1ccc(cc1)Cl 34a_100000196221_200025704644 [0,3,0,0,0,0|1,0,0]=4 21564 B13R1.19 C=CCN([13CH3])Cc1ccc(cc1)F 2230a_100000196225_200025704644 [0,3,0,0,0,0|1,0,0]=4 21565 B13R1.19 C=CCN([13CH3])Cc1ccc(cc1)F 269982a_100000196225_200025704644 [0,3,0,0,0,0|1,0,0]=4 21566 B13R1.19 C=CCN([13CH3])Cc1ccc(cc1)F 34a_100000196225_200025704644 [0,3,0,0,0,0|1,0,0]=4 21567 B13R1.19 CC#CC(=O)Cc1ccc(cc1)Br 1458a_100000763181_100000189115 [0,3,0,0,0,0|1,0,0]=4 21568 B13R1.19 CC#CC(=O)Cc1ccc(cc1)C 1458a_100000763181_100000210814 [0,3,0,0,0,0|1,0,0]=4 21569 B13R1.19 CC#CC(=O)Cc1ccc(cc1)Cl 1458a_100000763181_100000694040 [0,3,0,0,0,0|1,0,0]=4 21570 B13R1.19 CC#CC(=O)Cc1ccc(cc1)F 1458a_100000763181_100000198546 [0,3,0,0,0,0|1,0,0]=4 21571 B13R1.19 CC#CC(=O)Cc1ccc(cc1)I 1458a_100000763181_100000189116 [0,3,0,0,0,0|1,0,0]=4 21572 B13R1.19 CC=CC(=O)Cc1ccc(cc1)Br 1458a_100000210699_100000189115 [0,3,0,0,0,0|1,0,0]=4 21573 B13R1.19 CC=CC(=O)Cc1ccc(cc1)C 1458a_100000210699_100000210814 [0,3,0,0,0,0|1,0,0]=4 21574 B13R1.19 CC=CC(=O)Cc1ccc(cc1)Cl 1458a_100000210699_100000694040 [0,3,0,0,0,0|1,0,0]=4 21575 B13R1.19 CC=CC(=O)Cc1ccc(cc1)F 1458a_100000210699_100000198546 [0,3,0,0,0,0|1,0,0]=4 21576 B13R1.19 CC=CC(=O)Cc1ccc(cc1)I 1458a_100000210699_100000189116 [0,3,0,0,0,0|1,0,0]=4 21577 B13R1.19 CCCC(=O)Cc1ccc(cc1)Br 1458a_100000198978_100000210303 [0,3,0,0,0,0|1,0,0]=4 21578 B13R1.19 CCCC(=O)Cc1ccc(cc1)Br 1458a_100000211992_100000189115 [0,3,0,0,0,0|1,0,0]=4 21579 B13R1.19 CCCC(=O)Cc1ccc(cc1)C 1458a_100000211992_100000210814 [0,3,0,0,0,0|1,0,0]=4 21580 B13R1.19 CCCC(=O)Cc1ccc(cc1)C 1458a_100000212244_100000210303 [0,3,0,0,0,0|1,0,0]=4 21581 B13R1.19 CCCC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100000210303 [0,3,0,0,0,0|1,0,0]=4 21582 B13R1.19 CCCC(=O)Cc1ccc(cc1)Cl 1458a_100000211992_100000694040 [0,3,0,0,0,0|1,0,0]=4 21583 B13R1.19 CCCC(=O)Cc1ccc(cc1)F 1458a_100000210951_100000210303 [0,3,0,0,0,0|1,0,0]=4 21584 B13R1.19 CCCC(=O)Cc1ccc(cc1)F 1458a_100000211992_100000198546 [0,3,0,0,0,0|1,0,0]=4 21585 B13R1.19 CCCC(=O)Cc1ccc(cc1)I 1458a_100000211992_100000189116 [0,3,0,0,0,0|1,0,0]=4 21586 B13R1.19 CCCC(=O)Cc1ccc(cc1)I 1458a_100000688869_100000210303 [0,3,0,0,0,0|1,0,0]=4 21587 B13R1.19 CCCC(=O)Cc1ccc(cc1)O 1458a_100000198540_100000210303 [0,3,0,0,0,0|1,0,0]=4 21588 B13R1.19 CCNC(=O)Cc1ccc(cc1)Br 11a_100015525214_100000198978 [0,3,0,0,0,0|1,0,0]=4 21589 B13R1.19 CCNC(=O)Cc1ccc(cc1)Br 240690a_100015525214_100000198978 [0,3,0,0,0,0|1,0,0]=4 21590 B13R1.19 CCNC(=O)Cc1ccc(cc1)Br 527a_100015525214_100000198978 [0,3,0,0,0,0|1,0,0]=4 21591 B13R1.19 CCNC(=O)Cc1ccc(cc1)C 11a_100015525214_100000212244 [0,3,0,0,0,0|1,0,0]=4 21592 B13R1.19 CCNC(=O)Cc1ccc(cc1)C 240690a_100015525214_100000212244 [0,3,0,0,0,0|1,0,0]=4 21593 B13R1.19 CCNC(=O)Cc1ccc(cc1)C 527a_100015525214_100000212244 [0,3,0,0,0,0|1,0,0]=4 21594 B13R1.19 CCNC(=O)Cc1ccc(cc1)Cl 11a_100015525214_100000211027 [0,3,0,0,0,0|1,0,0]=4 21595 B13R1.19 CCNC(=O)Cc1ccc(cc1)Cl 240690a_100015525214_100000211027 [0,3,0,0,0,0|1,0,0]=4 21596 B13R1.19 CCNC(=O)Cc1ccc(cc1)Cl 527a_100015525214_100000211027 [0,3,0,0,0,0|1,0,0]=4 21597 B13R1.19 CCNC(=O)Cc1ccc(cc1)F 11a_100015525214_100000210951 [0,3,0,0,0,0|1,0,0]=4 21598 B13R1.19 CCNC(=O)Cc1ccc(cc1)F 240690a_100015525214_100000210951 [0,3,0,0,0,0|1,0,0]=4 21599 B13R1.19 CCNC(=O)Cc1ccc(cc1)F 527a_100015525214_100000210951 [0,3,0,0,0,0|1,0,0]=4 21600 B13R1.19 CCNC(=O)Cc1ccc(cc1)I 11a_100015525214_100000688869 [0,3,0,0,0,0|1,0,0]=4 21601 B13R1.19 CCNC(=O)Cc1ccc(cc1)I 240690a_100015525214_100000688869 [0,3,0,0,0,0|1,0,0]=4 21602 B13R1.19 CCNC(=O)Cc1ccc(cc1)I 527a_100015525214_100000688869 [0,3,0,0,0,0|1,0,0]=4 21603 B13R1.19 CCNC(=O)Cc1ccc(cc1)O 240690a_100015525214_100000198540 [0,3,0,0,0,0|1,0,0]=4 21604 B13R1.19 CCNC(=O)Cc1ccc(cc1)O 527a_100015525214_100000198540 [0,3,0,0,0,0|1,0,0]=4 21605 B13R1.19 CCOC(=O)Cc1ccc(cc1)O 271570a_203496583355_100000170549 [0,3,0,0,0,0|1,0,0]=4 21606 B13R1.19 CN(CC=O)Cc1ccc(cc1)Br 2230a_100000180866_200015260668 [0,3,0,0,0,0|1,0,0]=4 21607 B13R1.19 CN(CC=O)Cc1ccc(cc1)Br 269982a_100000180866_200015260668 [0,3,0,0,0,0|1,0,0]=4 21608 B13R1.19 CN(CC=O)Cc1ccc(cc1)Cl 2230a_100000184517_200015260668 [0,3,0,0,0,0|1,0,0]=4 21609 B13R1.19 CN(CC=O)Cc1ccc(cc1)Cl 269982a_100000184517_200015260668 [0,3,0,0,0,0|1,0,0]=4 21610 B13R1.19 CN(CC=O)Cc1ccc(cc1)Cl 34a_100000184517_200009817547 [0,3,0,0,0,0|1,0,0]=4 21611 B13R1.19 CN(CC=O)Cc1ccc(cc1)F 2230a_100000184576_200015260668 [0,3,0,0,0,0|1,0,0]=4 21612 B13R1.19 CN(CC=O)Cc1ccc(cc1)F 269982a_100000184576_200015260668 [0,3,0,0,0,0|1,0,0]=4 21613 B13R1.19 CN(CC=O)Cc1ccc(cc1)F 34a_100000184576_200009817547 [0,3,0,0,0,0|1,0,0]=4 21614 B13R1.19 CN(CC=O)Cc1ccc(cc1)O 2230a_100000207500_200015260668 [0,3,0,0,0,0|1,0,0]=4 21615 B13R1.19 CN(CC=O)Cc1ccc(cc1)O 269982a_100000207500_200015260668 [0,3,0,0,0,0|1,0,0]=4 21616 B13R1.19 CNNC(=O)Cc1ccc(cc1)Br 22a_100016993582_100000198978 [0,3,0,0,0,0|1,0,0]=4 21617 B13R1.19 CNNC(=O)Cc1ccc(cc1)C 22a_100016993582_100000212244 [0,3,0,0,0,0|1,0,0]=4 21618 B13R1.19 CNNC(=O)Cc1ccc(cc1)Cl 22a_100016993582_100000211027 [0,3,0,0,0,0|1,0,0]=4 21619 B13R1.19 CNNC(=O)Cc1ccc(cc1)F 22a_100016993582_100000210951 [0,3,0,0,0,0|1,0,0]=4 21620 B13R1.19 CNNC(=O)Cc1ccc(cc1)I 22a_100016993582_100000688869 [0,3,0,0,0,0|1,0,0]=4 21621 B13R1.19 CNNC(=O)Cc1ccc(cc1)O 22a_100016993582_100000198540 [0,3,0,0,0,0|1,0,0]=4 21622 B13R1.19 COCC(=O)Cc1ccc(cc1)Br 1458a_100000210968_100000189115 [0,3,0,0,0,0|1,0,0]=4 21623 B13R1.19 COCC(=O)Cc1ccc(cc1)C 1458a_100000210968_100000210814 [0,3,0,0,0,0|1,0,0]=4 21624 B13R1.19 COCC(=O)Cc1ccc(cc1)Cl 1458a_100000210968_100000694040 [0,3,0,0,0,0|1,0,0]=4 21625 B13R1.19 COCC(=O)Cc1ccc(cc1)F 1458a_100000210968_100000198546 [0,3,0,0,0,0|1,0,0]=4 21626 B13R1.19 COCC(=O)Cc1ccc(cc1)I 1458a_100000210968_100000189116 [0,3,0,0,0,0|1,0,0]=4 21627 B13R1.19 CSCC(=O)Cc1ccc(cc1)Br 1458a_100000184570_100000189115 [0,3,0,0,0,0|1,0,0]=4 21628 B13R1.19 CSCC(=O)Cc1ccc(cc1)C 1458a_100000184570_100000210814 [0,3,0,0,0,0|1,0,0]=4 21629 B13R1.19 CSCC(=O)Cc1ccc(cc1)Cl 1458a_100000184570_100000694040 [0,3,0,0,0,0|1,0,0]=4 21630 B13R1.19 CSCC(=O)Cc1ccc(cc1)F 1458a_100000184570_100000198546 [0,3,0,0,0,0|1,0,0]=4 21631 B13R1.19 CSCC(=O)Cc1ccc(cc1)I 1458a_100000184570_100000189116 [0,3,0,0,0,0|1,0,0]=4 21632 B13R1.19 Cc1ccc(cc1)CC(=O)C=CBr 1458a_100016273825_100000210814 [0,3,0,0,0,0|1,0,0]=4 21633 B13R1.19 Cc1ccc(cc1)CC(=O)C=CCl 1458a_200016279998_100000210814 [0,3,0,0,0,0|1,0,0]=4 21634 B13R1.19 Cc1ccc(cc1)CC(=O)C=CI 1458a_100016256311_100000210814 [0,3,0,0,0,0|1,0,0]=4 21635 B13R1.19 Cc1ccc(cc1)CC(=O)CC#N 1458a_100000212244_100011214920 [0,3,0,0,0,0|1,0,0]=4 21636 B13R1.19 Cc1ccc(cc1)CC(=O)CC#N 1458a_100051588842_100000210814 [0,3,0,0,0,0|1,0,0]=4 21637 B13R1.19 Cc1ccc(cc1)CC(=O)CCF 1458a_100000212244_100011217306 [0,3,0,0,0,0|1,0,0]=4 21638 B13R1.19 Cc1ccc(cc1)CC(=O)CCO 1458a_100000212244_100000211926 [0,3,0,0,0,0|1,0,0]=4 21639 B13R1.19 Cc1ccc(cc1)CC(=O)CCO 1458a_100011216618_100000210814 [0,3,0,0,0,0|1,0,0]=4 21640 B13R1.19 Cc1ccc(cc1)CN(C)CC=O 2230a_100000744650_200015260668 [0,3,0,0,0,0|1,0,0]=4 21641 B13R1.19 Cc1ccc(cc1)CN(C)CC=O 269982a_100000744650_200015260668 [0,3,0,0,0,0|1,0,0]=4 21642 B13R1.19 Cc1ccc(cc1)CN(C)CC=O 34a_100000744650_200009817547 [0,3,0,0,0,0|1,0,0]=4 21643 B13R1.19 N#CCC(=O)Cc1ccc(cc1)Br 1458a_100000198978_100011214920 [0,3,0,0,0,0|1,0,0]=4 21644 B13R1.19 N#CCC(=O)Cc1ccc(cc1)Br 1458a_100051588842_100000189115 [0,3,0,0,0,0|1,0,0]=4 21645 B13R1.19 N#CCC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100011214920 [0,3,0,0,0,0|1,0,0]=4 21646 B13R1.19 N#CCC(=O)Cc1ccc(cc1)Cl 1458a_100051588842_100000694040 [0,3,0,0,0,0|1,0,0]=4 21647 B13R1.19 N#CCC(=O)Cc1ccc(cc1)F 1458a_100000210951_100011214920 [0,3,0,0,0,0|1,0,0]=4 21648 B13R1.19 N#CCC(=O)Cc1ccc(cc1)F 1458a_100051588842_100000198546 [0,3,0,0,0,0|1,0,0]=4 21649 B13R1.19 N#CCC(=O)Cc1ccc(cc1)I 1458a_100000688869_100011214920 [0,3,0,0,0,0|1,0,0]=4 21650 B13R1.19 N#CCC(=O)Cc1ccc(cc1)I 1458a_100051588842_100000189116 [0,3,0,0,0,0|1,0,0]=4 21651 B13R1.19 N#CCC(=O)Cc1ccc(cc1)O 1458a_100000198540_100011214920 [0,3,0,0,0,0|1,0,0]=4 21652 B13R1.19 O=C(C=CBr)Cc1ccc(cc1)Br 1458a_100016273825_100000189115 [0,3,0,0,0,0|1,0,0]=4 21653 B13R1.19 O=C(C=CBr)Cc1ccc(cc1)Cl 1458a_100016273825_100000694040 [0,3,0,0,0,0|1,0,0]=4 21654 B13R1.19 O=C(C=CBr)Cc1ccc(cc1)F 1458a_100016273825_100000198546 [0,3,0,0,0,0|1,0,0]=4 21655 B13R1.19 O=C(C=CBr)Cc1ccc(cc1)I 1458a_100016273825_100000189116 [0,3,0,0,0,0|1,0,0]=4 21656 B13R1.19 O=C(C=CCl)Cc1ccc(cc1)Br 1458a_200016279998_100000189115 [0,3,0,0,0,0|1,0,0]=4 21657 B13R1.19 O=C(C=CCl)Cc1ccc(cc1)Cl 1458a_200016279998_100000694040 [0,3,0,0,0,0|1,0,0]=4 21658 B13R1.19 O=C(C=CCl)Cc1ccc(cc1)F 1458a_200016279998_100000198546 [0,3,0,0,0,0|1,0,0]=4 21659 B13R1.19 O=C(C=CCl)Cc1ccc(cc1)I 1458a_200016279998_100000189116 [0,3,0,0,0,0|1,0,0]=4 21660 B13R1.19 O=C(C=CI)Cc1ccc(cc1)Br 1458a_100016256311_100000189115 [0,3,0,0,0,0|1,0,0]=4 21661 B13R1.19 O=C(C=CI)Cc1ccc(cc1)Cl 1458a_100016256311_100000694040 [0,3,0,0,0,0|1,0,0]=4 21662 B13R1.19 O=C(C=CI)Cc1ccc(cc1)F 1458a_100016256311_100000198546 [0,3,0,0,0,0|1,0,0]=4 21663 B13R1.19 O=C(C=CI)Cc1ccc(cc1)I 1458a_100016256311_100000189116 [0,3,0,0,0,0|1,0,0]=4 21664 B13R1.19 O=C(CCF)Cc1ccc(cc1)Br 1458a_100000198978_100011217306 [0,3,0,0,0,0|1,0,0]=4 21665 B13R1.19 O=C(CCF)Cc1ccc(cc1)Cl 1458a_100000211027_100011217306 [0,3,0,0,0,0|1,0,0]=4 21666 B13R1.19 O=C(CCF)Cc1ccc(cc1)F 1458a_100000210951_100011217306 [0,3,0,0,0,0|1,0,0]=4 21667 B13R1.19 O=C(CCF)Cc1ccc(cc1)I 1458a_100000688869_100011217306 [0,3,0,0,0,0|1,0,0]=4 21668 B13R1.19 O=C(CCF)Cc1ccc(cc1)O 1458a_100000198540_100011217306 [0,3,0,0,0,0|1,0,0]=4 21669 B13R1.19 O=C(CCO)Cc1ccc(cc1)Br 1458a_100000198978_100000211926 [0,3,0,0,0,0|1,0,0]=4 21670 B13R1.19 O=C(CCO)Cc1ccc(cc1)Br 1458a_100011216618_100000189115 [0,3,0,0,0,0|1,0,0]=4 21671 B13R1.19 O=C(CCO)Cc1ccc(cc1)Cl 1458a_100000211027_100000211926 [0,3,0,0,0,0|1,0,0]=4 21672 B13R1.19 O=C(CCO)Cc1ccc(cc1)Cl 1458a_100011216618_100000694040 [0,3,0,0,0,0|1,0,0]=4 21673 B13R1.19 O=C(CCO)Cc1ccc(cc1)F 1458a_100000210951_100000211926 [0,3,0,0,0,0|1,0,0]=4 21674 B13R1.19 O=C(CCO)Cc1ccc(cc1)F 1458a_100011216618_100000198546 [0,3,0,0,0,0|1,0,0]=4 21675 B13R1.19 O=C(CCO)Cc1ccc(cc1)I 1458a_100000688869_100000211926 [0,3,0,0,0,0|1,0,0]=4 21676 B13R1.19 O=C(CCO)Cc1ccc(cc1)I 1458a_100011216618_100000189116 [0,3,0,0,0,0|1,0,0]=4 21677 B13R1.19 O=C(CCO)Cc1ccc(cc1)O 1458a_100000198540_100000211926 [0,3,0,0,0,0|1,0,0]=4 21678 B13R1.2679 C=CC(=O)Cc1ccc(cc1Br)Br 1458a_100000185746_200012351560 [0,3,0,0,0,0|1,0,0]=4 21679 B13R1.2679 C=CC(=O)Cc1ccc(cc1Br)Cl 1458a_100000185746_100000755608 [0,3,0,0,0,0|1,0,0]=4 21680 B13R1.2679 C=CC(=O)Cc1ccc(cc1Br)F 1458a_100000185746_100000243222 [0,3,0,0,0,0|1,0,0]=4 21681 B13R1.2679 C=CC(=O)Cc1ccc(cc1Br)I 1458a_100000185746_100010146610 [0,3,0,0,0,0|1,0,0]=4 21682 B13R1.2679 C=CC(=O)Cc1ccc(cc1C)Br 1458a_100000185746_100000708836 [0,3,0,0,0,0|1,0,0]=4 21683 B13R1.2679 C=CC(=O)Cc1ccc(cc1C)C 1458a_100000185746_100011219618 [0,3,0,0,0,0|1,0,0]=4 21684 B13R1.2679 C=CC(=O)Cc1ccc(cc1C)Cl 1458a_100000185746_100012361307 [0,3,0,0,0,0|1,0,0]=4 21685 B13R1.2679 C=CC(=O)Cc1ccc(cc1C)F 1458a_100000185746_100000700533 [0,3,0,0,0,0|1,0,0]=4 21686 B13R1.2679 C=CC(=O)Cc1ccc(cc1Cl)Br 1458a_100000185746_100011740631 [0,3,0,0,0,0|1,0,0]=4 21687 B13R1.2679 C=CC(=O)Cc1ccc(cc1Cl)C 1458a_100000185746_100012349684 [0,3,0,0,0,0|1,0,0]=4 21688 B13R1.2679 C=CC(=O)Cc1ccc(cc1Cl)Cl 1458a_100000185746_100000188473 [0,3,0,0,0,0|1,0,0]=4 21689 B13R1.2679 C=CC(=O)Cc1ccc(cc1Cl)F 1458a_100000185746_100011216360 [0,3,0,0,0,0|1,0,0]=4 21690 B13R1.2679 C=CC(=O)Cc1ccc(cc1F)Br 1458a_100000185746_100000211606 [0,3,0,0,0,0|1,0,0]=4 21691 B13R1.2679 C=CC(=O)Cc1ccc(cc1F)C 1458a_100000185746_100012002367 [0,3,0,0,0,0|1,0,0]=4 21692 B13R1.2679 C=CC(=O)Cc1ccc(cc1F)Cl 1458a_100000185746_100000709361 [0,3,0,0,0,0|1,0,0]=4 21693 B13R1.2679 C=CC(=O)Cc1ccc(cc1F)F 1458a_100000185746_100000748237 [0,3,0,0,0,0|1,0,0]=4 21694 B13R1.2679 C=CC(=O)Cc1ccc(cc1F)I 1458a_100000185746_100010244991 [0,3,0,0,0,0|1,0,0]=4 21695 B13R1.2679 C=CC(=O)Cc1ccc(cc1I)Br 1458a_100000185746_100010146615 [0,3,0,0,0,0|1,0,0]=4 21696 B13R1.2679 C=CC(=O)Cc1ccc(cc1I)Cl 1458a_100000185746_100010254388 [0,3,0,0,0,0|1,0,0]=4 21697 B13R1.2679 C=CC(=O)Cc1ccc(cc1I)F 1458a_100000185746_100012354799 [0,3,0,0,0,0|1,0,0]=4 21698 B13R1.2679 CCC(=O)Cc1ccc(cc1Br)Br 1458a_100000210414_200012351560 [0,3,0,0,0,0|1,0,0]=4 21699 B13R1.2679 CCC(=O)Cc1ccc(cc1Br)Br 1458a_100010172832_100000210202 [0,3,0,0,0,0|1,0,0]=4 21700 B13R1.2679 CCC(=O)Cc1ccc(cc1Br)Cl 1458a_100000210414_100000755608 [0,3,0,0,0,0|1,0,0]=4 21701 B13R1.2679 CCC(=O)Cc1ccc(cc1Br)Cl 1458a_100000755479_100000210202 [0,3,0,0,0,0|1,0,0]=4 21702 B13R1.2679 CCC(=O)Cc1ccc(cc1Br)F 1458a_100000210414_100000243222 [0,3,0,0,0,0|1,0,0]=4 21703 B13R1.2679 CCC(=O)Cc1ccc(cc1Br)F 1458a_100000708238_100000210202 [0,3,0,0,0,0|1,0,0]=4 21704 B13R1.2679 CCC(=O)Cc1ccc(cc1Br)I 1458a_100000210414_100010146610 [0,3,0,0,0,0|1,0,0]=4 21705 B13R1.2679 CCC(=O)Cc1ccc(cc1Br)O 1458a_100010176083_100000210202 [0,3,0,0,0,0|1,0,0]=4 21706 B13R1.2679 CCC(=O)Cc1ccc(cc1C)Br 1458a_100000210414_100000708836 [0,3,0,0,0,0|1,0,0]=4 21707 B13R1.2679 CCC(=O)Cc1ccc(cc1C)Br 1458a_100000697930_100000210202 [0,3,0,0,0,0|1,0,0]=4 21708 B13R1.2679 CCC(=O)Cc1ccc(cc1C)C 1458a_100000210414_100011219618 [0,3,0,0,0,0|1,0,0]=4 21709 B13R1.2679 CCC(=O)Cc1ccc(cc1C)C 1458a_100011236500_100000210202 [0,3,0,0,0,0|1,0,0]=4 21710 B13R1.2679 CCC(=O)Cc1ccc(cc1C)Cl 1458a_100000210414_100012361307 [0,3,0,0,0,0|1,0,0]=4 21711 B13R1.2679 CCC(=O)Cc1ccc(cc1C)F 1458a_100000210414_100000700533 [0,3,0,0,0,0|1,0,0]=4 21712 B13R1.2679 CCC(=O)Cc1ccc(cc1C)F 1458a_100011667441_100000210202 [0,3,0,0,0,0|1,0,0]=4 21713 B13R1.2679 CCC(=O)Cc1ccc(cc1Cl)Br 1458a_100000210414_100011740631 [0,3,0,0,0,0|1,0,0]=4 21714 B13R1.2679 CCC(=O)Cc1ccc(cc1Cl)Br 1458a_100012361378_100000210202 [0,3,0,0,0,0|1,0,0]=4 21715 B13R1.2679 CCC(=O)Cc1ccc(cc1Cl)C 1458a_100000210414_100012349684 [0,3,0,0,0,0|1,0,0]=4 21716 B13R1.2679 CCC(=O)Cc1ccc(cc1Cl)Cl 1458a_100000210414_100000188473 [0,3,0,0,0,0|1,0,0]=4 21717 B13R1.2679 CCC(=O)Cc1ccc(cc1Cl)Cl 1458a_100000210926_100000210202 [0,3,0,0,0,0|1,0,0]=4 21718 B13R1.2679 CCC(=O)Cc1ccc(cc1Cl)F 1458a_100000210414_100011216360 [0,3,0,0,0,0|1,0,0]=4 21719 B13R1.2679 CCC(=O)Cc1ccc(cc1Cl)F 1458a_100000690284_100000210202 [0,3,0,0,0,0|1,0,0]=4 21720 B13R1.2679 CCC(=O)Cc1ccc(cc1F)Br 1458a_100000210414_100000211606 [0,3,0,0,0,0|1,0,0]=4 21721 B13R1.2679 CCC(=O)Cc1ccc(cc1F)Br 1458a_100011295475_100000210202 [0,3,0,0,0,0|1,0,0]=4 21722 B13R1.2679 CCC(=O)Cc1ccc(cc1F)C 1458a_100000042674_100000210202 [0,3,0,0,0,0|1,0,0]=4 21723 B13R1.2679 CCC(=O)Cc1ccc(cc1F)C 1458a_100000210414_100012002367 [0,3,0,0,0,0|1,0,0]=4 21724 B13R1.2679 CCC(=O)Cc1ccc(cc1F)Cl 1458a_100000210414_100000709361 [0,3,0,0,0,0|1,0,0]=4 21725 B13R1.2679 CCC(=O)Cc1ccc(cc1F)Cl 1458a_100011830378_100000210202 [0,3,0,0,0,0|1,0,0]=4 21726 B13R1.2679 CCC(=O)Cc1ccc(cc1F)F 1458a_100000210414_100000748237 [0,3,0,0,0,0|1,0,0]=4 21727 B13R1.2679 CCC(=O)Cc1ccc(cc1F)F 1458a_100000684719_100000210202 [0,3,0,0,0,0|1,0,0]=4 21728 B13R1.2679 CCC(=O)Cc1ccc(cc1F)I 1458a_100000210414_100010244991 [0,3,0,0,0,0|1,0,0]=4 21729 B13R1.2679 CCC(=O)Cc1ccc(cc1F)I 1458a_100010149628_100000210202 [0,3,0,0,0,0|1,0,0]=4 21730 B13R1.2679 CCC(=O)Cc1ccc(cc1F)O 1458a_100000090534_100000210202 [0,3,0,0,0,0|1,0,0]=4 21731 B13R1.2679 CCC(=O)Cc1ccc(cc1I)Br 1458a_100000210414_100010146615 [0,3,0,0,0,0|1,0,0]=4 21732 B13R1.2679 CCC(=O)Cc1ccc(cc1I)Cl 1458a_100000210414_100010254388 [0,3,0,0,0,0|1,0,0]=4 21733 B13R1.2679 CCC(=O)Cc1ccc(cc1I)F 1458a_100000210414_100012354799 [0,3,0,0,0,0|1,0,0]=4 21734 B13R1.2679 CCC(=O)Cc1ccc(cc1O)Br 1458a_100000707504_100000210202 [0,3,0,0,0,0|1,0,0]=4 21735 B13R1.2679 CNC(=O)Cc1ccc(cc1Br)Br 11a_106832991635_100010172832 [0,3,0,0,0,0|1,0,0]=4 21736 B13R1.2679 CNC(=O)Cc1ccc(cc1Br)Br 240690a_100102657272_100010172832 [0,3,0,0,0,0|1,0,0]=4 21737 B13R1.2679 CNC(=O)Cc1ccc(cc1Br)Br 527a_100102657272_100010172832 [0,3,0,0,0,0|1,0,0]=4 21738 B13R1.2679 CNC(=O)Cc1ccc(cc1Br)Cl 11a_106832991635_100000755479 [0,3,0,0,0,0|1,0,0]=4 21739 B13R1.2679 CNC(=O)Cc1ccc(cc1Br)Cl 1626a_100102657272_100000755479 [0,3,0,0,0,0|1,0,0]=4 21740 B13R1.2679 CNC(=O)Cc1ccc(cc1Br)Cl 240690a_100102657272_100000755479 [0,3,0,0,0,0|1,0,0]=4 21741 B13R1.2679 CNC(=O)Cc1ccc(cc1Br)Cl 527a_100102657272_100000755479 [0,3,0,0,0,0|1,0,0]=4 21742 B13R1.2679 CNC(=O)Cc1ccc(cc1Br)F 11a_106832991635_100000708238 [0,3,0,0,0,0|1,0,0]=4 21743 B13R1.2679 CNC(=O)Cc1ccc(cc1Br)F 1626a_100102657272_100000708238 [0,3,0,0,0,0|1,0,0]=4 21744 B13R1.2679 CNC(=O)Cc1ccc(cc1Br)F 240690a_100102657272_100000708238 [0,3,0,0,0,0|1,0,0]=4 21745 B13R1.2679 CNC(=O)Cc1ccc(cc1Br)F 527a_100102657272_100000708238 [0,3,0,0,0,0|1,0,0]=4 21746 B13R1.2679 CNC(=O)Cc1ccc(cc1Br)O 240690a_100102657272_100010176083 [0,3,0,0,0,0|1,0,0]=4 21747 B13R1.2679 CNC(=O)Cc1ccc(cc1Br)O 527a_100102657272_100010176083 [0,3,0,0,0,0|1,0,0]=4 21748 B13R1.2679 CNC(=O)Cc1ccc(cc1C)Br 11a_106832991635_100000697930 [0,3,0,0,0,0|1,0,0]=4 21749 B13R1.2679 CNC(=O)Cc1ccc(cc1C)Br 1626a_100102657272_100000697930 [0,3,0,0,0,0|1,0,0]=4 21750 B13R1.2679 CNC(=O)Cc1ccc(cc1C)Br 240690a_100102657272_100000697930 [0,3,0,0,0,0|1,0,0]=4 21751 B13R1.2679 CNC(=O)Cc1ccc(cc1C)Br 527a_100102657272_100000697930 [0,3,0,0,0,0|1,0,0]=4 21752 B13R1.2679 CNC(=O)Cc1ccc(cc1C)C 11a_106832991635_100011236500 [0,3,0,0,0,0|1,0,0]=4 21753 B13R1.2679 CNC(=O)Cc1ccc(cc1C)C 1626a_100102657272_100011236500 [0,3,0,0,0,0|1,0,0]=4 21754 B13R1.2679 CNC(=O)Cc1ccc(cc1C)C 240690a_100102657272_100011236500 [0,3,0,0,0,0|1,0,0]=4 21755 B13R1.2679 CNC(=O)Cc1ccc(cc1C)C 527a_100102657272_100011236500 [0,3,0,0,0,0|1,0,0]=4 21756 B13R1.2679 CNC(=O)Cc1ccc(cc1C)F 11a_106832991635_100011667441 [0,3,0,0,0,0|1,0,0]=4 21757 B13R1.2679 CNC(=O)Cc1ccc(cc1C)F 1626a_100102657272_100011667441 [0,3,0,0,0,0|1,0,0]=4 21758 B13R1.2679 CNC(=O)Cc1ccc(cc1C)F 240690a_100102657272_100011667441 [0,3,0,0,0,0|1,0,0]=4 21759 B13R1.2679 CNC(=O)Cc1ccc(cc1C)F 527a_100102657272_100011667441 [0,3,0,0,0,0|1,0,0]=4 21760 B13R1.2679 CNC(=O)Cc1ccc(cc1Cl)Br 11a_106832991635_100012361378 [0,3,0,0,0,0|1,0,0]=4 21761 B13R1.2679 CNC(=O)Cc1ccc(cc1Cl)Br 1626a_100102657272_100012361378 [0,3,0,0,0,0|1,0,0]=4 21762 B13R1.2679 CNC(=O)Cc1ccc(cc1Cl)Br 240690a_100102657272_100012361378 [0,3,0,0,0,0|1,0,0]=4 21763 B13R1.2679 CNC(=O)Cc1ccc(cc1Cl)Br 527a_100102657272_100012361378 [0,3,0,0,0,0|1,0,0]=4 21764 B13R1.2679 CNC(=O)Cc1ccc(cc1Cl)Cl 11a_106832991635_100000210926 [0,3,0,0,0,0|1,0,0]=4 21765 B13R1.2679 CNC(=O)Cc1ccc(cc1Cl)Cl 1626a_100102657272_100000210926 [0,3,0,0,0,0|1,0,0]=4 21766 B13R1.2679 CNC(=O)Cc1ccc(cc1Cl)Cl 240690a_100102657272_100000210926 [0,3,0,0,0,0|1,0,0]=4 21767 B13R1.2679 CNC(=O)Cc1ccc(cc1Cl)Cl 527a_100102657272_100000210926 [0,3,0,0,0,0|1,0,0]=4 21768 B13R1.2679 CNC(=O)Cc1ccc(cc1Cl)F 11a_106832991635_100000690284 [0,3,0,0,0,0|1,0,0]=4 21769 B13R1.2679 CNC(=O)Cc1ccc(cc1Cl)F 1626a_100102657272_100000690284 [0,3,0,0,0,0|1,0,0]=4 21770 B13R1.2679 CNC(=O)Cc1ccc(cc1Cl)F 240690a_100102657272_100000690284 [0,3,0,0,0,0|1,0,0]=4 21771 B13R1.2679 CNC(=O)Cc1ccc(cc1Cl)F 527a_100102657272_100000690284 [0,3,0,0,0,0|1,0,0]=4 21772 B13R1.2679 CNC(=O)Cc1ccc(cc1F)Br 11a_106832991635_100011295475 [0,3,0,0,0,0|1,0,0]=4 21773 B13R1.2679 CNC(=O)Cc1ccc(cc1F)Br 1626a_100102657272_100011295475 [0,3,0,0,0,0|1,0,0]=4 21774 B13R1.2679 CNC(=O)Cc1ccc(cc1F)Br 240690a_100102657272_100011295475 [0,3,0,0,0,0|1,0,0]=4 21775 B13R1.2679 CNC(=O)Cc1ccc(cc1F)Br 527a_100102657272_100011295475 [0,3,0,0,0,0|1,0,0]=4 21776 B13R1.2679 CNC(=O)Cc1ccc(cc1F)C 11a_106832991635_100000042674 [0,3,0,0,0,0|1,0,0]=4 21777 B13R1.2679 CNC(=O)Cc1ccc(cc1F)C 1626a_100102657272_100000042674 [0,3,0,0,0,0|1,0,0]=4 21778 B13R1.2679 CNC(=O)Cc1ccc(cc1F)C 240690a_100102657272_100000042674 [0,3,0,0,0,0|1,0,0]=4 21779 B13R1.2679 CNC(=O)Cc1ccc(cc1F)C 527a_100102657272_100000042674 [0,3,0,0,0,0|1,0,0]=4 21780 B13R1.2679 CNC(=O)Cc1ccc(cc1F)Cl 11a_106832991635_100011830378 [0,3,0,0,0,0|1,0,0]=4 21781 B13R1.2679 CNC(=O)Cc1ccc(cc1F)Cl 1626a_100102657272_100011830378 [0,3,0,0,0,0|1,0,0]=4 21782 B13R1.2679 CNC(=O)Cc1ccc(cc1F)Cl 240690a_100102657272_100011830378 [0,3,0,0,0,0|1,0,0]=4 21783 B13R1.2679 CNC(=O)Cc1ccc(cc1F)Cl 527a_100102657272_100011830378 [0,3,0,0,0,0|1,0,0]=4 21784 B13R1.2679 CNC(=O)Cc1ccc(cc1F)F 11a_106832991635_100000684719 [0,3,0,0,0,0|1,0,0]=4 21785 B13R1.2679 CNC(=O)Cc1ccc(cc1F)F 1626a_100102657272_100000684719 [0,3,0,0,0,0|1,0,0]=4 21786 B13R1.2679 CNC(=O)Cc1ccc(cc1F)F 240690a_100102657272_100000684719 [0,3,0,0,0,0|1,0,0]=4 21787 B13R1.2679 CNC(=O)Cc1ccc(cc1F)F 527a_100102657272_100000684719 [0,3,0,0,0,0|1,0,0]=4 21788 B13R1.2679 CNC(=O)Cc1ccc(cc1F)I 11a_106832991635_100010149628 [0,3,0,0,0,0|1,0,0]=4 21789 B13R1.2679 CNC(=O)Cc1ccc(cc1F)I 1626a_100102657272_100010149628 [0,3,0,0,0,0|1,0,0]=4 21790 B13R1.2679 CNC(=O)Cc1ccc(cc1F)I 240690a_100102657272_100010149628 [0,3,0,0,0,0|1,0,0]=4 21791 B13R1.2679 CNC(=O)Cc1ccc(cc1F)I 527a_100102657272_100010149628 [0,3,0,0,0,0|1,0,0]=4 21792 B13R1.2679 CNC(=O)Cc1ccc(cc1F)O 240690a_100102657272_100000090534 [0,3,0,0,0,0|1,0,0]=4 21793 B13R1.2679 CNC(=O)Cc1ccc(cc1F)O 527a_100102657272_100000090534 [0,3,0,0,0,0|1,0,0]=4 21794 B13R1.2679 CNC(=O)Cc1ccc(cc1O)Br 240690a_100102657272_100000707504 [0,3,0,0,0,0|1,0,0]=4 21795 B13R1.2679 COC(=O)Cc1ccc(cc1F)O 271570a_203496583355_100013023952 [0,3,0,0,0,0|1,0,0]=4 21796 B13R1.2679 COC(=O)Cc1ccc(cc1O)F 271570a_203496583355_200012569216 [0,3,0,0,0,0|1,0,0]=4 21797 B13R1.2679 COC(=O)Cc1ccc(cc1O)O 271570a_203496583355_100010150832 [0,3,0,0,0,0|1,0,0]=4 21798 B13R1.2679 Cc1cc(ccc1CC(=O)CF)Br 1458a_100000697930_100015361967 [0,3,0,0,0,0|1,0,0]=4 21799 B13R1.2679 Cc1cc(ccc1CC(=O)CF)F 1458a_100011667441_100015361967 [0,3,0,0,0,0|1,0,0]=4 21800 B13R1.2679 Cc1cc(ccc1CC(=O)CO)Br 1458a_100000210174_100000708836 [0,3,0,0,0,0|1,0,0]=4 21801 B13R1.2679 Cc1cc(ccc1CC(=O)CO)Cl 1458a_100000210174_100012361307 [0,3,0,0,0,0|1,0,0]=4 21802 B13R1.2679 Cc1cc(ccc1CC(=O)CO)F 1458a_100000210174_100000700533 [0,3,0,0,0,0|1,0,0]=4 21803 B13R1.2679 Cc1ccc(c(c1)C)CC(=O)CF 1458a_100011236500_100015361967 [0,3,0,0,0,0|1,0,0]=4 21804 B13R1.2679 Cc1ccc(c(c1)C)CC(=O)CO 1458a_100000210174_100011219618 [0,3,0,0,0,0|1,0,0]=4 21805 B13R1.2679 Cc1ccc(c(c1)Cl)CC(=O)CO 1458a_100000210174_100012349684 [0,3,0,0,0,0|1,0,0]=4 21806 B13R1.2679 Cc1ccc(c(c1)F)CC(=O)CF 1458a_100000042674_100015361967 [0,3,0,0,0,0|1,0,0]=4 21807 B13R1.2679 Cc1ccc(c(c1)F)CC(=O)CO 1458a_100000210174_100012002367 [0,3,0,0,0,0|1,0,0]=4 21808 B13R1.2679 O=C(CF)Cc1ccc(cc1Br)Br 1458a_100010172832_100015361967 [0,3,0,0,0,0|1,0,0]=4 21809 B13R1.2679 O=C(CF)Cc1ccc(cc1Br)Cl 1458a_100000755479_100015361967 [0,3,0,0,0,0|1,0,0]=4 21810 B13R1.2679 O=C(CF)Cc1ccc(cc1Br)F 1458a_100000708238_100015361967 [0,3,0,0,0,0|1,0,0]=4 21811 B13R1.2679 O=C(CF)Cc1ccc(cc1Br)O 1458a_100010176083_100015361967 [0,3,0,0,0,0|1,0,0]=4 21812 B13R1.2679 O=C(CF)Cc1ccc(cc1Cl)Br 1458a_100012361378_100015361967 [0,3,0,0,0,0|1,0,0]=4 21813 B13R1.2679 O=C(CF)Cc1ccc(cc1Cl)Cl 1458a_100000210926_100015361967 [0,3,0,0,0,0|1,0,0]=4 21814 B13R1.2679 O=C(CF)Cc1ccc(cc1Cl)F 1458a_100000690284_100015361967 [0,3,0,0,0,0|1,0,0]=4 21815 B13R1.2679 O=C(CF)Cc1ccc(cc1F)Br 1458a_100011295475_100015361967 [0,3,0,0,0,0|1,0,0]=4 21816 B13R1.2679 O=C(CF)Cc1ccc(cc1F)Cl 1458a_100011830378_100015361967 [0,3,0,0,0,0|1,0,0]=4 21817 B13R1.2679 O=C(CF)Cc1ccc(cc1F)F 1458a_100000684719_100015361967 [0,3,0,0,0,0|1,0,0]=4 21818 B13R1.2679 O=C(CF)Cc1ccc(cc1F)I 1458a_100010149628_100015361967 [0,3,0,0,0,0|1,0,0]=4 21819 B13R1.2679 O=C(CF)Cc1ccc(cc1F)O 1458a_100000090534_100015361967 [0,3,0,0,0,0|1,0,0]=4 21820 B13R1.2679 O=C(CF)Cc1ccc(cc1O)Br 1458a_100000707504_100015361967 [0,3,0,0,0,0|1,0,0]=4 21821 B13R1.2679 O=C(CO)Cc1ccc(cc1Br)Br 1458a_100000210174_200012351560 [0,3,0,0,0,0|1,0,0]=4 21822 B13R1.2679 O=C(CO)Cc1ccc(cc1Br)Cl 1458a_100000210174_100000755608 [0,3,0,0,0,0|1,0,0]=4 21823 B13R1.2679 O=C(CO)Cc1ccc(cc1Br)F 1458a_100000210174_100000243222 [0,3,0,0,0,0|1,0,0]=4 21824 B13R1.2679 O=C(CO)Cc1ccc(cc1Br)I 1458a_100000210174_100010146610 [0,3,0,0,0,0|1,0,0]=4 21825 B13R1.2679 O=C(CO)Cc1ccc(cc1Cl)Br 1458a_100000210174_100011740631 [0,3,0,0,0,0|1,0,0]=4 21826 B13R1.2679 O=C(CO)Cc1ccc(cc1Cl)Cl 1458a_100000210174_100000188473 [0,3,0,0,0,0|1,0,0]=4 21827 B13R1.2679 O=C(CO)Cc1ccc(cc1Cl)F 1458a_100000210174_100011216360 [0,3,0,0,0,0|1,0,0]=4 21828 B13R1.2679 O=C(CO)Cc1ccc(cc1F)Br 1458a_100000210174_100000211606 [0,3,0,0,0,0|1,0,0]=4 21829 B13R1.2679 O=C(CO)Cc1ccc(cc1F)Cl 1458a_100000210174_100000709361 [0,3,0,0,0,0|1,0,0]=4 21830 B13R1.2679 O=C(CO)Cc1ccc(cc1F)F 1458a_100000210174_100000748237 [0,3,0,0,0,0|1,0,0]=4 21831 B13R1.2679 O=C(CO)Cc1ccc(cc1F)I 1458a_100000210174_100010244991 [0,3,0,0,0,0|1,0,0]=4 21832 B13R1.2679 O=C(CO)Cc1ccc(cc1I)Br 1458a_100000210174_100010146615 [0,3,0,0,0,0|1,0,0]=4 21833 B13R1.2679 O=C(CO)Cc1ccc(cc1I)Cl 1458a_100000210174_100010254388 [0,3,0,0,0,0|1,0,0]=4 21834 B13R1.2679 O=C(CO)Cc1ccc(cc1I)F 1458a_100000210174_100012354799 [0,3,0,0,0,0|1,0,0]=4 21835 B13R1.51 CC(=O)Cc1ccc(cc1C#N)Br 1458a_100000070787_100000687761 [0,3,0,0,0,0|1,0,0]=4 21836 B13R1.51 CC(=O)Cc1ccc(cc1C#N)Cl 1458a_100000070787_100000702095 [0,3,0,0,0,0|1,0,0]=4 21837 B13R1.51 CC(=O)Cc1ccc(cc1C#N)F 1458a_100000070787_100000751460 [0,3,0,0,0,0|1,0,0]=4 21838 B13R1.51 CC(=O)Cc1ccc(cc1C=O)F 1458a_100000070787_100010132769 [0,3,0,0,0,0|1,0,0]=4 21839 B13R1.51 COc1cc(ccc1CC(=O)C)Br 1458a_100000070787_100012359436 [0,3,0,0,0,0|1,0,0]=4 21840 B13R1.51 COc1cc(ccc1CC(=O)C)Br 1458a_100010245118_200000210301 [0,3,0,0,0,0|1,0,0]=4 21841 B13R1.51 COc1cc(ccc1CC(=O)C)Cl 1458a_100010217541_200000210301 [0,3,0,0,0,0|1,0,0]=4 21842 B13R1.51 COc1cc(ccc1CC(=O)C)F 1458a_100000062011_200000210301 [0,3,0,0,0,0|1,0,0]=4 21843 B13R1.51 COc1cc(ccc1CC(=O)C)F 1458a_100000070787_200010171551 [0,3,0,0,0,0|1,0,0]=4 21844 B13R1.51 COc1cc(ccc1CC(=O)[13CH3])Br 1458a_100010245118_200025704644 [0,3,0,0,0,0|1,0,0]=4 21845 B13R1.51 COc1cc(ccc1CC(=O)[13CH3])Cl 1458a_100010217541_200025704644 [0,3,0,0,0,0|1,0,0]=4 21846 B13R1.51 COc1cc(ccc1CC(=O)[13CH3])F 1458a_100000062011_200025704644 [0,3,0,0,0,0|1,0,0]=4 21847 B13R1.2808 CC(=O)Cc1c(cc(cc1Br)F)F 1458a_100000070787_100015786123 [0,3,0,0,0,0|1,0,0]=4 21848 B13R1.2808 CC(=O)Cc1c(cc(cc1C)C)C 1458a_100000070787_100000749405 [0,3,0,0,0,0|1,0,0]=4 21849 B13R1.2808 CC(=O)Cc1c(cc(cc1C)C)C 1458a_100000696705_200000210301 [0,3,0,0,0,0|1,0,0]=4 21850 B13R1.2808 CC(=O)Cc1c(cc(cc1Cl)Cl)Cl 1458a_100000070787_100012339996 [0,3,0,0,0,0|1,0,0]=4 21851 B13R1.2808 CC(=O)Cc1c(cc(cc1F)Br)F 1458a_100000070787_100012355225 [0,3,0,0,0,0|1,0,0]=4 21852 B13R1.2808 CC(=O)Cc1c(cc(cc1F)Br)F 1458a_100009813797_200000210301 [0,3,0,0,0,0|1,0,0]=4 21853 B13R1.2808 CC(=O)Cc1c(cc(cc1F)Cl)F 1458a_100000070787_100009813723 [0,3,0,0,0,0|1,0,0]=4 21854 B13R1.2808 CC(=O)Cc1c(cc(cc1F)F)F 1458a_100000037057_200000210301 [0,3,0,0,0,0|1,0,0]=4 21855 B13R1.2808 CC(=O)Cc1c(cc(cc1F)F)F 1458a_100000070787_100011216150 [0,3,0,0,0,0|1,0,0]=4 21856 B13R1.2808 Cc1cc(c(c(c1)C)CC(=O)[13CH3])C 1458a_100000696705_200025704644 [0,3,0,0,0,0|1,0,0]=4 21857 B13R1.2808 [13CH3]C(=O)Cc1c(cc(cc1F)Br)F 1458a_100009813797_200025704644 [0,3,0,0,0,0|1,0,0]=4 21858 B13R1.2808 [13CH3]C(=O)Cc1c(cc(cc1F)F)F 1458a_100000037057_200025704644 [0,3,0,0,0,0|1,0,0]=4 21859 B13R1.22 CC(C(=O)CF)c1cccc(c1)Br 1458a_100000722698_100015361967 [0,3,0,0,0,0|1,0,0]=4 21860 B13R1.22 CC(C(=O)CF)c1cccc(c1)Cl 1458a_100000762818_100015361967 [0,3,0,0,0,0|1,0,0]=4 21861 B13R1.22 CC(C(=O)CF)c1cccc(c1)F 1458a_100000762896_100015361967 [0,3,0,0,0,0|1,0,0]=4 21862 B13R1.22 CCC(=O)C(C)c1cccc(c1)Br 1458a_100000722698_100000210202 [0,3,0,0,0,0|1,0,0]=4 21863 B13R1.22 CCC(=O)C(C)c1cccc(c1)Cl 1458a_100000762818_100000210202 [0,3,0,0,0,0|1,0,0]=4 21864 B13R1.22 CCC(=O)C(C)c1cccc(c1)F 1458a_100000762896_100000210202 [0,3,0,0,0,0|1,0,0]=4 21865 B13R1.22 CCC(=O)C(O)c1cccc(c1)C 1458a_100011434945_100000210202 [0,3,0,0,0,0|1,0,0]=4 21866 B13R1.22 CCC(=O)C(O)c1cccc(c1)Cl 1458a_100011216955_100000210202 [0,3,0,0,0,0|1,0,0]=4 21867 B13R1.22 CCC(=O)C(O)c1cccc(c1)F 1458a_100011434943_100000210202 [0,3,0,0,0,0|1,0,0]=4 21868 B13R1.22 CCC(=O)[C@H](C)c1cccc(c1)C 1458a_200009911544_100000210202 [0,3,0,0,0,0|1,0,0]=4 21869 B13R1.22 CNC(=O)C(C)c1cccc(c1)Br 11a_106832991635_100000722698 [0,3,0,0,0,0|1,0,0]=4 21870 B13R1.22 CNC(=O)C(C)c1cccc(c1)Br 1626a_100102657272_100000722698 [0,3,0,0,0,0|1,0,0]=4 21871 B13R1.22 CNC(=O)C(C)c1cccc(c1)Br 240690a_100102657272_100000722698 [0,3,0,0,0,0|1,0,0]=4 21872 B13R1.22 CNC(=O)C(C)c1cccc(c1)Br 527a_100102657272_100000722698 [0,3,0,0,0,0|1,0,0]=4 21873 B13R1.22 CNC(=O)C(C)c1cccc(c1)Cl 11a_106832991635_100000762818 [0,3,0,0,0,0|1,0,0]=4 21874 B13R1.22 CNC(=O)C(C)c1cccc(c1)Cl 1626a_100102657272_100000762818 [0,3,0,0,0,0|1,0,0]=4 21875 B13R1.22 CNC(=O)C(C)c1cccc(c1)Cl 240690a_100102657272_100000762818 [0,3,0,0,0,0|1,0,0]=4 21876 B13R1.22 CNC(=O)C(C)c1cccc(c1)Cl 527a_100102657272_100000762818 [0,3,0,0,0,0|1,0,0]=4 21877 B13R1.22 CNC(=O)C(C)c1cccc(c1)F 11a_106832991635_100000762896 [0,3,0,0,0,0|1,0,0]=4 21878 B13R1.22 CNC(=O)C(C)c1cccc(c1)F 1626a_100102657272_100000762896 [0,3,0,0,0,0|1,0,0]=4 21879 B13R1.22 CNC(=O)C(C)c1cccc(c1)F 240690a_100102657272_100000762896 [0,3,0,0,0,0|1,0,0]=4 21880 B13R1.22 CNC(=O)C(C)c1cccc(c1)F 527a_100102657272_100000762896 [0,3,0,0,0,0|1,0,0]=4 21881 B13R1.22 CNC(=O)C(O)c1cccc(c1)C 240690a_100102657272_100011434945 [0,3,0,0,0,0|1,0,0]=4 21882 B13R1.22 CNC(=O)C(O)c1cccc(c1)Cl 240690a_100102657272_100011216955 [0,3,0,0,0,0|1,0,0]=4 21883 B13R1.22 CNC(=O)C(O)c1cccc(c1)F 240690a_100102657272_100011434943 [0,3,0,0,0,0|1,0,0]=4 21884 B13R1.22 CNC(=O)[C@H](C)c1cccc(c1)C 11a_106832991635_200009911544 [0,3,0,0,0,0|1,0,0]=4 21885 B13R1.22 CNC(=O)[C@H](C)c1cccc(c1)C 1626a_100102657272_200009911544 [0,3,0,0,0,0|1,0,0]=4 21886 B13R1.22 CNC(=O)[C@H](C)c1cccc(c1)C 240690a_100102657272_200009911544 [0,3,0,0,0,0|1,0,0]=4 21887 B13R1.22 CNC(=O)[C@H](C)c1cccc(c1)C 527a_100102657272_200009911544 [0,3,0,0,0,0|1,0,0]=4 21888 B13R1.22 COC(=O)C(C)c1cccc(c1)O 271570a_203496583355_100010077029 [0,3,0,0,0,0|1,0,0]=4 21889 B13R1.22 COC(=O)C(N)c1cccc(c1)O 271570a_203496583355_100015207118 [0,3,0,0,0,0|1,0,0]=4 21890 B13R1.22 Cc1cccc(c1)C(O)C(=O)CF 1458a_100011434945_100015361967 [0,3,0,0,0,0|1,0,0]=4 21891 B13R1.22 Cc1cccc(c1)[C@@H](C)C(=O)CF 1458a_200009911544_100015361967 [0,3,0,0,0,0|1,0,0]=4 21892 B13R1.22 O=C(CF)C(O)c1cccc(c1)Cl 1458a_100011216955_100015361967 [0,3,0,0,0,0|1,0,0]=4 21893 B13R1.22 O=C(CF)C(O)c1cccc(c1)F 1458a_100011434943_100015361967 [0,3,0,0,0,0|1,0,0]=4 21894 B13R1.47 C#CCC(=O)C(C)c1ccccc1 1458a_100011220946_100000230085 [0,3,0,0,0,0|1,0,0]=4 21895 B13R1.47 C#CCC(=O)C(F)c1ccccc1 1458a_100000698975_100000184674 [0,3,0,0,0,0|1,0,0]=4 21896 B13R1.47 C#CCC(=O)[C@@H](C)c1ccccc1 1458a_100000751047_100000184674 [0,3,0,0,0,0|1,0,0]=4 21897 B13R1.47 C#CCC(=O)[C@H](O)c1ccccc1 1458a_100000684486_100000184674 [0,3,0,0,0,0|1,0,0]=4 21898 B13R1.47 C=CCC(=O)C(C)c1ccccc1 1458a_100000210193_100000230085 [0,3,0,0,0,0|1,0,0]=4 21899 B13R1.47 C=CCC(=O)C(F)c1ccccc1 1458a_100000698975_100000210623 [0,3,0,0,0,0|1,0,0]=4 21900 B13R1.47 C=CCC(=O)[C@@H](C)c1ccccc1 1458a_100000751047_100000210623 [0,3,0,0,0,0|1,0,0]=4 21901 B13R1.47 C=CCC(=O)[C@H](O)c1ccccc1 1458a_100000684486_100000210623 [0,3,0,0,0,0|1,0,0]=4 21902 B13R1.47 C=CCN(C)C(C)c1ccccc1 2230a_100000195388_100000210623 [0,3,0,0,0,0|1,0,0]=4 21903 B13R1.47 C=CCN(C)C(C)c1ccccc1 2230a_100000225617_100000230085 [0,3,0,0,0,0|1,0,0]=4 21904 B13R1.47 C=CCN(C)C(C)c1ccccc1 269982a_100000195388_100000210623 [0,3,0,0,0,0|1,0,0]=4 21905 B13R1.47 C=CCN(C)C(C)c1ccccc1 269982a_100000225617_100000230085 [0,3,0,0,0,0|1,0,0]=4 21906 B13R1.47 CC#CC(=O)C(C)c1ccccc1 1458a_100000763181_100000230085 [0,3,0,0,0,0|1,0,0]=4 21907 B13R1.47 CC(C(=O)C=CBr)c1ccccc1 1458a_100016273825_100000230085 [0,3,0,0,0,0|1,0,0]=4 21908 B13R1.47 CC(C(=O)C=CCl)c1ccccc1 1458a_200016279998_100000230085 [0,3,0,0,0,0|1,0,0]=4 21909 B13R1.47 CC(C(=O)C=CI)c1ccccc1 1458a_100016256311_100000230085 [0,3,0,0,0,0|1,0,0]=4 21910 B13R1.47 CC(C(=O)CC#N)c1ccccc1 1458a_100051588842_100000230085 [0,3,0,0,0,0|1,0,0]=4 21911 B13R1.47 CC(C(=O)CCO)c1ccccc1 1458a_100011216618_100000230085 [0,3,0,0,0,0|1,0,0]=4 21912 B13R1.47 CC(c1ccccc1)N(C)CC=O 2230a_100000195388_200015260668 [0,3,0,0,0,0|1,0,0]=4 21913 B13R1.47 CC(c1ccccc1)N(C)CC=O 269982a_100000195388_200015260668 [0,3,0,0,0,0|1,0,0]=4 21914 B13R1.47 CC=CC(=O)C(C)c1ccccc1 1458a_100000210699_100000230085 [0,3,0,0,0,0|1,0,0]=4 21915 B13R1.47 CCCC(=O)C(C)c1ccccc1 1458a_100000211992_100000230085 [0,3,0,0,0,0|1,0,0]=4 21916 B13R1.47 CCCC(=O)C(F)c1ccccc1 1458a_100000698975_100000210303 [0,3,0,0,0,0|1,0,0]=4 21917 B13R1.47 CCCC(=O)[C@@H](C)c1ccccc1 1458a_100000751047_100000210303 [0,3,0,0,0,0|1,0,0]=4 21918 B13R1.47 CCCC(=O)[C@H](O)c1ccccc1 1458a_100000684486_100000210303 [0,3,0,0,0,0|1,0,0]=4 21919 B13R1.47 CCNC(=O)C(F)c1ccccc1 11a_100015525214_100000698975 [0,3,0,0,0,0|1,0,0]=4 21920 B13R1.47 CCNC(=O)C(F)c1ccccc1 240690a_100015525214_100000698975 [0,3,0,0,0,0|1,0,0]=4 21921 B13R1.47 CCNC(=O)C(F)c1ccccc1 527a_100015525214_100000698975 [0,3,0,0,0,0|1,0,0]=4 21922 B13R1.47 CCNC(=O)[C@@H](C)c1ccccc1 11a_100015525214_100000751047 [0,3,0,0,0,0|1,0,0]=4 21923 B13R1.47 CCNC(=O)[C@@H](C)c1ccccc1 240690a_100015525214_100000751047 [0,3,0,0,0,0|1,0,0]=4 21924 B13R1.47 CCNC(=O)[C@@H](C)c1ccccc1 527a_100015525214_100000751047 [0,3,0,0,0,0|1,0,0]=4 21925 B13R1.47 CCNC(=O)[C@H](O)c1ccccc1 240690a_100015525214_100000684486 [0,3,0,0,0,0|1,0,0]=4 21926 B13R1.47 CNNC(=O)C(F)c1ccccc1 22a_100016993582_100000698975 [0,3,0,0,0,0|1,0,0]=4 21927 B13R1.47 CNNC(=O)[C@@H](C)c1ccccc1 22a_100016993582_100000751047 [0,3,0,0,0,0|1,0,0]=4 21928 B13R1.47 CNNC(=O)[C@H](O)c1ccccc1 22a_100016993582_100000684486 [0,3,0,0,0,0|1,0,0]=4 21929 B13R1.47 COCC(=O)C(C)c1ccccc1 1458a_100000210968_100000230085 [0,3,0,0,0,0|1,0,0]=4 21930 B13R1.47 CSCC(=O)C(C)c1ccccc1 1458a_100000184570_100000230085 [0,3,0,0,0,0|1,0,0]=4 21931 B13R1.47 C[C@H](C(=O)CC#N)c1ccccc1 1458a_100000751047_100011214920 [0,3,0,0,0,0|1,0,0]=4 21932 B13R1.47 C[C@H](C(=O)CCF)c1ccccc1 1458a_100000751047_100011217306 [0,3,0,0,0,0|1,0,0]=4 21933 B13R1.47 C[C@H](C(=O)CCO)c1ccccc1 1458a_100000751047_100000211926 [0,3,0,0,0,0|1,0,0]=4 21934 B13R1.47 N#CCC(=O)C(F)c1ccccc1 1458a_100000698975_100011214920 [0,3,0,0,0,0|1,0,0]=4 21935 B13R1.47 N#CCC(=O)[C@H](O)c1ccccc1 1458a_100000684486_100011214920 [0,3,0,0,0,0|1,0,0]=4 21936 B13R1.47 O=C(CCF)C(F)c1ccccc1 1458a_100000698975_100011217306 [0,3,0,0,0,0|1,0,0]=4 21937 B13R1.47 O=C(CCF)[C@H](O)c1ccccc1 1458a_100000684486_100011217306 [0,3,0,0,0,0|1,0,0]=4 21938 B13R1.47 O=C(CCO)C(F)c1ccccc1 1458a_100000698975_100000211926 [0,3,0,0,0,0|1,0,0]=4 21939 B13R1.47 O=C(CCO)[C@H](O)c1ccccc1 1458a_100000684486_100000211926 [0,3,0,0,0,0|1,0,0]=4 21940 B13R1.532 CCC(=O)C(CC)c1ccccc1 1458a_100000211302_100000210202 [0,3,0,0,0,0|1,0,0]=4 21941 B13R1.532 CCC(=O)C(CO)c1ccccc1 1458a_100011218805_100000210202 [0,3,0,0,0,0|1,0,0]=4 21942 B13R1.532 CCC(=O)[C@H](OC)c1ccccc1 1458a_100000698336_100000210202 [0,3,0,0,0,0|1,0,0]=4 21943 B13R1.532 CCC(C(=O)CF)c1ccccc1 1458a_100000211302_100015361967 [0,3,0,0,0,0|1,0,0]=4 21944 B13R1.532 CCC(C(=O)NC)c1ccccc1 11a_106832991635_100000211302 [0,3,0,0,0,0|1,0,0]=4 21945 B13R1.532 CCC(C(=O)NC)c1ccccc1 1626a_100102657272_100000211302 [0,3,0,0,0,0|1,0,0]=4 21946 B13R1.532 CCC(C(=O)NC)c1ccccc1 240690a_100102657272_100000211302 [0,3,0,0,0,0|1,0,0]=4 21947 B13R1.532 CCC(C(=O)NC)c1ccccc1 527a_100102657272_100000211302 [0,3,0,0,0,0|1,0,0]=4 21948 B13R1.532 CNC(=O)C(CO)c1ccccc1 240690a_100102657272_100011218805 [0,3,0,0,0,0|1,0,0]=4 21949 B13R1.532 CNC(=O)C(NC)c1ccccc1 2230a_100000741928_200000210301 [0,3,0,0,0,0|1,0,0]=4 21950 B13R1.532 CNC(=O)C(NC)c1ccccc1 34a_100000741928_200000210301 [0,3,0,0,0,0|1,0,0]=4 21951 B13R1.532 CNC(=O)C(N[13CH3])c1ccccc1 2230a_100000741928_200025704644 [0,3,0,0,0,0|1,0,0]=4 21952 B13R1.532 CNC(=O)C(N[13CH3])c1ccccc1 34a_100000741928_200025704644 [0,3,0,0,0,0|1,0,0]=4 21953 B13R1.532 CNC(=O)C(OC)c1ccccc1 34a_100012026080_200000210301 [0,3,0,0,0,0|1,0,0]=4 21954 B13R1.532 CNC(=O)C(O[13CH3])c1ccccc1 34a_100012026080_200025704644 [0,3,0,0,0,0|1,0,0]=4 21955 B13R1.532 CNC(=O)[C@H](OC)c1ccccc1 11a_106832991635_100000698336 [0,3,0,0,0,0|1,0,0]=4 21956 B13R1.532 CNC(=O)[C@H](OC)c1ccccc1 1626a_100102657272_100000698336 [0,3,0,0,0,0|1,0,0]=4 21957 B13R1.532 CNC(=O)[C@H](OC)c1ccccc1 240690a_100102657272_100000698336 [0,3,0,0,0,0|1,0,0]=4 21958 B13R1.532 CNC(=O)[C@H](OC)c1ccccc1 527a_100102657272_100000698336 [0,3,0,0,0,0|1,0,0]=4 21959 B13R1.532 CNC(C(=O)OC)c1ccccc1 2230a_106832991635_100000754950 [0,3,0,0,0,0|1,0,0]=4 21960 B13R1.532 CNC(C(=O)OC)c1ccccc1 34a_100102657272_100000185205 [0,3,0,0,0,0|1,0,0]=4 21961 B13R1.532 CNC(C(=O)OC)c1ccccc1 7a_106832991635_100000754950 [0,3,0,0,0,0|1,0,0]=4 21962 B13R1.532 COC(=O)C(OC)c1ccccc1 34a_100138415774_100000185205 [0,3,0,0,0,0|1,0,0]=4 21963 B13R1.532 COC(=O)C(SC)c1ccccc1 62a_100000754950_200000210301 [0,3,0,0,0,0|1,0,0]=4 21964 B13R1.532 COC(=O)C(SC)c1ccccc1 62a_200000210301_100000754950 [0,3,0,0,0,0|1,0,0]=4 21965 B13R1.532 COC(=O)C(S[13CH3])c1ccccc1 62a_100000754950_200025704644 [0,3,0,0,0,0|1,0,0]=4 21966 B13R1.532 COC(=O)C(S[13CH3])c1ccccc1 62a_200025704644_100000754950 [0,3,0,0,0,0|1,0,0]=4 21967 B13R1.532 COC(=O)[C@H](OC)c1ccccc1 34a_100009815907_200000210301 [0,3,0,0,0,0|1,0,0]=4 21968 B13R1.532 COC(=O)[C@H](O[13CH3])c1ccccc1 34a_100009815907_200025704644 [0,3,0,0,0,0|1,0,0]=4 21969 B13R1.532 CO[C@@H](C(=O)CF)c1ccccc1 1458a_100000698336_100015361967 [0,3,0,0,0,0|1,0,0]=4 21970 B13R1.532 O=C(CF)C(CO)c1ccccc1 1458a_100011218805_100015361967 [0,3,0,0,0,0|1,0,0]=4 21971 B13R1.696 C=CC(=O)C(C)c1ccccc1Cl 1458a_100000185746_100000181259 [0,3,0,0,0,0|1,0,0]=4 21972 B13R1.696 C=CC(=O)C(C)c1ccccc1F 1458a_100000185746_200000741388 [0,3,0,0,0,0|1,0,0]=4 21973 B13R1.696 CC(C(=O)CF)c1ccccc1Br 1458a_100012359601_100015361967 [0,3,0,0,0,0|1,0,0]=4 21974 B13R1.696 CC(C(=O)CF)c1ccccc1Cl 1458a_100011667492_100015361967 [0,3,0,0,0,0|1,0,0]=4 21975 B13R1.696 CC(C(=O)CO)c1ccccc1Cl 1458a_100000210174_100000181259 [0,3,0,0,0,0|1,0,0]=4 21976 B13R1.696 CC(C(=O)CO)c1ccccc1F 1458a_100000210174_200000741388 [0,3,0,0,0,0|1,0,0]=4 21977 B13R1.696 CCC(=O)C(C)c1ccccc1Br 1458a_100012359601_100000210202 [0,3,0,0,0,0|1,0,0]=4 21978 B13R1.696 CCC(=O)C(C)c1ccccc1Cl 1458a_100000210414_100000181259 [0,3,0,0,0,0|1,0,0]=4 21979 B13R1.696 CCC(=O)C(C)c1ccccc1Cl 1458a_100011667492_100000210202 [0,3,0,0,0,0|1,0,0]=4 21980 B13R1.696 CCC(=O)C(C)c1ccccc1F 1458a_100000210414_200000741388 [0,3,0,0,0,0|1,0,0]=4 21981 B13R1.696 CCC(=O)C(O)c1ccccc1Br 1458a_200011356456_100000210202 [0,3,0,0,0,0|1,0,0]=4 21982 B13R1.696 CCC(=O)C(O)c1ccccc1Cl 1458a_100011217820_100000210202 [0,3,0,0,0,0|1,0,0]=4 21983 B13R1.696 CCC(=O)C(O)c1ccccc1F 1458a_100011219519_100000210202 [0,3,0,0,0,0|1,0,0]=4 21984 B13R1.696 CNC(=O)C(C)c1ccccc1Br 11a_106832991635_100012359601 [0,3,0,0,0,0|1,0,0]=4 21985 B13R1.696 CNC(=O)C(C)c1ccccc1Br 1626a_100102657272_100012359601 [0,3,0,0,0,0|1,0,0]=4 21986 B13R1.696 CNC(=O)C(C)c1ccccc1Br 240690a_100102657272_100012359601 [0,3,0,0,0,0|1,0,0]=4 21987 B13R1.696 CNC(=O)C(C)c1ccccc1Br 527a_100102657272_100012359601 [0,3,0,0,0,0|1,0,0]=4 21988 B13R1.696 CNC(=O)C(C)c1ccccc1Cl 11a_106832991635_100011667492 [0,3,0,0,0,0|1,0,0]=4 21989 B13R1.696 CNC(=O)C(C)c1ccccc1Cl 1626a_100102657272_100011667492 [0,3,0,0,0,0|1,0,0]=4 21990 B13R1.696 CNC(=O)C(C)c1ccccc1Cl 240690a_100102657272_100011667492 [0,3,0,0,0,0|1,0,0]=4 21991 B13R1.696 CNC(=O)C(C)c1ccccc1Cl 527a_100102657272_100011667492 [0,3,0,0,0,0|1,0,0]=4 21992 B13R1.696 CNC(=O)C(O)c1ccccc1Br 240690a_100102657272_200011356456 [0,3,0,0,0,0|1,0,0]=4 21993 B13R1.696 CNC(=O)C(O)c1ccccc1Cl 240690a_100102657272_100011217820 [0,3,0,0,0,0|1,0,0]=4 21994 B13R1.696 CNC(=O)C(O)c1ccccc1F 240690a_100102657272_100011219519 [0,3,0,0,0,0|1,0,0]=4 21995 B13R1.696 COC(=O)C(O)c1ccccc1O 271570a_203496583355_200011625927 [0,3,0,0,0,0|1,0,0]=4 21996 B13R1.696 O=C(CF)C(O)c1ccccc1Br 1458a_200011356456_100015361967 [0,3,0,0,0,0|1,0,0]=4 21997 B13R1.696 O=C(CF)C(O)c1ccccc1Cl 1458a_100011217820_100015361967 [0,3,0,0,0,0|1,0,0]=4 21998 B13R1.696 O=C(CF)C(O)c1ccccc1F 1458a_100011219519_100015361967 [0,3,0,0,0,0|1,0,0]=4 21999 B13R1.708 C=CC(=O)C(C)(C)c1ccccc1 1458a_100000185746_100000034625 [0,3,0,0,0,0|1,0,0]=4 22000 B13R1.708 C=CC(=O)C(F)(F)c1ccccc1 1458a_100000185746_100000036403 [0,3,0,0,0,0|1,0,0]=4 22001 B13R1.708 CC(C)(C(=O)CF)c1ccccc1 1458a_100000211857_100015361967 [0,3,0,0,0,0|1,0,0]=4 22002 B13R1.708 CC(C)(C(=O)CO)c1ccccc1 1458a_100000210174_100000034625 [0,3,0,0,0,0|1,0,0]=4 22003 B13R1.708 CCC(=O)C(C)(C)c1ccccc1 1458a_100000210414_100000034625 [0,3,0,0,0,0|1,0,0]=4 22004 B13R1.708 CCC(=O)C(C)(C)c1ccccc1 1458a_100000211857_100000210202 [0,3,0,0,0,0|1,0,0]=4 22005 B13R1.708 CCC(=O)C(F)(F)c1ccccc1 1458a_100000210414_100000036403 [0,3,0,0,0,0|1,0,0]=4 22006 B13R1.708 CCC(=O)[C@](C)(O)c1ccccc1 1458a_100000753667_100000210202 [0,3,0,0,0,0|1,0,0]=4 22007 B13R1.708 CNC(=O)C(C)(C)c1ccccc1 11a_106832991635_100000211857 [0,3,0,0,0,0|1,0,0]=4 22008 B13R1.708 CNC(=O)C(C)(C)c1ccccc1 1626a_100102657272_100000211857 [0,3,0,0,0,0|1,0,0]=4 22009 B13R1.708 CNC(=O)C(C)(C)c1ccccc1 240690a_100102657272_100000211857 [0,3,0,0,0,0|1,0,0]=4 22010 B13R1.708 CNC(=O)C(C)(C)c1ccccc1 527a_100102657272_100000211857 [0,3,0,0,0,0|1,0,0]=4 22011 B13R1.708 CNC(=O)C(F)(F)c1ccccc1 11a_106832991635_100000182030 [0,3,0,0,0,0|1,0,0]=4 22012 B13R1.708 CNC(=O)C(F)(F)c1ccccc1 1626a_100102657272_100000182030 [0,3,0,0,0,0|1,0,0]=4 22013 B13R1.708 CNC(=O)C(F)(F)c1ccccc1 240690a_100102657272_100000182030 [0,3,0,0,0,0|1,0,0]=4 22014 B13R1.708 CNC(=O)C(F)(F)c1ccccc1 527a_100102657272_100000182030 [0,3,0,0,0,0|1,0,0]=4 22015 B13R1.708 CNC(=O)[C@](C)(O)c1ccccc1 240690a_100102657272_100000753667 [0,3,0,0,0,0|1,0,0]=4 22016 B13R1.708 C[C@](O)(C(=O)CF)c1ccccc1 1458a_100000753667_100015361967 [0,3,0,0,0,0|1,0,0]=4 22017 B13R1.708 O=C(CO)C(F)(F)c1ccccc1 1458a_100000210174_100000036403 [0,3,0,0,0,0|1,0,0]=4 22018 B13R1.89 COc1ccccc1C(C)C(=O)C 1458a_100011435281_200000210301 [0,3,0,0,0,0|1,0,0]=4 22019 B13R1.89 COc1ccccc1C(C)C(=O)[13CH3] 1458a_100011435281_200025704644 [0,3,0,0,0,0|1,0,0]=4 22020 B13R1.720 CCC(C(=O)C)c1ccccc1Cl 1458a_100011667493_200000210301 [0,3,0,0,0,0|1,0,0]=4 22021 B13R1.720 CCC(C(=O)[13CH3])c1ccccc1Cl 1458a_100011667493_200025704644 [0,3,0,0,0,0|1,0,0]=4 22022 B13R1.720 COC(C(=O)C)c1ccccc1C 1458a_100012277922_200000210301 [0,3,0,0,0,0|1,0,0]=4 22023 B13R1.720 COC(C(=O)C)c1ccccc1F 1458a_100012277919_200000210301 [0,3,0,0,0,0|1,0,0]=4 22024 B13R1.720 COC(C(=O)[13CH3])c1ccccc1C 1458a_100012277922_200025704644 [0,3,0,0,0,0|1,0,0]=4 22025 B13R1.720 COC(C(=O)[13CH3])c1ccccc1F 1458a_100012277919_200025704644 [0,3,0,0,0,0|1,0,0]=4 22026 B13R1.897 CC(=O)C(O)c1cc(ccc1C)C 1458a_100011497465_200000210301 [0,3,0,0,0,0|1,0,0]=4 22027 B13R1.897 CC(=O)C(O)c1cc(ccc1F)F 1458a_200011216140_200000210301 [0,3,0,0,0,0|1,0,0]=4 22028 B13R1.897 Cc1ccc(c(c1)C(O)C(=O)[13CH3])C 1458a_100011497465_200025704644 [0,3,0,0,0,0|1,0,0]=4 22029 B13R1.897 [13CH3]C(=O)C(O)c1cc(ccc1F)F 1458a_200011216140_200025704644 [0,3,0,0,0,0|1,0,0]=4 22030 B13R1.3768 CC(=O)C(C)c1cccc(c1C)C 1458a_100000070787_100012183177 [0,3,0,0,0,0|1,0,0]=4 22031 B13R1.3768 CC(=O)C(O)c1cccc(c1F)F 1458a_200011215923_200000210301 [0,3,0,0,0,0|1,0,0]=4 22032 B13R1.3768 [13CH3]C(=O)C(O)c1cccc(c1F)F 1458a_200011215923_200025704644 [0,3,0,0,0,0|1,0,0]=4 22033 B13R1.3789 CC(=O)C(O)c1c(cccc1F)F 1458a_200011216624_200000210301 [0,3,0,0,0,0|1,0,0]=4 22034 B13R1.3789 [13CH3]C(=O)C(O)c1c(cccc1F)F 1458a_200011216624_200025704644 [0,3,0,0,0,0|1,0,0]=4 22035 B13R1.3802 CC(=O)C(C)(C)c1ccccc1F 1458a_100000748980_200000210301 [0,3,0,0,0,0|1,0,0]=4 22036 B13R1.3802 CC(=O)C(F)(F)c1ccccc1F 1458a_100000070787_100000070671 [0,3,0,0,0,0|1,0,0]=4 22037 B13R1.3802 CC(C)(C(=O)[13CH3])c1ccccc1F 1458a_100000748980_200025704644 [0,3,0,0,0,0|1,0,0]=4 22038 B13R1.716 COC(C(=O)C)c1cccc(c1)Cl 1458a_100012350482_200000210301 [0,3,0,0,0,0|1,0,0]=4 22039 B13R1.716 COC(C(=O)[13CH3])c1cccc(c1)Cl 1458a_100012350482_200025704644 [0,3,0,0,0,0|1,0,0]=4 22040 B13R1.3423 CC(=O)C(O)c1cc(cc(c1)F)F 1458a_100011218751_200000210301 [0,3,0,0,0,0|1,0,0]=4 22041 B13R1.3423 [13CH3]C(=O)C(O)c1cc(cc(c1)F)F 1458a_100011218751_200025704644 [0,3,0,0,0,0|1,0,0]=4 22042 B13R1.3493 CC(=O)C(C)(C)c1cccc(c1)Br 1458a_100000749669_200000210301 [0,3,0,0,0,0|1,0,0]=4 22043 B13R1.3493 CC(=O)C(C)(C)c1cccc(c1)Cl 1458a_100000758063_200000210301 [0,3,0,0,0,0|1,0,0]=4 22044 B13R1.3493 CC(C)(C(=O)[13CH3])c1cccc(c1)Br 1458a_100000749669_200025704644 [0,3,0,0,0,0|1,0,0]=4 22045 B13R1.3493 CC(C)(C(=O)[13CH3])c1cccc(c1)Cl 1458a_100000758063_200025704644 [0,3,0,0,0,0|1,0,0]=4 22046 B13R1.3085 CCC(O)(C(=O)C)c1ccccc1 1458a_100011434905_200000210301 [0,3,0,0,0,0|1,0,0]=4 22047 B13R1.3085 CCC(O)(C(=O)[13CH3])c1ccccc1 1458a_100011434905_200025704644 [0,3,0,0,0,0|1,0,0]=4 22048 B13R1.405 C=C(C)C(OCC)c1ccccc1 34a_200011216824_100000210202 [0,3,0,0,0,0|0,0,0]=3 22049 B13R1.405 C=C(C)C(OCC)c1ccccc1 7a_200011216824_100000210202 [0,3,0,0,0,0|0,0,0]=3 22050 B13R1.405 C=C(C)C(OCF)c1ccccc1 34a_200011216824_100015361967 [0,3,0,0,0,0|0,0,0]=3 22051 B13R1.405 C=C(C)C(OCF)c1ccccc1 7a_200011216824_100015361967 [0,3,0,0,0,0|0,0,0]=3 22052 B13R1.405 CC(=O)C(CCCl)c1ccccc1 1458a_100000070787_200010132975 [0,3,0,0,0,0|1,0,0]=4 22053 B13R1.405 CC(=O)C(SCF)c1ccccc1 62a_100009888967_100015361967 [0,3,0,0,0,0|1,0,0]=4 22054 B13R1.405 CC(=O)C(SCF)c1ccccc1 62a_100015361967_100009888967 [0,3,0,0,0,0|1,0,0]=4 22055 B13R1.405 CCNC(C(=O)C)c1ccccc1 2230a_100015525214_100009888967 [0,3,0,0,0,0|1,0,0]=4 22056 B13R1.405 CCSC(C(=O)C)c1ccccc1 62a_100000210202_100009888967 [0,3,0,0,0,0|1,0,0]=4 22057 B13R1.405 CCSC(C(=O)C)c1ccccc1 62a_100009888967_100000210202 [0,3,0,0,0,0|1,0,0]=4 22058 B13R1.1111 CC(=O)C(C(=O)C)c1ccccc1 1458a_100000070787_100009888967 [0,3,0,0,0,0|1,0,0]=4 22059 B13R1.1111 CC(=O)C(C(=O)N)c1ccccc1 1458a_100000070787_100000188848 [0,3,0,0,0,0|1,0,0]=4 22060 B13R1.1111 CC(=O)C(c1ccccc1)C(C)C 1458a_100000764467_200000210301 [0,3,0,0,0,0|1,0,0]=4 22061 B13R1.1111 CC(=O)C(c1ccccc1)N(C)C 1458a_100000743987_200000210301 [0,3,0,0,0,0|1,0,0]=4 22062 B13R1.1111 CC(=O)C(c1ccccc1)N(C)C 2230a_100102631434_100009888967 [0,3,0,0,0,0|1,0,0]=4 22063 B13R1.1111 CC(=O)C(c1ccccc1)N(C)C 269982a_100102631434_100009888967 [0,3,0,0,0,0|1,0,0]=4 22064 B13R1.1111 CC(C)C(C(=O)[13CH3])c1ccccc1 1458a_100000764467_200025704644 [0,3,0,0,0,0|1,0,0]=4 22065 B13R1.1111 CN(C)C(C(=O)[13CH3])c1ccccc1 1458a_100000743987_200025704644 [0,3,0,0,0,0|1,0,0]=4 22066 B13R1.20 C#CCC(=O)Cc1cccc(c1)Br 1458a_100000747190_100000184674 [0,3,0,0,0,0|1,0,0]=4 22067 B13R1.20 C#CCC(=O)Cc1cccc(c1)Br 1458a_100011220946_100000211773 [0,3,0,0,0,0|1,0,0]=4 22068 B13R1.20 C#CCC(=O)Cc1cccc(c1)C 1458a_100011206899_100000184674 [0,3,0,0,0,0|1,0,0]=4 22069 B13R1.20 C#CCC(=O)Cc1cccc(c1)C 1458a_100011220946_100000211840 [0,3,0,0,0,0|1,0,0]=4 22070 B13R1.20 C#CCC(=O)Cc1cccc(c1)Cl 1458a_100000749307_100000184674 [0,3,0,0,0,0|1,0,0]=4 22071 B13R1.20 C#CCC(=O)Cc1cccc(c1)Cl 1458a_100011220946_100000181238 [0,3,0,0,0,0|1,0,0]=4 22072 B13R1.20 C#CCC(=O)Cc1cccc(c1)F 1458a_100000211661_100000184674 [0,3,0,0,0,0|1,0,0]=4 22073 B13R1.20 C#CCC(=O)Cc1cccc(c1)F 1458a_100011220946_100000230114 [0,3,0,0,0,0|1,0,0]=4 22074 B13R1.20 C#CCC(=O)Cc1cccc(c1)I 1458a_100000238430_100000184674 [0,3,0,0,0,0|1,0,0]=4 22075 B13R1.20 C#CCC(=O)Cc1cccc(c1)I 1458a_100011220946_100011218688 [0,3,0,0,0,0|1,0,0]=4 22076 B13R1.20 C#CCC(=O)Cc1cccc(c1)O 1458a_100000745134_100000184674 [0,3,0,0,0,0|1,0,0]=4 22077 B13R1.20 C#CCC(=O)Cc1cccc(c1)O 1458a_100011220946_100011660834 [0,3,0,0,0,0|1,0,0]=4 22078 B13R1.20 C=CCC(=O)Cc1cccc(c1)Br 1458a_100000210193_100000211773 [0,3,0,0,0,0|1,0,0]=4 22079 B13R1.20 C=CCC(=O)Cc1cccc(c1)Br 1458a_100000747190_100000210623 [0,3,0,0,0,0|1,0,0]=4 22080 B13R1.20 C=CCC(=O)Cc1cccc(c1)C 1458a_100000210193_100000211840 [0,3,0,0,0,0|1,0,0]=4 22081 B13R1.20 C=CCC(=O)Cc1cccc(c1)C 1458a_100011206899_100000210623 [0,3,0,0,0,0|1,0,0]=4 22082 B13R1.20 C=CCC(=O)Cc1cccc(c1)Cl 1458a_100000210193_100000181238 [0,3,0,0,0,0|1,0,0]=4 22083 B13R1.20 C=CCC(=O)Cc1cccc(c1)Cl 1458a_100000749307_100000210623 [0,3,0,0,0,0|1,0,0]=4 22084 B13R1.20 C=CCC(=O)Cc1cccc(c1)F 1458a_100000210193_100000230114 [0,3,0,0,0,0|1,0,0]=4 22085 B13R1.20 C=CCC(=O)Cc1cccc(c1)F 1458a_100000211661_100000210623 [0,3,0,0,0,0|1,0,0]=4 22086 B13R1.20 C=CCC(=O)Cc1cccc(c1)I 1458a_100000210193_100011218688 [0,3,0,0,0,0|1,0,0]=4 22087 B13R1.20 C=CCC(=O)Cc1cccc(c1)I 1458a_100000238430_100000210623 [0,3,0,0,0,0|1,0,0]=4 22088 B13R1.20 C=CCC(=O)Cc1cccc(c1)O 1458a_100000210193_100011660834 [0,3,0,0,0,0|1,0,0]=4 22089 B13R1.20 C=CCC(=O)Cc1cccc(c1)O 1458a_100000745134_100000210623 [0,3,0,0,0,0|1,0,0]=4 22090 B13R1.20 C=CCN(C)Cc1cccc(c1)Br 2230a_100000187585_100000210623 [0,3,0,0,0,0|1,0,0]=4 22091 B13R1.20 C=CCN(C)Cc1cccc(c1)Br 2230a_100000225617_100000698116 [0,3,0,0,0,0|1,0,0]=4 22092 B13R1.20 C=CCN(C)Cc1cccc(c1)Br 2230a_100015185876_200000210301 [0,3,0,0,0,0|1,0,0]=4 22093 B13R1.20 C=CCN(C)Cc1cccc(c1)Br 269982a_100000187585_100000210623 [0,3,0,0,0,0|1,0,0]=4 22094 B13R1.20 C=CCN(C)Cc1cccc(c1)Br 269982a_100000225617_100000211773 [0,3,0,0,0,0|1,0,0]=4 22095 B13R1.20 C=CCN(C)Cc1cccc(c1)Br 269982a_100015185876_200000210301 [0,3,0,0,0,0|1,0,0]=4 22096 B13R1.20 C=CCN(C)Cc1cccc(c1)Br 26a_100000225617_100000210342 [0,3,0,0,0,0|1,0,0]=4 22097 B13R1.20 C=CCN(C)Cc1cccc(c1)Br 270004a_100000225617_100000210085 [0,3,0,0,0,0|1,0,0]=4 22098 B13R1.20 C=CCN(C)Cc1cccc(c1)C 2230a_100000225617_100000211840 [0,3,0,0,0,0|1,0,0]=4 22099 B13R1.20 C=CCN(C)Cc1cccc(c1)C 2230a_102495364743_100000210623 [0,3,0,0,0,0|1,0,0]=4 22100 B13R1.20 C=CCN(C)Cc1cccc(c1)C 269982a_100000225617_100000211840 [0,3,0,0,0,0|1,0,0]=4 22101 B13R1.20 C=CCN(C)Cc1cccc(c1)C 269982a_102495364743_100000210623 [0,3,0,0,0,0|1,0,0]=4 22102 B13R1.20 C=CCN(C)Cc1cccc(c1)C 270004a_100000225617_100000211157 [0,3,0,0,0,0|1,0,0]=4 22103 B13R1.20 C=CCN(C)Cc1cccc(c1)C 34a_102495364743_100015514636 [0,3,0,0,0,0|1,0,0]=4 22104 B13R1.20 C=CCN(C)Cc1cccc(c1)Cl 2230a_100000225617_100000181238 [0,3,0,0,0,0|1,0,0]=4 22105 B13R1.20 C=CCN(C)Cc1cccc(c1)Cl 2230a_100020629429_100000210623 [0,3,0,0,0,0|1,0,0]=4 22106 B13R1.20 C=CCN(C)Cc1cccc(c1)Cl 269982a_100000225617_100000181238 [0,3,0,0,0,0|1,0,0]=4 22107 B13R1.20 C=CCN(C)Cc1cccc(c1)Cl 269982a_100020629429_100000210623 [0,3,0,0,0,0|1,0,0]=4 22108 B13R1.20 C=CCN(C)Cc1cccc(c1)Cl 270004a_100000225617_100000210801 [0,3,0,0,0,0|1,0,0]=4 22109 B13R1.20 C=CCN(C)Cc1cccc(c1)F 2230a_100000184398_100000210623 [0,3,0,0,0,0|1,0,0]=4 22110 B13R1.20 C=CCN(C)Cc1cccc(c1)F 2230a_100000196241_200000210301 [0,3,0,0,0,0|1,0,0]=4 22111 B13R1.20 C=CCN(C)Cc1cccc(c1)F 2230a_100000225617_100000230114 [0,3,0,0,0,0|1,0,0]=4 22112 B13R1.20 C=CCN(C)Cc1cccc(c1)F 269982a_100000184398_100000210623 [0,3,0,0,0,0|1,0,0]=4 22113 B13R1.20 C=CCN(C)Cc1cccc(c1)F 269982a_100000196241_200000210301 [0,3,0,0,0,0|1,0,0]=4 22114 B13R1.20 C=CCN(C)Cc1cccc(c1)F 269982a_100000225617_100000230114 [0,3,0,0,0,0|1,0,0]=4 22115 B13R1.20 C=CCN(C)Cc1cccc(c1)F 270004a_100000225617_100000210812 [0,3,0,0,0,0|1,0,0]=4 22116 B13R1.20 C=CCN(C)Cc1cccc(c1)F 34a_100000184398_100015514636 [0,3,0,0,0,0|1,0,0]=4 22117 B13R1.20 C=CCN(C)Cc1cccc(c1)F 34a_100000196241_200000210301 [0,3,0,0,0,0|1,0,0]=4 22118 B13R1.20 C=CCN(C)Cc1cccc(c1)I 2230a_100000225617_100011218688 [0,3,0,0,0,0|1,0,0]=4 22119 B13R1.20 C=CCN(C)Cc1cccc(c1)I 269982a_100000225617_100011218688 [0,3,0,0,0,0|1,0,0]=4 22120 B13R1.20 C=CCN(C)Cc1cccc(c1)I 270004a_100000225617_100000014684 [0,3,0,0,0,0|1,0,0]=4 22121 B13R1.20 C=CCN(C)Cc1cccc(c1)O 2230a_100000207540_100000210623 [0,3,0,0,0,0|1,0,0]=4 22122 B13R1.20 C=CCN(C)Cc1cccc(c1)O 2230a_100000225617_100011660834 [0,3,0,0,0,0|1,0,0]=4 22123 B13R1.20 C=CCN(C)Cc1cccc(c1)O 269982a_100000207540_100000210623 [0,3,0,0,0,0|1,0,0]=4 22124 B13R1.20 C=CCN(C)Cc1cccc(c1)O 269982a_100000225617_100000084143 [0,3,0,0,0,0|1,0,0]=4 22125 B13R1.20 C=CCN(C)Cc1cccc(c1)O 270004a_100000225617_100000188321 [0,3,0,0,0,0|1,0,0]=4 22126 B13R1.20 C=CCN([13CH3])Cc1cccc(c1)Br 2230a_100015185876_200025704644 [0,3,0,0,0,0|1,0,0]=4 22127 B13R1.20 C=CCN([13CH3])Cc1cccc(c1)Br 269982a_100015185876_200025704644 [0,3,0,0,0,0|1,0,0]=4 22128 B13R1.20 C=CCN([13CH3])Cc1cccc(c1)F 2230a_100000196241_200025704644 [0,3,0,0,0,0|1,0,0]=4 22129 B13R1.20 C=CCN([13CH3])Cc1cccc(c1)F 269982a_100000196241_200025704644 [0,3,0,0,0,0|1,0,0]=4 22130 B13R1.20 C=CCN([13CH3])Cc1cccc(c1)F 34a_100000196241_200025704644 [0,3,0,0,0,0|1,0,0]=4 22131 B13R1.20 CC#CC(=O)Cc1cccc(c1)Br 1458a_100000763181_100000211773 [0,3,0,0,0,0|1,0,0]=4 22132 B13R1.20 CC#CC(=O)Cc1cccc(c1)C 1458a_100000763181_100000211840 [0,3,0,0,0,0|1,0,0]=4 22133 B13R1.20 CC#CC(=O)Cc1cccc(c1)Cl 1458a_100000763181_100000181238 [0,3,0,0,0,0|1,0,0]=4 22134 B13R1.20 CC#CC(=O)Cc1cccc(c1)F 1458a_100000763181_100000230114 [0,3,0,0,0,0|1,0,0]=4 22135 B13R1.20 CC#CC(=O)Cc1cccc(c1)I 1458a_100000763181_100011218688 [0,3,0,0,0,0|1,0,0]=4 22136 B13R1.20 CC#CC(=O)Cc1cccc(c1)O 1458a_100000763181_100011660834 [0,3,0,0,0,0|1,0,0]=4 22137 B13R1.20 CC=CC(=O)Cc1cccc(c1)Br 1458a_100000210699_100000211773 [0,3,0,0,0,0|1,0,0]=4 22138 B13R1.20 CC=CC(=O)Cc1cccc(c1)C 1458a_100000210699_100000211840 [0,3,0,0,0,0|1,0,0]=4 22139 B13R1.20 CC=CC(=O)Cc1cccc(c1)Cl 1458a_100000210699_100000181238 [0,3,0,0,0,0|1,0,0]=4 22140 B13R1.20 CC=CC(=O)Cc1cccc(c1)F 1458a_100000210699_100000230114 [0,3,0,0,0,0|1,0,0]=4 22141 B13R1.20 CC=CC(=O)Cc1cccc(c1)I 1458a_100000210699_100011218688 [0,3,0,0,0,0|1,0,0]=4 22142 B13R1.20 CC=CC(=O)Cc1cccc(c1)O 1458a_100000210699_100011660834 [0,3,0,0,0,0|1,0,0]=4 22143 B13R1.20 CCCC(=O)Cc1cccc(c1)Br 1458a_100000211992_100000211773 [0,3,0,0,0,0|1,0,0]=4 22144 B13R1.20 CCCC(=O)Cc1cccc(c1)Br 1458a_100000747190_100000210303 [0,3,0,0,0,0|1,0,0]=4 22145 B13R1.20 CCCC(=O)Cc1cccc(c1)C 1458a_100000211992_100000211840 [0,3,0,0,0,0|1,0,0]=4 22146 B13R1.20 CCCC(=O)Cc1cccc(c1)C 1458a_100011206899_100000210303 [0,3,0,0,0,0|1,0,0]=4 22147 B13R1.20 CCCC(=O)Cc1cccc(c1)Cl 1458a_100000211992_100000181238 [0,3,0,0,0,0|1,0,0]=4 22148 B13R1.20 CCCC(=O)Cc1cccc(c1)Cl 1458a_100000749307_100000210303 [0,3,0,0,0,0|1,0,0]=4 22149 B13R1.20 CCCC(=O)Cc1cccc(c1)F 1458a_100000211661_100000210303 [0,3,0,0,0,0|1,0,0]=4 22150 B13R1.20 CCCC(=O)Cc1cccc(c1)F 1458a_100000211992_100000230114 [0,3,0,0,0,0|1,0,0]=4 22151 B13R1.20 CCCC(=O)Cc1cccc(c1)I 1458a_100000211992_100011218688 [0,3,0,0,0,0|1,0,0]=4 22152 B13R1.20 CCCC(=O)Cc1cccc(c1)I 1458a_100000238430_100000210303 [0,3,0,0,0,0|1,0,0]=4 22153 B13R1.20 CCCC(=O)Cc1cccc(c1)O 1458a_100000211992_100011660834 [0,3,0,0,0,0|1,0,0]=4 22154 B13R1.20 CCCC(=O)Cc1cccc(c1)O 1458a_100000745134_100000210303 [0,3,0,0,0,0|1,0,0]=4 22155 B13R1.20 CCNC(=O)Cc1cccc(c1)Br 11a_100015525214_100000747190 [0,3,0,0,0,0|1,0,0]=4 22156 B13R1.20 CCNC(=O)Cc1cccc(c1)Br 240690a_100015525214_100000747190 [0,3,0,0,0,0|1,0,0]=4 22157 B13R1.20 CCNC(=O)Cc1cccc(c1)Br 527a_100015525214_100000747190 [0,3,0,0,0,0|1,0,0]=4 22158 B13R1.20 CCNC(=O)Cc1cccc(c1)C 11a_100015525214_100011206899 [0,3,0,0,0,0|1,0,0]=4 22159 B13R1.20 CCNC(=O)Cc1cccc(c1)C 240690a_100015525214_100011206899 [0,3,0,0,0,0|1,0,0]=4 22160 B13R1.20 CCNC(=O)Cc1cccc(c1)C 527a_100015525214_100011206899 [0,3,0,0,0,0|1,0,0]=4 22161 B13R1.20 CCNC(=O)Cc1cccc(c1)Cl 11a_100015525214_100000749307 [0,3,0,0,0,0|1,0,0]=4 22162 B13R1.20 CCNC(=O)Cc1cccc(c1)Cl 240690a_100015525214_100000749307 [0,3,0,0,0,0|1,0,0]=4 22163 B13R1.20 CCNC(=O)Cc1cccc(c1)Cl 527a_100015525214_100000749307 [0,3,0,0,0,0|1,0,0]=4 22164 B13R1.20 CCNC(=O)Cc1cccc(c1)F 11a_100015525214_100000211661 [0,3,0,0,0,0|1,0,0]=4 22165 B13R1.20 CCNC(=O)Cc1cccc(c1)F 240690a_100015525214_100000211661 [0,3,0,0,0,0|1,0,0]=4 22166 B13R1.20 CCNC(=O)Cc1cccc(c1)F 527a_100015525214_100000211661 [0,3,0,0,0,0|1,0,0]=4 22167 B13R1.20 CCNC(=O)Cc1cccc(c1)I 11a_100015525214_100000238430 [0,3,0,0,0,0|1,0,0]=4 22168 B13R1.20 CCNC(=O)Cc1cccc(c1)I 240690a_100015525214_100000238430 [0,3,0,0,0,0|1,0,0]=4 22169 B13R1.20 CCNC(=O)Cc1cccc(c1)I 527a_100015525214_100000238430 [0,3,0,0,0,0|1,0,0]=4 22170 B13R1.20 CCNC(=O)Cc1cccc(c1)O 240690a_100015525214_100000745134 [0,3,0,0,0,0|1,0,0]=4 22171 B13R1.20 CCNC(=O)Cc1cccc(c1)O 527a_100015525214_100000745134 [0,3,0,0,0,0|1,0,0]=4 22172 B13R1.20 CCOC(=O)Cc1cccc(c1)O 271570a_203496583355_100011586817 [0,3,0,0,0,0|1,0,0]=4 22173 B13R1.20 CN(CC=O)Cc1cccc(c1)Br 2230a_100000187585_200015260668 [0,3,0,0,0,0|1,0,0]=4 22174 B13R1.20 CN(CC=O)Cc1cccc(c1)Br 269982a_100000187585_200015260668 [0,3,0,0,0,0|1,0,0]=4 22175 B13R1.20 CN(CC=O)Cc1cccc(c1)Cl 2230a_100020629429_200015260668 [0,3,0,0,0,0|1,0,0]=4 22176 B13R1.20 CN(CC=O)Cc1cccc(c1)Cl 269982a_100020629429_200015260668 [0,3,0,0,0,0|1,0,0]=4 22177 B13R1.20 CN(CC=O)Cc1cccc(c1)F 2230a_100000184398_200015260668 [0,3,0,0,0,0|1,0,0]=4 22178 B13R1.20 CN(CC=O)Cc1cccc(c1)F 269982a_100000184398_200015260668 [0,3,0,0,0,0|1,0,0]=4 22179 B13R1.20 CN(CC=O)Cc1cccc(c1)F 34a_100000184398_200009817547 [0,3,0,0,0,0|1,0,0]=4 22180 B13R1.20 CN(CC=O)Cc1cccc(c1)O 2230a_100000207540_200015260668 [0,3,0,0,0,0|1,0,0]=4 22181 B13R1.20 CN(CC=O)Cc1cccc(c1)O 269982a_100000207540_200015260668 [0,3,0,0,0,0|1,0,0]=4 22182 B13R1.20 CNNC(=O)Cc1cccc(c1)Br 22a_100016993582_100000747190 [0,3,0,0,0,0|1,0,0]=4 22183 B13R1.20 CNNC(=O)Cc1cccc(c1)C 22a_100016993582_100011206899 [0,3,0,0,0,0|1,0,0]=4 22184 B13R1.20 CNNC(=O)Cc1cccc(c1)Cl 22a_100016993582_100000749307 [0,3,0,0,0,0|1,0,0]=4 22185 B13R1.20 CNNC(=O)Cc1cccc(c1)F 22a_100016993582_100000211661 [0,3,0,0,0,0|1,0,0]=4 22186 B13R1.20 CNNC(=O)Cc1cccc(c1)I 22a_100016993582_100000238430 [0,3,0,0,0,0|1,0,0]=4 22187 B13R1.20 CNNC(=O)Cc1cccc(c1)O 22a_100016993582_100000745134 [0,3,0,0,0,0|1,0,0]=4 22188 B13R1.20 COCC(=O)Cc1cccc(c1)Br 1458a_100000210968_100000211773 [0,3,0,0,0,0|1,0,0]=4 22189 B13R1.20 COCC(=O)Cc1cccc(c1)C 1458a_100000210968_100000211840 [0,3,0,0,0,0|1,0,0]=4 22190 B13R1.20 COCC(=O)Cc1cccc(c1)Cl 1458a_100000210968_100000181238 [0,3,0,0,0,0|1,0,0]=4 22191 B13R1.20 COCC(=O)Cc1cccc(c1)F 1458a_100000210968_100000230114 [0,3,0,0,0,0|1,0,0]=4 22192 B13R1.20 COCC(=O)Cc1cccc(c1)I 1458a_100000210968_100011218688 [0,3,0,0,0,0|1,0,0]=4 22193 B13R1.20 COCC(=O)Cc1cccc(c1)O 1458a_100000210968_100011660834 [0,3,0,0,0,0|1,0,0]=4 22194 B13R1.20 CSCC(=O)Cc1cccc(c1)Br 1458a_100000184570_100000211773 [0,3,0,0,0,0|1,0,0]=4 22195 B13R1.20 CSCC(=O)Cc1cccc(c1)C 1458a_100000184570_100000211840 [0,3,0,0,0,0|1,0,0]=4 22196 B13R1.20 CSCC(=O)Cc1cccc(c1)Cl 1458a_100000184570_100000181238 [0,3,0,0,0,0|1,0,0]=4 22197 B13R1.20 CSCC(=O)Cc1cccc(c1)F 1458a_100000184570_100000230114 [0,3,0,0,0,0|1,0,0]=4 22198 B13R1.20 CSCC(=O)Cc1cccc(c1)I 1458a_100000184570_100011218688 [0,3,0,0,0,0|1,0,0]=4 22199 B13R1.20 CSCC(=O)Cc1cccc(c1)O 1458a_100000184570_100011660834 [0,3,0,0,0,0|1,0,0]=4 22200 B13R1.20 Cc1cccc(c1)CC(=O)C=CBr 1458a_100016273825_100000211840 [0,3,0,0,0,0|1,0,0]=4 22201 B13R1.20 Cc1cccc(c1)CC(=O)C=CCl 1458a_200016279998_100000211840 [0,3,0,0,0,0|1,0,0]=4 22202 B13R1.20 Cc1cccc(c1)CC(=O)C=CI 1458a_100016256311_100000211840 [0,3,0,0,0,0|1,0,0]=4 22203 B13R1.20 Cc1cccc(c1)CC(=O)CC#N 1458a_100011206899_100011214920 [0,3,0,0,0,0|1,0,0]=4 22204 B13R1.20 Cc1cccc(c1)CC(=O)CC#N 1458a_100051588842_100000211840 [0,3,0,0,0,0|1,0,0]=4 22205 B13R1.20 Cc1cccc(c1)CC(=O)CCF 1458a_100011206899_100011217306 [0,3,0,0,0,0|1,0,0]=4 22206 B13R1.20 Cc1cccc(c1)CC(=O)CCO 1458a_100011206899_100000211926 [0,3,0,0,0,0|1,0,0]=4 22207 B13R1.20 Cc1cccc(c1)CC(=O)CCO 1458a_100011216618_100000211840 [0,3,0,0,0,0|1,0,0]=4 22208 B13R1.20 Cc1cccc(c1)CN(C)CC=O 2230a_102495364743_200015260668 [0,3,0,0,0,0|1,0,0]=4 22209 B13R1.20 Cc1cccc(c1)CN(C)CC=O 269982a_102495364743_200015260668 [0,3,0,0,0,0|1,0,0]=4 22210 B13R1.20 Cc1cccc(c1)CN(C)CC=O 34a_102495364743_200009817547 [0,3,0,0,0,0|1,0,0]=4 22211 B13R1.20 N#CCC(=O)Cc1cccc(c1)Br 1458a_100000747190_100011214920 [0,3,0,0,0,0|1,0,0]=4 22212 B13R1.20 N#CCC(=O)Cc1cccc(c1)Br 1458a_100051588842_100000211773 [0,3,0,0,0,0|1,0,0]=4 22213 B13R1.20 N#CCC(=O)Cc1cccc(c1)Cl 1458a_100000749307_100011214920 [0,3,0,0,0,0|1,0,0]=4 22214 B13R1.20 N#CCC(=O)Cc1cccc(c1)Cl 1458a_100051588842_100000181238 [0,3,0,0,0,0|1,0,0]=4 22215 B13R1.20 N#CCC(=O)Cc1cccc(c1)F 1458a_100000211661_100011214920 [0,3,0,0,0,0|1,0,0]=4 22216 B13R1.20 N#CCC(=O)Cc1cccc(c1)F 1458a_100051588842_100000230114 [0,3,0,0,0,0|1,0,0]=4 22217 B13R1.20 N#CCC(=O)Cc1cccc(c1)I 1458a_100000238430_100011214920 [0,3,0,0,0,0|1,0,0]=4 22218 B13R1.20 N#CCC(=O)Cc1cccc(c1)I 1458a_100051588842_100011218688 [0,3,0,0,0,0|1,0,0]=4 22219 B13R1.20 N#CCC(=O)Cc1cccc(c1)O 1458a_100000745134_100011214920 [0,3,0,0,0,0|1,0,0]=4 22220 B13R1.20 N#CCC(=O)Cc1cccc(c1)O 1458a_100051588842_100011660834 [0,3,0,0,0,0|1,0,0]=4 22221 B13R1.20 O=C(C=CBr)Cc1cccc(c1)Br 1458a_100016273825_100000211773 [0,3,0,0,0,0|1,0,0]=4 22222 B13R1.20 O=C(C=CBr)Cc1cccc(c1)Cl 1458a_100016273825_100000181238 [0,3,0,0,0,0|1,0,0]=4 22223 B13R1.20 O=C(C=CBr)Cc1cccc(c1)F 1458a_100016273825_100000230114 [0,3,0,0,0,0|1,0,0]=4 22224 B13R1.20 O=C(C=CBr)Cc1cccc(c1)I 1458a_100016273825_100011218688 [0,3,0,0,0,0|1,0,0]=4 22225 B13R1.20 O=C(C=CBr)Cc1cccc(c1)O 1458a_100016273825_100011660834 [0,3,0,0,0,0|1,0,0]=4 22226 B13R1.20 O=C(C=CCl)Cc1cccc(c1)Br 1458a_200016279998_100000211773 [0,3,0,0,0,0|1,0,0]=4 22227 B13R1.20 O=C(C=CCl)Cc1cccc(c1)Cl 1458a_200016279998_100000181238 [0,3,0,0,0,0|1,0,0]=4 22228 B13R1.20 O=C(C=CCl)Cc1cccc(c1)F 1458a_200016279998_100000230114 [0,3,0,0,0,0|1,0,0]=4 22229 B13R1.20 O=C(C=CCl)Cc1cccc(c1)I 1458a_200016279998_100011218688 [0,3,0,0,0,0|1,0,0]=4 22230 B13R1.20 O=C(C=CCl)Cc1cccc(c1)O 1458a_200016279998_100011660834 [0,3,0,0,0,0|1,0,0]=4 22231 B13R1.20 O=C(C=CI)Cc1cccc(c1)Br 1458a_100016256311_100000211773 [0,3,0,0,0,0|1,0,0]=4 22232 B13R1.20 O=C(C=CI)Cc1cccc(c1)Cl 1458a_100016256311_100000181238 [0,3,0,0,0,0|1,0,0]=4 22233 B13R1.20 O=C(C=CI)Cc1cccc(c1)F 1458a_100016256311_100000230114 [0,3,0,0,0,0|1,0,0]=4 22234 B13R1.20 O=C(C=CI)Cc1cccc(c1)I 1458a_100016256311_100011218688 [0,3,0,0,0,0|1,0,0]=4 22235 B13R1.20 O=C(C=CI)Cc1cccc(c1)O 1458a_100016256311_100011660834 [0,3,0,0,0,0|1,0,0]=4 22236 B13R1.20 O=C(CCF)Cc1cccc(c1)Br 1458a_100000747190_100011217306 [0,3,0,0,0,0|1,0,0]=4 22237 B13R1.20 O=C(CCF)Cc1cccc(c1)Cl 1458a_100000749307_100011217306 [0,3,0,0,0,0|1,0,0]=4 22238 B13R1.20 O=C(CCF)Cc1cccc(c1)F 1458a_100000211661_100011217306 [0,3,0,0,0,0|1,0,0]=4 22239 B13R1.20 O=C(CCF)Cc1cccc(c1)I 1458a_100000238430_100011217306 [0,3,0,0,0,0|1,0,0]=4 22240 B13R1.20 O=C(CCF)Cc1cccc(c1)O 1458a_100000745134_100011217306 [0,3,0,0,0,0|1,0,0]=4 22241 B13R1.20 O=C(CCO)Cc1cccc(c1)Br 1458a_100000747190_100000211926 [0,3,0,0,0,0|1,0,0]=4 22242 B13R1.20 O=C(CCO)Cc1cccc(c1)Br 1458a_100011216618_100000211773 [0,3,0,0,0,0|1,0,0]=4 22243 B13R1.20 O=C(CCO)Cc1cccc(c1)Cl 1458a_100000749307_100000211926 [0,3,0,0,0,0|1,0,0]=4 22244 B13R1.20 O=C(CCO)Cc1cccc(c1)Cl 1458a_100011216618_100000181238 [0,3,0,0,0,0|1,0,0]=4 22245 B13R1.20 O=C(CCO)Cc1cccc(c1)F 1458a_100000211661_100000211926 [0,3,0,0,0,0|1,0,0]=4 22246 B13R1.20 O=C(CCO)Cc1cccc(c1)F 1458a_100011216618_100000230114 [0,3,0,0,0,0|1,0,0]=4 22247 B13R1.20 O=C(CCO)Cc1cccc(c1)I 1458a_100000238430_100000211926 [0,3,0,0,0,0|1,0,0]=4 22248 B13R1.20 O=C(CCO)Cc1cccc(c1)I 1458a_100011216618_100011218688 [0,3,0,0,0,0|1,0,0]=4 22249 B13R1.20 O=C(CCO)Cc1cccc(c1)O 1458a_100000745134_100000211926 [0,3,0,0,0,0|1,0,0]=4 22250 B13R1.20 O=C(CCO)Cc1cccc(c1)O 1458a_100011216618_100011660834 [0,3,0,0,0,0|1,0,0]=4 22251 B13R1.44 C#CCCC(=O)Cc1ccccc1 1458a_100000692101_100015291786 [0,3,0,0,0,0|1,0,0]=4 22252 B13R1.44 C/C=C/CN(C)Cc1ccccc1 269982a_100000186898_100102629194 [0,3,0,0,0,0|1,0,0]=4 22253 B13R1.44 C=CC=CC(=O)Cc1ccccc1 1458a_100016291481_100015291786 [0,3,0,0,0,0|1,0,0]=4 22254 B13R1.44 C=CCCC(=O)Cc1ccccc1 1458a_100000749702_100015291786 [0,3,0,0,0,0|1,0,0]=4 22255 B13R1.44 C=CCCN(C)Cc1ccccc1 2230a_100000186898_100000754431 [0,3,0,0,0,0|1,0,0]=4 22256 B13R1.44 C=CCCN(C)Cc1ccccc1 2230a_100011934112_200000210301 [0,3,0,0,0,0|1,0,0]=4 22257 B13R1.44 C=CCCN(C)Cc1ccccc1 2230a_100020639649_100015291786 [0,3,0,0,0,0|1,0,0]=4 22258 B13R1.44 C=CCCN(C)Cc1ccccc1 269982a_100000186898_100000754431 [0,3,0,0,0,0|1,0,0]=4 22259 B13R1.44 C=CCCN(C)Cc1ccccc1 269982a_100011934112_200000210301 [0,3,0,0,0,0|1,0,0]=4 22260 B13R1.44 C=CCCN(C)Cc1ccccc1 269982a_100020639649_100000211182 [0,3,0,0,0,0|1,0,0]=4 22261 B13R1.44 C=CCCN(C)Cc1ccccc1 270004a_100020639649_100015611070 [0,3,0,0,0,0|1,0,0]=4 22262 B13R1.44 C=CCCN([13CH3])Cc1ccccc1 2230a_100011934112_200025704644 [0,3,0,0,0,0|1,0,0]=4 22263 B13R1.44 C=CCCN([13CH3])Cc1ccccc1 269982a_100011934112_200025704644 [0,3,0,0,0,0|1,0,0]=4 22264 B13R1.44 C=CCOC(C)Cc1ccccc1 34a_100000748627_100015514636 [0,3,0,0,0,0|0,0,1]=4 22265 B13R1.44 C=CCOC(C)Cc1ccccc1 34a_200000210373_200011218536 [0,3,0,0,0,0|0,0,1]=4 22266 B13R1.44 C=CCOC(C)Cc1ccccc1 7a_100000748627_100015514636 [0,3,0,0,0,0|0,0,1]=4 22267 B13R1.44 C=CCSC(C)Cc1ccccc1 62a_100000210623_200011218536 [0,3,0,0,0,0|0,0,1]=4 22268 B13R1.44 C=CCSC(C)Cc1ccccc1 62a_200011218536_100000210623 [0,3,0,0,0,0|0,0,1]=4 22269 B13R1.44 CC(Cc1ccccc1)OCC=O 34a_100000748627_200009817547 [0,3,0,0,0,0|0,0,1]=4 22270 B13R1.44 CC(Cc1ccccc1)OCC=O 7a_100000748627_200015260668 [0,3,0,0,0,0|0,0,1]=4 22271 B13R1.44 CC(Cc1ccccc1)SCC=O 62a_200011218536_200015260668 [0,3,0,0,0,0|0,0,1]=4 22272 B13R1.44 CC(Cc1ccccc1)SCC=O 62a_200015260668_200011218536 [0,3,0,0,0,0|0,0,1]=4 22273 B13R1.44 CC=CCC(=O)Cc1ccccc1 1458a_100121576822_100015291786 [0,3,0,0,0,0|1,0,0]=4 22274 B13R1.44 CC=CCN(C)Cc1ccccc1 2230a_100000186898_100000070051 [0,3,0,0,0,0|1,0,0]=4 22275 B13R1.44 CC=NNC(=O)Cc1ccccc1 4a_100000182964_200000210099 [0,3,0,0,0,0|1,0,0]=4 22276 B13R1.44 CCC#CC(=O)Cc1ccccc1 1458a_100011827653_100015291786 [0,3,0,0,0,0|1,0,0]=4 22277 B13R1.44 CCC=CC(=O)Cc1ccccc1 1458a_100000212282_100015291786 [0,3,0,0,0,0|1,0,0]=4 22278 B13R1.44 CCCCC(=O)Cc1ccccc1 1458a_100000210183_100015291786 [0,3,0,0,0,0|1,0,0]=4 22279 B13R1.44 CCNCC(=O)Cc1ccccc1 2230a_100015525214_100000233483 [0,3,0,0,0,0|1,0,0]=4 22280 B13R1.44 CCOCC(=O)Cc1ccccc1 1458a_100000211967_100015291786 [0,3,0,0,0,0|1,0,0]=4 22281 B13R1.44 CCSCC(=O)Cc1ccccc1 1458a_100000230394_100015291786 [0,3,0,0,0,0|1,0,0]=4 22282 B13R1.44 CCSCC(=O)Cc1ccccc1 62a_100000210202_100000233483 [0,3,0,0,0,0|1,0,0]=4 22283 B13R1.44 CCSCC(=O)Cc1ccccc1 62a_100000233483_100000210202 [0,3,0,0,0,0|1,0,0]=4 22284 B13R1.44 COC=CC(=O)Cc1ccccc1 1458a_100016268678_100015291786 [0,3,0,0,0,0|1,0,0]=4 22285 B13R1.44 COCCC(=O)Cc1ccccc1 1458a_100000749529_100015291786 [0,3,0,0,0,0|1,0,0]=4 22286 B13R1.44 CSCCC(=O)Cc1ccccc1 1458a_100000174002_100015291786 [0,3,0,0,0,0|1,0,0]=4 22287 B13R1.44 N#CCCC(=O)Cc1ccccc1 1458a_100011934036_100015291786 [0,3,0,0,0,0|1,0,0]=4 22288 B13R1.44 O=C(C#CCO)Cc1ccccc1 1458a_100000049017_100015291786 [0,3,0,0,0,0|1,0,0]=4 22289 B13R1.44 O=C(CSCF)Cc1ccccc1 62a_100000233483_100015361967 [0,3,0,0,0,0|1,0,0]=4 22290 B13R1.44 O=C(CSCF)Cc1ccccc1 62a_100015361967_100000233483 [0,3,0,0,0,0|1,0,0]=4 22291 B13R1.79 C=CCN(CC)Cc1ccccc1 2230a_100000186914_100000210623 [0,3,0,0,0,0|1,0,0]=4 22292 B13R1.79 C=CCN(CC)Cc1ccccc1 2230a_100000196212_100000210202 [0,3,0,0,0,0|1,0,0]=4 22293 B13R1.79 C=CCN(CC)Cc1ccccc1 269982a_100000186914_100000210623 [0,3,0,0,0,0|1,0,0]=4 22294 B13R1.79 C=CCN(CC)Cc1ccccc1 269982a_100000196212_100000204670 [0,3,0,0,0,0|1,0,0]=4 22295 B13R1.79 C=CCN(CF)Cc1ccccc1 269982a_100000196212_100015361967 [0,3,0,0,0,0|1,0,0]=4 22296 B13R1.79 CCN(CC=O)Cc1ccccc1 2230a_100000186914_200015260668 [0,3,0,0,0,0|1,0,0]=4 22297 B13R1.79 CCN(CC=O)Cc1ccccc1 269982a_100000186914_200015260668 [0,3,0,0,0,0|1,0,0]=4 22298 B13R1.470 C#CCC(=O)Cc1ccccc1Br 1458a_100000751119_100000184674 [0,3,0,0,0,0|1,0,0]=4 22299 B13R1.470 C#CCC(=O)Cc1ccccc1Br 1458a_100011220946_100000184730 [0,3,0,0,0,0|1,0,0]=4 22300 B13R1.470 C#CCC(=O)Cc1ccccc1C 1458a_100000212180_100000184674 [0,3,0,0,0,0|1,0,0]=4 22301 B13R1.470 C#CCC(=O)Cc1ccccc1C 1458a_100011220946_100000211839 [0,3,0,0,0,0|1,0,0]=4 22302 B13R1.470 C#CCC(=O)Cc1ccccc1Cl 1458a_100000183793_100000184674 [0,3,0,0,0,0|1,0,0]=4 22303 B13R1.470 C#CCC(=O)Cc1ccccc1Cl 1458a_100011220946_100000187162 [0,3,0,0,0,0|1,0,0]=4 22304 B13R1.470 C#CCC(=O)Cc1ccccc1F 1458a_100000212012_100000184674 [0,3,0,0,0,0|1,0,0]=4 22305 B13R1.470 C#CCC(=O)Cc1ccccc1F 1458a_100011220946_100000187165 [0,3,0,0,0,0|1,0,0]=4 22306 B13R1.470 C#CCC(=O)Cc1ccccc1I 1458a_100000036491_100000184674 [0,3,0,0,0,0|1,0,0]=4 22307 B13R1.470 C#CCC(=O)Cc1ccccc1I 1458a_100011220946_100011216222 [0,3,0,0,0,0|1,0,0]=4 22308 B13R1.470 C#CCC(=O)Cc1ccccc1O 1458a_100000743006_100000184674 [0,3,0,0,0,0|1,0,0]=4 22309 B13R1.470 C=CCC(=O)Cc1ccccc1Br 1458a_100000210193_100000184730 [0,3,0,0,0,0|1,0,0]=4 22310 B13R1.470 C=CCC(=O)Cc1ccccc1Br 1458a_100000751119_100000210623 [0,3,0,0,0,0|1,0,0]=4 22311 B13R1.470 C=CCC(=O)Cc1ccccc1C 1458a_100000210193_100000211839 [0,3,0,0,0,0|1,0,0]=4 22312 B13R1.470 C=CCC(=O)Cc1ccccc1C 1458a_100000212180_100000210623 [0,3,0,0,0,0|1,0,0]=4 22313 B13R1.470 C=CCC(=O)Cc1ccccc1Cl 1458a_100000183793_100000210623 [0,3,0,0,0,0|1,0,0]=4 22314 B13R1.470 C=CCC(=O)Cc1ccccc1Cl 1458a_100000210193_100000187162 [0,3,0,0,0,0|1,0,0]=4 22315 B13R1.470 C=CCC(=O)Cc1ccccc1F 1458a_100000210193_100000187165 [0,3,0,0,0,0|1,0,0]=4 22316 B13R1.470 C=CCC(=O)Cc1ccccc1F 1458a_100000212012_100000210623 [0,3,0,0,0,0|1,0,0]=4 22317 B13R1.470 C=CCC(=O)Cc1ccccc1I 1458a_100000036491_100000210623 [0,3,0,0,0,0|1,0,0]=4 22318 B13R1.470 C=CCC(=O)Cc1ccccc1I 1458a_100000210193_100011216222 [0,3,0,0,0,0|1,0,0]=4 22319 B13R1.470 C=CCC(=O)Cc1ccccc1O 1458a_100000743006_100000210623 [0,3,0,0,0,0|1,0,0]=4 22320 B13R1.470 C=CCN(C)Cc1ccccc1Br 2230a_100000184654_100000210623 [0,3,0,0,0,0|1,0,0]=4 22321 B13R1.470 C=CCN(C)Cc1ccccc1Br 2230a_100000225617_100000184730 [0,3,0,0,0,0|1,0,0]=4 22322 B13R1.470 C=CCN(C)Cc1ccccc1Br 269982a_100000184654_100000210623 [0,3,0,0,0,0|1,0,0]=4 22323 B13R1.470 C=CCN(C)Cc1ccccc1Br 269982a_100000225617_100000184730 [0,3,0,0,0,0|1,0,0]=4 22324 B13R1.470 C=CCN(C)Cc1ccccc1Br 26a_100000225617_100000181306 [0,3,0,0,0,0|1,0,0]=4 22325 B13R1.470 C=CCN(C)Cc1ccccc1Br 270004a_100000225617_100000211189 [0,3,0,0,0,0|1,0,0]=4 22326 B13R1.470 C=CCN(C)Cc1ccccc1C 2230a_100000184421_100000210623 [0,3,0,0,0,0|1,0,0]=4 22327 B13R1.470 C=CCN(C)Cc1ccccc1C 2230a_100000225617_100000211839 [0,3,0,0,0,0|1,0,0]=4 22328 B13R1.470 C=CCN(C)Cc1ccccc1C 2230a_200015183989_200000210301 [0,3,0,0,0,0|1,0,0]=4 22329 B13R1.470 C=CCN(C)Cc1ccccc1C 269982a_100000184421_100000210623 [0,3,0,0,0,0|1,0,0]=4 22330 B13R1.470 C=CCN(C)Cc1ccccc1C 269982a_100000225617_100000211839 [0,3,0,0,0,0|1,0,0]=4 22331 B13R1.470 C=CCN(C)Cc1ccccc1C 269982a_200015183989_200000210301 [0,3,0,0,0,0|1,0,0]=4 22332 B13R1.470 C=CCN(C)Cc1ccccc1C 270004a_100000225617_100000211143 [0,3,0,0,0,0|1,0,0]=4 22333 B13R1.470 C=CCN(C)Cc1ccccc1C 34a_200015183989_200000210301 [0,3,0,0,0,0|1,0,0]=4 22334 B13R1.470 C=CCN(C)Cc1ccccc1Cl 2230a_100000184507_100000210623 [0,3,0,0,0,0|1,0,0]=4 22335 B13R1.470 C=CCN(C)Cc1ccccc1Cl 2230a_100000225617_100000187162 [0,3,0,0,0,0|1,0,0]=4 22336 B13R1.470 C=CCN(C)Cc1ccccc1Cl 2230a_200015185268_200000210301 [0,3,0,0,0,0|1,0,0]=4 22337 B13R1.470 C=CCN(C)Cc1ccccc1Cl 269982a_100000184507_100000210623 [0,3,0,0,0,0|1,0,0]=4 22338 B13R1.470 C=CCN(C)Cc1ccccc1Cl 269982a_100000225617_100000187162 [0,3,0,0,0,0|1,0,0]=4 22339 B13R1.470 C=CCN(C)Cc1ccccc1Cl 269982a_200015185268_200000210301 [0,3,0,0,0,0|1,0,0]=4 22340 B13R1.470 C=CCN(C)Cc1ccccc1Cl 26a_100000225617_100000210172 [0,3,0,0,0,0|1,0,0]=4 22341 B13R1.470 C=CCN(C)Cc1ccccc1Cl 270004a_100000225617_100000210073 [0,3,0,0,0,0|1,0,0]=4 22342 B13R1.470 C=CCN(C)Cc1ccccc1Cl 34a_200015185268_200000210301 [0,3,0,0,0,0|1,0,0]=4 22343 B13R1.470 C=CCN(C)Cc1ccccc1F 2230a_100000225617_100000211605 [0,3,0,0,0,0|1,0,0]=4 22344 B13R1.470 C=CCN(C)Cc1ccccc1F 2230a_100000742528_100000210623 [0,3,0,0,0,0|1,0,0]=4 22345 B13R1.470 C=CCN(C)Cc1ccccc1F 269982a_100000225617_100000211605 [0,3,0,0,0,0|1,0,0]=4 22346 B13R1.470 C=CCN(C)Cc1ccccc1F 269982a_100000742528_100000210623 [0,3,0,0,0,0|1,0,0]=4 22347 B13R1.470 C=CCN(C)Cc1ccccc1F 270004a_100000225617_100000210811 [0,3,0,0,0,0|1,0,0]=4 22348 B13R1.470 C=CCN(C)Cc1ccccc1F 34a_100000742528_100015514636 [0,3,0,0,0,0|1,0,0]=4 22349 B13R1.470 C=CCN(C)Cc1ccccc1I 2230a_100000225617_100011215278 [0,3,0,0,0,0|1,0,0]=4 22350 B13R1.470 C=CCN(C)Cc1ccccc1I 269982a_100000225617_100011215278 [0,3,0,0,0,0|1,0,0]=4 22351 B13R1.470 C=CCN(C)Cc1ccccc1I 270004a_100000225617_100000010305 [0,3,0,0,0,0|1,0,0]=4 22352 B13R1.470 C=CCN(C)Cc1ccccc1O 2230a_100015189988_100000210623 [0,3,0,0,0,0|1,0,0]=4 22353 B13R1.470 C=CCN(C)Cc1ccccc1O 269982a_100015189988_100000210623 [0,3,0,0,0,0|1,0,0]=4 22354 B13R1.470 C=CCN([13CH3])Cc1ccccc1C 2230a_200015183989_200025704644 [0,3,0,0,0,0|1,0,0]=4 22355 B13R1.470 C=CCN([13CH3])Cc1ccccc1C 269982a_200015183989_200025704644 [0,3,0,0,0,0|1,0,0]=4 22356 B13R1.470 C=CCN([13CH3])Cc1ccccc1C 34a_200015183989_200025704644 [0,3,0,0,0,0|1,0,0]=4 22357 B13R1.470 C=CCN([13CH3])Cc1ccccc1Cl 2230a_200015185268_200025704644 [0,3,0,0,0,0|1,0,0]=4 22358 B13R1.470 C=CCN([13CH3])Cc1ccccc1Cl 269982a_200015185268_200025704644 [0,3,0,0,0,0|1,0,0]=4 22359 B13R1.470 C=CCN([13CH3])Cc1ccccc1Cl 34a_200015185268_200025704644 [0,3,0,0,0,0|1,0,0]=4 22360 B13R1.470 CC#CC(=O)Cc1ccccc1Br 1458a_100000763181_100000184730 [0,3,0,0,0,0|1,0,0]=4 22361 B13R1.470 CC#CC(=O)Cc1ccccc1C 1458a_100000763181_100000211839 [0,3,0,0,0,0|1,0,0]=4 22362 B13R1.470 CC#CC(=O)Cc1ccccc1Cl 1458a_100000763181_100000187162 [0,3,0,0,0,0|1,0,0]=4 22363 B13R1.470 CC#CC(=O)Cc1ccccc1F 1458a_100000763181_100000187165 [0,3,0,0,0,0|1,0,0]=4 22364 B13R1.470 CC#CC(=O)Cc1ccccc1I 1458a_100000763181_100011216222 [0,3,0,0,0,0|1,0,0]=4 22365 B13R1.470 CC=CC(=O)Cc1ccccc1Br 1458a_100000210699_100000184730 [0,3,0,0,0,0|1,0,0]=4 22366 B13R1.470 CC=CC(=O)Cc1ccccc1C 1458a_100000210699_100000211839 [0,3,0,0,0,0|1,0,0]=4 22367 B13R1.470 CC=CC(=O)Cc1ccccc1Cl 1458a_100000210699_100000187162 [0,3,0,0,0,0|1,0,0]=4 22368 B13R1.470 CC=CC(=O)Cc1ccccc1F 1458a_100000210699_100000187165 [0,3,0,0,0,0|1,0,0]=4 22369 B13R1.470 CC=CC(=O)Cc1ccccc1I 1458a_100000210699_100011216222 [0,3,0,0,0,0|1,0,0]=4 22370 B13R1.470 CCCC(=O)Cc1ccccc1Br 1458a_100000211992_100000184730 [0,3,0,0,0,0|1,0,0]=4 22371 B13R1.470 CCCC(=O)Cc1ccccc1Br 1458a_100000751119_100000210303 [0,3,0,0,0,0|1,0,0]=4 22372 B13R1.470 CCCC(=O)Cc1ccccc1C 1458a_100000211992_100000211839 [0,3,0,0,0,0|1,0,0]=4 22373 B13R1.470 CCCC(=O)Cc1ccccc1C 1458a_100000212180_100000210303 [0,3,0,0,0,0|1,0,0]=4 22374 B13R1.470 CCCC(=O)Cc1ccccc1Cl 1458a_100000183793_100000210303 [0,3,0,0,0,0|1,0,0]=4 22375 B13R1.470 CCCC(=O)Cc1ccccc1Cl 1458a_100000211992_100000187162 [0,3,0,0,0,0|1,0,0]=4 22376 B13R1.470 CCCC(=O)Cc1ccccc1F 1458a_100000211992_100000187165 [0,3,0,0,0,0|1,0,0]=4 22377 B13R1.470 CCCC(=O)Cc1ccccc1F 1458a_100000212012_100000210303 [0,3,0,0,0,0|1,0,0]=4 22378 B13R1.470 CCCC(=O)Cc1ccccc1I 1458a_100000036491_100000210303 [0,3,0,0,0,0|1,0,0]=4 22379 B13R1.470 CCCC(=O)Cc1ccccc1I 1458a_100000211992_100011216222 [0,3,0,0,0,0|1,0,0]=4 22380 B13R1.470 CCCC(=O)Cc1ccccc1O 1458a_100000743006_100000210303 [0,3,0,0,0,0|1,0,0]=4 22381 B13R1.470 CCNC(=O)Cc1ccccc1Br 11a_100015525214_100000751119 [0,3,0,0,0,0|1,0,0]=4 22382 B13R1.470 CCNC(=O)Cc1ccccc1Br 240690a_100015525214_100000751119 [0,3,0,0,0,0|1,0,0]=4 22383 B13R1.470 CCNC(=O)Cc1ccccc1Br 527a_100015525214_100000751119 [0,3,0,0,0,0|1,0,0]=4 22384 B13R1.470 CCNC(=O)Cc1ccccc1C 11a_100015525214_100000212180 [0,3,0,0,0,0|1,0,0]=4 22385 B13R1.470 CCNC(=O)Cc1ccccc1C 240690a_100015525214_100000212180 [0,3,0,0,0,0|1,0,0]=4 22386 B13R1.470 CCNC(=O)Cc1ccccc1C 527a_100015525214_100000212180 [0,3,0,0,0,0|1,0,0]=4 22387 B13R1.470 CCNC(=O)Cc1ccccc1Cl 11a_100015525214_100000183793 [0,3,0,0,0,0|1,0,0]=4 22388 B13R1.470 CCNC(=O)Cc1ccccc1Cl 240690a_100015525214_100000183793 [0,3,0,0,0,0|1,0,0]=4 22389 B13R1.470 CCNC(=O)Cc1ccccc1Cl 527a_100015525214_100000183793 [0,3,0,0,0,0|1,0,0]=4 22390 B13R1.470 CCNC(=O)Cc1ccccc1F 11a_100015525214_100000212012 [0,3,0,0,0,0|1,0,0]=4 22391 B13R1.470 CCNC(=O)Cc1ccccc1F 240690a_100015525214_100000212012 [0,3,0,0,0,0|1,0,0]=4 22392 B13R1.470 CCNC(=O)Cc1ccccc1F 527a_100015525214_100000212012 [0,3,0,0,0,0|1,0,0]=4 22393 B13R1.470 CCNC(=O)Cc1ccccc1I 11a_100015525214_100000036491 [0,3,0,0,0,0|1,0,0]=4 22394 B13R1.470 CCNC(=O)Cc1ccccc1I 240690a_100015525214_100000036491 [0,3,0,0,0,0|1,0,0]=4 22395 B13R1.470 CCNC(=O)Cc1ccccc1I 527a_100015525214_100000036491 [0,3,0,0,0,0|1,0,0]=4 22396 B13R1.470 CCNC(=O)Cc1ccccc1O 240690a_100015525214_100000743006 [0,3,0,0,0,0|1,0,0]=4 22397 B13R1.470 CCNC(=O)Cc1ccccc1O 271570a_203496583355_200009816148 [0,3,0,0,0,0|1,0,0]=4 22398 B13R1.470 CCNC(=O)Cc1ccccc1O 527a_100015525214_100000743006 [0,3,0,0,0,0|1,0,0]=4 22399 B13R1.470 CCOC(=O)Cc1ccccc1O 271570a_203496583355_100011218996 [0,3,0,0,0,0|1,0,0]=4 22400 B13R1.470 CN(CC=O)Cc1ccccc1Br 2230a_100000184654_200015260668 [0,3,0,0,0,0|1,0,0]=4 22401 B13R1.470 CN(CC=O)Cc1ccccc1Br 269982a_100000184654_200015260668 [0,3,0,0,0,0|1,0,0]=4 22402 B13R1.470 CN(CC=O)Cc1ccccc1Cl 2230a_100000184507_200015260668 [0,3,0,0,0,0|1,0,0]=4 22403 B13R1.470 CN(CC=O)Cc1ccccc1Cl 269982a_100000184507_200015260668 [0,3,0,0,0,0|1,0,0]=4 22404 B13R1.470 CN(CC=O)Cc1ccccc1F 2230a_100000742528_200015260668 [0,3,0,0,0,0|1,0,0]=4 22405 B13R1.470 CN(CC=O)Cc1ccccc1F 269982a_100000742528_200015260668 [0,3,0,0,0,0|1,0,0]=4 22406 B13R1.470 CN(CC=O)Cc1ccccc1F 34a_100000742528_200009817547 [0,3,0,0,0,0|1,0,0]=4 22407 B13R1.470 CN(CC=O)Cc1ccccc1O 2230a_100015189988_200015260668 [0,3,0,0,0,0|1,0,0]=4 22408 B13R1.470 CN(CC=O)Cc1ccccc1O 269982a_100015189988_200015260668 [0,3,0,0,0,0|1,0,0]=4 22409 B13R1.470 CNCC(=O)Cc1ccccc1Br 2230a_106832991635_100000700504 [0,3,0,0,0,0|1,0,0]=4 22410 B13R1.470 CNCC(=O)Cc1ccccc1Br 34a_100102657272_100000700504 [0,3,0,0,0,0|1,0,0]=4 22411 B13R1.470 CNCC(=O)Cc1ccccc1Br 7a_106832991635_100000700504 [0,3,0,0,0,0|1,0,0]=4 22412 B13R1.470 CNCC(=O)Cc1ccccc1C 2230a_106832991635_100011223134 [0,3,0,0,0,0|1,0,0]=4 22413 B13R1.470 CNCC(=O)Cc1ccccc1C 7a_106832991635_100011223134 [0,3,0,0,0,0|1,0,0]=4 22414 B13R1.470 CNNC(=O)Cc1ccccc1Br 22a_100016993582_100000751119 [0,3,0,0,0,0|1,0,0]=4 22415 B13R1.470 CNNC(=O)Cc1ccccc1C 22a_100016993582_100000212180 [0,3,0,0,0,0|1,0,0]=4 22416 B13R1.470 CNNC(=O)Cc1ccccc1Cl 22a_100016993582_100000183793 [0,3,0,0,0,0|1,0,0]=4 22417 B13R1.470 CNNC(=O)Cc1ccccc1F 22a_100016993582_100000212012 [0,3,0,0,0,0|1,0,0]=4 22418 B13R1.470 CNNC(=O)Cc1ccccc1I 22a_100016993582_100000036491 [0,3,0,0,0,0|1,0,0]=4 22419 B13R1.470 CNNC(=O)Cc1ccccc1O 22a_100016993582_100000743006 [0,3,0,0,0,0|1,0,0]=4 22420 B13R1.470 COCC(=O)Cc1ccccc1Br 1458a_100000210968_100000184730 [0,3,0,0,0,0|1,0,0]=4 22421 B13R1.470 COCC(=O)Cc1ccccc1Br 34a_100138415774_100000700504 [0,3,0,0,0,0|1,0,0]=4 22422 B13R1.470 COCC(=O)Cc1ccccc1C 1458a_100000210968_100000211839 [0,3,0,0,0,0|1,0,0]=4 22423 B13R1.470 COCC(=O)Cc1ccccc1Cl 1458a_100000210968_100000187162 [0,3,0,0,0,0|1,0,0]=4 22424 B13R1.470 COCC(=O)Cc1ccccc1F 1458a_100000210968_100000187165 [0,3,0,0,0,0|1,0,0]=4 22425 B13R1.470 COCC(=O)Cc1ccccc1I 1458a_100000210968_100011216222 [0,3,0,0,0,0|1,0,0]=4 22426 B13R1.470 CSCC(=O)Cc1ccccc1Br 1458a_100000184570_100000184730 [0,3,0,0,0,0|1,0,0]=4 22427 B13R1.470 CSCC(=O)Cc1ccccc1Br 62a_100000700504_200000210301 [0,3,0,0,0,0|1,0,0]=4 22428 B13R1.470 CSCC(=O)Cc1ccccc1Br 62a_200000210301_100000700504 [0,3,0,0,0,0|1,0,0]=4 22429 B13R1.470 CSCC(=O)Cc1ccccc1C 1458a_100000184570_100000211839 [0,3,0,0,0,0|1,0,0]=4 22430 B13R1.470 CSCC(=O)Cc1ccccc1C 62a_100011223134_200000210301 [0,3,0,0,0,0|1,0,0]=4 22431 B13R1.470 CSCC(=O)Cc1ccccc1C 62a_200000210301_100011223134 [0,3,0,0,0,0|1,0,0]=4 22432 B13R1.470 CSCC(=O)Cc1ccccc1Cl 1458a_100000184570_100000187162 [0,3,0,0,0,0|1,0,0]=4 22433 B13R1.470 CSCC(=O)Cc1ccccc1F 1458a_100000184570_100000187165 [0,3,0,0,0,0|1,0,0]=4 22434 B13R1.470 CSCC(=O)Cc1ccccc1I 1458a_100000184570_100011216222 [0,3,0,0,0,0|1,0,0]=4 22435 B13R1.470 Cc1ccccc1CC(=O)C=CBr 1458a_100016273825_100000211839 [0,3,0,0,0,0|1,0,0]=4 22436 B13R1.470 Cc1ccccc1CC(=O)C=CCl 1458a_200016279998_100000211839 [0,3,0,0,0,0|1,0,0]=4 22437 B13R1.470 Cc1ccccc1CC(=O)C=CI 1458a_100016256311_100000211839 [0,3,0,0,0,0|1,0,0]=4 22438 B13R1.470 Cc1ccccc1CC(=O)CC#N 1458a_100000212180_100011214920 [0,3,0,0,0,0|1,0,0]=4 22439 B13R1.470 Cc1ccccc1CC(=O)CC#N 1458a_100051588842_100000211839 [0,3,0,0,0,0|1,0,0]=4 22440 B13R1.470 Cc1ccccc1CC(=O)CCF 1458a_100000212180_100011217306 [0,3,0,0,0,0|1,0,0]=4 22441 B13R1.470 Cc1ccccc1CC(=O)CCO 1458a_100000212180_100000211926 [0,3,0,0,0,0|1,0,0]=4 22442 B13R1.470 Cc1ccccc1CC(=O)CCO 1458a_100011216618_100000211839 [0,3,0,0,0,0|1,0,0]=4 22443 B13R1.470 Cc1ccccc1CC(=O)CS[13CH3] 62a_100011223134_200025704644 [0,3,0,0,0,0|1,0,0]=4 22444 B13R1.470 Cc1ccccc1CC(=O)CS[13CH3] 62a_200025704644_100011223134 [0,3,0,0,0,0|1,0,0]=4 22445 B13R1.470 Cc1ccccc1CN(C)CC=O 2230a_100000184421_200015260668 [0,3,0,0,0,0|1,0,0]=4 22446 B13R1.470 Cc1ccccc1CN(C)CC=O 269982a_100000184421_200015260668 [0,3,0,0,0,0|1,0,0]=4 22447 B13R1.470 N#CCC(=O)Cc1ccccc1Br 1458a_100000751119_100011214920 [0,3,0,0,0,0|1,0,0]=4 22448 B13R1.470 N#CCC(=O)Cc1ccccc1Br 1458a_100051588842_100000184730 [0,3,0,0,0,0|1,0,0]=4 22449 B13R1.470 N#CCC(=O)Cc1ccccc1Cl 1458a_100000183793_100011214920 [0,3,0,0,0,0|1,0,0]=4 22450 B13R1.470 N#CCC(=O)Cc1ccccc1Cl 1458a_100051588842_100000187162 [0,3,0,0,0,0|1,0,0]=4 22451 B13R1.470 N#CCC(=O)Cc1ccccc1F 1458a_100000212012_100011214920 [0,3,0,0,0,0|1,0,0]=4 22452 B13R1.470 N#CCC(=O)Cc1ccccc1F 1458a_100051588842_100000187165 [0,3,0,0,0,0|1,0,0]=4 22453 B13R1.470 N#CCC(=O)Cc1ccccc1I 1458a_100000036491_100011214920 [0,3,0,0,0,0|1,0,0]=4 22454 B13R1.470 N#CCC(=O)Cc1ccccc1I 1458a_100051588842_100011216222 [0,3,0,0,0,0|1,0,0]=4 22455 B13R1.470 N#CCC(=O)Cc1ccccc1O 1458a_100000743006_100011214920 [0,3,0,0,0,0|1,0,0]=4 22456 B13R1.470 O=C(C=CBr)Cc1ccccc1Br 1458a_100016273825_100000184730 [0,3,0,0,0,0|1,0,0]=4 22457 B13R1.470 O=C(C=CBr)Cc1ccccc1Cl 1458a_100016273825_100000187162 [0,3,0,0,0,0|1,0,0]=4 22458 B13R1.470 O=C(C=CBr)Cc1ccccc1F 1458a_100016273825_100000187165 [0,3,0,0,0,0|1,0,0]=4 22459 B13R1.470 O=C(C=CBr)Cc1ccccc1I 1458a_100016273825_100011216222 [0,3,0,0,0,0|1,0,0]=4 22460 B13R1.470 O=C(C=CCl)Cc1ccccc1Br 1458a_200016279998_100000184730 [0,3,0,0,0,0|1,0,0]=4 22461 B13R1.470 O=C(C=CCl)Cc1ccccc1Cl 1458a_200016279998_100000187162 [0,3,0,0,0,0|1,0,0]=4 22462 B13R1.470 O=C(C=CCl)Cc1ccccc1F 1458a_200016279998_100000187165 [0,3,0,0,0,0|1,0,0]=4 22463 B13R1.470 O=C(C=CCl)Cc1ccccc1I 1458a_200016279998_100011216222 [0,3,0,0,0,0|1,0,0]=4 22464 B13R1.470 O=C(C=CI)Cc1ccccc1Br 1458a_100016256311_100000184730 [0,3,0,0,0,0|1,0,0]=4 22465 B13R1.470 O=C(C=CI)Cc1ccccc1Cl 1458a_100016256311_100000187162 [0,3,0,0,0,0|1,0,0]=4 22466 B13R1.470 O=C(C=CI)Cc1ccccc1F 1458a_100016256311_100000187165 [0,3,0,0,0,0|1,0,0]=4 22467 B13R1.470 O=C(C=CI)Cc1ccccc1I 1458a_100016256311_100011216222 [0,3,0,0,0,0|1,0,0]=4 22468 B13R1.470 O=C(CCF)Cc1ccccc1Br 1458a_100000751119_100011217306 [0,3,0,0,0,0|1,0,0]=4 22469 B13R1.470 O=C(CCF)Cc1ccccc1Cl 1458a_100000183793_100011217306 [0,3,0,0,0,0|1,0,0]=4 22470 B13R1.470 O=C(CCF)Cc1ccccc1F 1458a_100000212012_100011217306 [0,3,0,0,0,0|1,0,0]=4 22471 B13R1.470 O=C(CCF)Cc1ccccc1I 1458a_100000036491_100011217306 [0,3,0,0,0,0|1,0,0]=4 22472 B13R1.470 O=C(CCF)Cc1ccccc1O 1458a_100000743006_100011217306 [0,3,0,0,0,0|1,0,0]=4 22473 B13R1.470 O=C(CCO)Cc1ccccc1Br 1458a_100000751119_100000211926 [0,3,0,0,0,0|1,0,0]=4 22474 B13R1.470 O=C(CCO)Cc1ccccc1Br 1458a_100011216618_100000184730 [0,3,0,0,0,0|1,0,0]=4 22475 B13R1.470 O=C(CCO)Cc1ccccc1Cl 1458a_100000183793_100000211926 [0,3,0,0,0,0|1,0,0]=4 22476 B13R1.470 O=C(CCO)Cc1ccccc1Cl 1458a_100011216618_100000187162 [0,3,0,0,0,0|1,0,0]=4 22477 B13R1.470 O=C(CCO)Cc1ccccc1F 1458a_100000212012_100000211926 [0,3,0,0,0,0|1,0,0]=4 22478 B13R1.470 O=C(CCO)Cc1ccccc1F 1458a_100011216618_100000187165 [0,3,0,0,0,0|1,0,0]=4 22479 B13R1.470 O=C(CCO)Cc1ccccc1I 1458a_100000036491_100000211926 [0,3,0,0,0,0|1,0,0]=4 22480 B13R1.470 O=C(CCO)Cc1ccccc1I 1458a_100011216618_100011216222 [0,3,0,0,0,0|1,0,0]=4 22481 B13R1.470 O=C(CCO)Cc1ccccc1O 1458a_100000743006_100000211926 [0,3,0,0,0,0|1,0,0]=4 22482 B13R1.470 [13CH3]SCC(=O)Cc1ccccc1Br 62a_100000700504_200025704644 [0,3,0,0,0,0|1,0,0]=4 22483 B13R1.470 [13CH3]SCC(=O)Cc1ccccc1Br 62a_200025704644_100000700504 [0,3,0,0,0,0|1,0,0]=4 22484 B13R1.40 C=CC(=O)Cc1cccc(c1Br)C 1458a_100000185746_200012349612 [0,3,0,0,0,0|1,0,0]=4 22485 B13R1.40 C=CC(=O)Cc1cccc(c1Br)Cl 1458a_100000185746_100010145525 [0,3,0,0,0,0|1,0,0]=4 22486 B13R1.40 C=CC(=O)Cc1cccc(c1Br)F 1458a_100000185746_100012351116 [0,3,0,0,0,0|1,0,0]=4 22487 B13R1.40 C=CC(=O)Cc1cccc(c1Br)I 1458a_100000185746_100010254545 [0,3,0,0,0,0|1,0,0]=4 22488 B13R1.40 C=CC(=O)Cc1cccc(c1C)Br 1458a_100000185746_100000694682 [0,3,0,0,0,0|1,0,0]=4 22489 B13R1.40 C=CC(=O)Cc1cccc(c1C)C 1458a_100000185746_100011515928 [0,3,0,0,0,0|1,0,0]=4 22490 B13R1.40 C=CC(=O)Cc1cccc(c1C)Cl 1458a_100000185746_100012186920 [0,3,0,0,0,0|1,0,0]=4 22491 B13R1.40 C=CC(=O)Cc1cccc(c1C)F 1458a_100000185746_100009813626 [0,3,0,0,0,0|1,0,0]=4 22492 B13R1.40 C=CC(=O)Cc1cccc(c1C)I 1458a_100000185746_100010150147 [0,3,0,0,0,0|1,0,0]=4 22493 B13R1.40 C=CC(=O)Cc1cccc(c1Cl)Br 1458a_100000185746_100012349491 [0,3,0,0,0,0|1,0,0]=4 22494 B13R1.40 C=CC(=O)Cc1cccc(c1Cl)Cl 1458a_100000185746_100000720918 [0,3,0,0,0,0|1,0,0]=4 22495 B13R1.40 C=CC(=O)Cc1cccc(c1Cl)F 1458a_100000185746_100000696688 [0,3,0,0,0,0|1,0,0]=4 22496 B13R1.40 C=CC(=O)Cc1cccc(c1F)Br 1458a_100000185746_100012356507 [0,3,0,0,0,0|1,0,0]=4 22497 B13R1.40 C=CC(=O)Cc1cccc(c1F)C 1458a_100000185746_100011216058 [0,3,0,0,0,0|1,0,0]=4 22498 B13R1.40 C=CC(=O)Cc1cccc(c1F)Cl 1458a_100000185746_100000716733 [0,3,0,0,0,0|1,0,0]=4 22499 B13R1.40 C=CC(=O)Cc1cccc(c1F)F 1458a_100000185746_100000217499 [0,3,0,0,0,0|1,0,0]=4 22500 B13R1.40 C=CC(=O)Cc1cccc(c1I)F 1458a_100000185746_100010149603 [0,3,0,0,0,0|1,0,0]=4 22501 B13R1.40 CCC(=O)Cc1cccc(c1Br)C 1458a_100000210414_200012349612 [0,3,0,0,0,0|1,0,0]=4 22502 B13R1.40 CCC(=O)Cc1cccc(c1Br)C 1458a_100010147021_100000210202 [0,3,0,0,0,0|1,0,0]=4 22503 B13R1.40 CCC(=O)Cc1cccc(c1Br)Cl 1458a_100000210414_100010145525 [0,3,0,0,0,0|1,0,0]=4 22504 B13R1.40 CCC(=O)Cc1cccc(c1Br)Cl 1458a_100010145769_100000210202 [0,3,0,0,0,0|1,0,0]=4 22505 B13R1.40 CCC(=O)Cc1cccc(c1Br)F 1458a_100000210414_100012351116 [0,3,0,0,0,0|1,0,0]=4 22506 B13R1.40 CCC(=O)Cc1cccc(c1Br)F 1458a_100012356664_100000210202 [0,3,0,0,0,0|1,0,0]=4 22507 B13R1.40 CCC(=O)Cc1cccc(c1Br)I 1458a_100000210414_100010254545 [0,3,0,0,0,0|1,0,0]=4 22508 B13R1.40 CCC(=O)Cc1cccc(c1C)Br 1458a_100000210414_100000694682 [0,3,0,0,0,0|1,0,0]=4 22509 B13R1.40 CCC(=O)Cc1cccc(c1C)C 1458a_100000210414_100011515928 [0,3,0,0,0,0|1,0,0]=4 22510 B13R1.40 CCC(=O)Cc1cccc(c1C)C 1458a_100011698479_100000210202 [0,3,0,0,0,0|1,0,0]=4 22511 B13R1.40 CCC(=O)Cc1cccc(c1C)Cl 1458a_100000210414_100012186920 [0,3,0,0,0,0|1,0,0]=4 22512 B13R1.40 CCC(=O)Cc1cccc(c1C)F 1458a_100000035905_100000210202 [0,3,0,0,0,0|1,0,0]=4 22513 B13R1.40 CCC(=O)Cc1cccc(c1C)F 1458a_100000210414_100009813626 [0,3,0,0,0,0|1,0,0]=4 22514 B13R1.40 CCC(=O)Cc1cccc(c1C)I 1458a_100000210414_100010150147 [0,3,0,0,0,0|1,0,0]=4 22515 B13R1.40 CCC(=O)Cc1cccc(c1Cl)Br 1458a_100000210414_100012349491 [0,3,0,0,0,0|1,0,0]=4 22516 B13R1.40 CCC(=O)Cc1cccc(c1Cl)Br 1458a_100010145770_100000210202 [0,3,0,0,0,0|1,0,0]=4 22517 B13R1.40 CCC(=O)Cc1cccc(c1Cl)Cl 1458a_100000210414_100000720918 [0,3,0,0,0,0|1,0,0]=4 22518 B13R1.40 CCC(=O)Cc1cccc(c1Cl)Cl 1458a_100000759314_100000210202 [0,3,0,0,0,0|1,0,0]=4 22519 B13R1.40 CCC(=O)Cc1cccc(c1Cl)F 1458a_100000210414_100000696688 [0,3,0,0,0,0|1,0,0]=4 22520 B13R1.40 CCC(=O)Cc1cccc(c1Cl)F 1458a_100012001123_100000210202 [0,3,0,0,0,0|1,0,0]=4 22521 B13R1.40 CCC(=O)Cc1cccc(c1F)Br 1458a_100000210414_100012356507 [0,3,0,0,0,0|1,0,0]=4 22522 B13R1.40 CCC(=O)Cc1cccc(c1F)Br 1458a_100011935088_100000210202 [0,3,0,0,0,0|1,0,0]=4 22523 B13R1.40 CCC(=O)Cc1cccc(c1F)C 1458a_100000210414_100011216058 [0,3,0,0,0,0|1,0,0]=4 22524 B13R1.40 CCC(=O)Cc1cccc(c1F)Cl 1458a_100000210414_100000716733 [0,3,0,0,0,0|1,0,0]=4 22525 B13R1.40 CCC(=O)Cc1cccc(c1F)Cl 1458a_100000709823_100000210202 [0,3,0,0,0,0|1,0,0]=4 22526 B13R1.40 CCC(=O)Cc1cccc(c1F)F 1458a_100000210414_100000217499 [0,3,0,0,0,0|1,0,0]=4 22527 B13R1.40 CCC(=O)Cc1cccc(c1F)F 1458a_100000684727_100000210202 [0,3,0,0,0,0|1,0,0]=4 22528 B13R1.40 CCC(=O)Cc1cccc(c1I)F 1458a_100000210414_100010149603 [0,3,0,0,0,0|1,0,0]=4 22529 B13R1.40 CNC(=O)Cc1cccc(c1Br)C 11a_106832991635_100010147021 [0,3,0,0,0,0|1,0,0]=4 22530 B13R1.40 CNC(=O)Cc1cccc(c1Br)C 1626a_100102657272_100010147021 [0,3,0,0,0,0|1,0,0]=4 22531 B13R1.40 CNC(=O)Cc1cccc(c1Br)C 240690a_100102657272_100010147021 [0,3,0,0,0,0|1,0,0]=4 22532 B13R1.40 CNC(=O)Cc1cccc(c1Br)C 527a_100102657272_100010147021 [0,3,0,0,0,0|1,0,0]=4 22533 B13R1.40 CNC(=O)Cc1cccc(c1Br)Cl 11a_106832991635_100010145769 [0,3,0,0,0,0|1,0,0]=4 22534 B13R1.40 CNC(=O)Cc1cccc(c1Br)Cl 1626a_100102657272_100010145769 [0,3,0,0,0,0|1,0,0]=4 22535 B13R1.40 CNC(=O)Cc1cccc(c1Br)Cl 240690a_100102657272_100010145769 [0,3,0,0,0,0|1,0,0]=4 22536 B13R1.40 CNC(=O)Cc1cccc(c1Br)Cl 527a_100102657272_100010145769 [0,3,0,0,0,0|1,0,0]=4 22537 B13R1.40 CNC(=O)Cc1cccc(c1Br)F 11a_106832991635_100012356664 [0,3,0,0,0,0|1,0,0]=4 22538 B13R1.40 CNC(=O)Cc1cccc(c1Br)F 1626a_100102657272_100012356664 [0,3,0,0,0,0|1,0,0]=4 22539 B13R1.40 CNC(=O)Cc1cccc(c1Br)F 240690a_100102657272_100012356664 [0,3,0,0,0,0|1,0,0]=4 22540 B13R1.40 CNC(=O)Cc1cccc(c1Br)F 527a_100102657272_100012356664 [0,3,0,0,0,0|1,0,0]=4 22541 B13R1.40 CNC(=O)Cc1cccc(c1C)C 11a_106832991635_100011698479 [0,3,0,0,0,0|1,0,0]=4 22542 B13R1.40 CNC(=O)Cc1cccc(c1C)C 1626a_100102657272_100011698479 [0,3,0,0,0,0|1,0,0]=4 22543 B13R1.40 CNC(=O)Cc1cccc(c1C)C 240690a_100102657272_100011698479 [0,3,0,0,0,0|1,0,0]=4 22544 B13R1.40 CNC(=O)Cc1cccc(c1C)C 527a_100102657272_100011698479 [0,3,0,0,0,0|1,0,0]=4 22545 B13R1.40 CNC(=O)Cc1cccc(c1C)F 11a_106832991635_100000035905 [0,3,0,0,0,0|1,0,0]=4 22546 B13R1.40 CNC(=O)Cc1cccc(c1C)F 1626a_100102657272_100000035905 [0,3,0,0,0,0|1,0,0]=4 22547 B13R1.40 CNC(=O)Cc1cccc(c1C)F 240690a_100102657272_100000035905 [0,3,0,0,0,0|1,0,0]=4 22548 B13R1.40 CNC(=O)Cc1cccc(c1C)F 527a_100102657272_100000035905 [0,3,0,0,0,0|1,0,0]=4 22549 B13R1.40 CNC(=O)Cc1cccc(c1Cl)Br 11a_106832991635_100010145770 [0,3,0,0,0,0|1,0,0]=4 22550 B13R1.40 CNC(=O)Cc1cccc(c1Cl)Br 1626a_100102657272_100010145770 [0,3,0,0,0,0|1,0,0]=4 22551 B13R1.40 CNC(=O)Cc1cccc(c1Cl)Br 240690a_100102657272_100010145770 [0,3,0,0,0,0|1,0,0]=4 22552 B13R1.40 CNC(=O)Cc1cccc(c1Cl)Br 527a_100102657272_100010145770 [0,3,0,0,0,0|1,0,0]=4 22553 B13R1.40 CNC(=O)Cc1cccc(c1Cl)Cl 11a_106832991635_100000759314 [0,3,0,0,0,0|1,0,0]=4 22554 B13R1.40 CNC(=O)Cc1cccc(c1Cl)Cl 1626a_100102657272_100000759314 [0,3,0,0,0,0|1,0,0]=4 22555 B13R1.40 CNC(=O)Cc1cccc(c1Cl)Cl 240690a_100102657272_100000759314 [0,3,0,0,0,0|1,0,0]=4 22556 B13R1.40 CNC(=O)Cc1cccc(c1Cl)Cl 527a_100102657272_100000759314 [0,3,0,0,0,0|1,0,0]=4 22557 B13R1.40 CNC(=O)Cc1cccc(c1Cl)F 11a_106832991635_100012001123 [0,3,0,0,0,0|1,0,0]=4 22558 B13R1.40 CNC(=O)Cc1cccc(c1Cl)F 1626a_100102657272_100012001123 [0,3,0,0,0,0|1,0,0]=4 22559 B13R1.40 CNC(=O)Cc1cccc(c1Cl)F 240690a_100102657272_100012001123 [0,3,0,0,0,0|1,0,0]=4 22560 B13R1.40 CNC(=O)Cc1cccc(c1Cl)F 527a_100102657272_100012001123 [0,3,0,0,0,0|1,0,0]=4 22561 B13R1.40 CNC(=O)Cc1cccc(c1F)Br 11a_106832991635_100011935088 [0,3,0,0,0,0|1,0,0]=4 22562 B13R1.40 CNC(=O)Cc1cccc(c1F)Br 1626a_100102657272_100011935088 [0,3,0,0,0,0|1,0,0]=4 22563 B13R1.40 CNC(=O)Cc1cccc(c1F)Br 240690a_100102657272_100011935088 [0,3,0,0,0,0|1,0,0]=4 22564 B13R1.40 CNC(=O)Cc1cccc(c1F)Br 527a_100102657272_100011935088 [0,3,0,0,0,0|1,0,0]=4 22565 B13R1.40 CNC(=O)Cc1cccc(c1F)Cl 11a_106832991635_100000709823 [0,3,0,0,0,0|1,0,0]=4 22566 B13R1.40 CNC(=O)Cc1cccc(c1F)Cl 1626a_100102657272_100000709823 [0,3,0,0,0,0|1,0,0]=4 22567 B13R1.40 CNC(=O)Cc1cccc(c1F)Cl 240690a_100102657272_100000709823 [0,3,0,0,0,0|1,0,0]=4 22568 B13R1.40 CNC(=O)Cc1cccc(c1F)Cl 527a_100102657272_100000709823 [0,3,0,0,0,0|1,0,0]=4 22569 B13R1.40 CNC(=O)Cc1cccc(c1F)F 11a_106832991635_100000684727 [0,3,0,0,0,0|1,0,0]=4 22570 B13R1.40 CNC(=O)Cc1cccc(c1F)F 1626a_100102657272_100000684727 [0,3,0,0,0,0|1,0,0]=4 22571 B13R1.40 CNC(=O)Cc1cccc(c1F)F 240690a_100102657272_100000684727 [0,3,0,0,0,0|1,0,0]=4 22572 B13R1.40 CNC(=O)Cc1cccc(c1F)F 527a_100102657272_100000684727 [0,3,0,0,0,0|1,0,0]=4 22573 B13R1.40 COC(=O)Cc1cccc(c1F)O 271570a_203496583355_100010741560 [0,3,0,0,0,0|1,0,0]=4 22574 B13R1.40 COC(=O)Cc1cccc(c1O)C 271570a_203496583355_200010150888 [0,3,0,0,0,0|1,0,0]=4 22575 B13R1.40 COC(=O)Cc1cccc(c1O)O 271570a_203496583355_100010150830 [0,3,0,0,0,0|1,0,0]=4 22576 B13R1.40 Cc1c(cccc1CC(=O)CF)F 1458a_100000035905_100015361967 [0,3,0,0,0,0|1,0,0]=4 22577 B13R1.40 Cc1c(cccc1CC(=O)CO)Br 1458a_100000210174_100000694682 [0,3,0,0,0,0|1,0,0]=4 22578 B13R1.40 Cc1c(cccc1CC(=O)CO)Cl 1458a_100000210174_100012186920 [0,3,0,0,0,0|1,0,0]=4 22579 B13R1.40 Cc1c(cccc1CC(=O)CO)F 1458a_100000210174_100009813626 [0,3,0,0,0,0|1,0,0]=4 22580 B13R1.40 Cc1c(cccc1CC(=O)CO)I 1458a_100000210174_100010150147 [0,3,0,0,0,0|1,0,0]=4 22581 B13R1.40 Cc1cccc(c1Br)CC(=O)CF 1458a_100010147021_100015361967 [0,3,0,0,0,0|1,0,0]=4 22582 B13R1.40 Cc1cccc(c1Br)CC(=O)CO 1458a_100000210174_200012349612 [0,3,0,0,0,0|1,0,0]=4 22583 B13R1.40 Cc1cccc(c1C)CC(=O)CF 1458a_100011698479_100015361967 [0,3,0,0,0,0|1,0,0]=4 22584 B13R1.40 Cc1cccc(c1C)CC(=O)CO 1458a_100000210174_100011515928 [0,3,0,0,0,0|1,0,0]=4 22585 B13R1.40 Cc1cccc(c1F)CC(=O)CO 1458a_100000210174_100011216058 [0,3,0,0,0,0|1,0,0]=4 22586 B13R1.40 O=C(CF)Cc1cccc(c1Br)Cl 1458a_100010145769_100015361967 [0,3,0,0,0,0|1,0,0]=4 22587 B13R1.40 O=C(CF)Cc1cccc(c1Br)F 1458a_100012356664_100015361967 [0,3,0,0,0,0|1,0,0]=4 22588 B13R1.40 O=C(CF)Cc1cccc(c1Cl)Br 1458a_100010145770_100015361967 [0,3,0,0,0,0|1,0,0]=4 22589 B13R1.40 O=C(CF)Cc1cccc(c1Cl)Cl 1458a_100000759314_100015361967 [0,3,0,0,0,0|1,0,0]=4 22590 B13R1.40 O=C(CF)Cc1cccc(c1Cl)F 1458a_100012001123_100015361967 [0,3,0,0,0,0|1,0,0]=4 22591 B13R1.40 O=C(CF)Cc1cccc(c1F)Br 1458a_100011935088_100015361967 [0,3,0,0,0,0|1,0,0]=4 22592 B13R1.40 O=C(CF)Cc1cccc(c1F)Cl 1458a_100000709823_100015361967 [0,3,0,0,0,0|1,0,0]=4 22593 B13R1.40 O=C(CF)Cc1cccc(c1F)F 1458a_100000684727_100015361967 [0,3,0,0,0,0|1,0,0]=4 22594 B13R1.40 O=C(CO)Cc1cccc(c1Br)Cl 1458a_100000210174_100010145525 [0,3,0,0,0,0|1,0,0]=4 22595 B13R1.40 O=C(CO)Cc1cccc(c1Br)F 1458a_100000210174_100012351116 [0,3,0,0,0,0|1,0,0]=4 22596 B13R1.40 O=C(CO)Cc1cccc(c1Br)I 1458a_100000210174_100010254545 [0,3,0,0,0,0|1,0,0]=4 22597 B13R1.40 O=C(CO)Cc1cccc(c1Cl)Br 1458a_100000210174_100012349491 [0,3,0,0,0,0|1,0,0]=4 22598 B13R1.40 O=C(CO)Cc1cccc(c1Cl)Cl 1458a_100000210174_100000720918 [0,3,0,0,0,0|1,0,0]=4 22599 B13R1.40 O=C(CO)Cc1cccc(c1Cl)F 1458a_100000210174_100000696688 [0,3,0,0,0,0|1,0,0]=4 22600 B13R1.40 O=C(CO)Cc1cccc(c1F)Br 1458a_100000210174_100012356507 [0,3,0,0,0,0|1,0,0]=4 22601 B13R1.40 O=C(CO)Cc1cccc(c1F)Cl 1458a_100000210174_100000716733 [0,3,0,0,0,0|1,0,0]=4 22602 B13R1.40 O=C(CO)Cc1cccc(c1F)F 1458a_100000210174_100000217499 [0,3,0,0,0,0|1,0,0]=4 22603 B13R1.40 O=C(CO)Cc1cccc(c1I)F 1458a_100000210174_100010149603 [0,3,0,0,0,0|1,0,0]=4 22604 B13R1.81 C=CC(=O)Cc1cccc(c1)C#N 1458a_100000185746_100000233786 [0,3,0,0,0,0|1,0,0]=4 22605 B13R1.81 C=CC(=O)Cc1cccc(c1)C=O 1458a_100000185746_100009816774 [0,3,0,0,0,0|1,0,0]=4 22606 B13R1.81 C=CC(=O)Cc1cccc(c1)CO 1458a_100000185746_100010188025 [0,3,0,0,0,0|1,0,0]=4 22607 B13R1.81 C=CC(=O)Cc1cccc(c1)OC 1458a_100000185746_100000211672 [0,3,0,0,0,0|1,0,0]=4 22608 B13R1.81 C=Cc1cccc(c1)CC(=O)OC 271570a_100011290941_100000699549 [0,3,0,0,0,0|1,0,0]=4 22609 B13R1.81 CCC(=O)Cc1cccc(c1)C#N 1458a_100000210414_100000233786 [0,3,0,0,0,0|1,0,0]=4 22610 B13R1.81 CCC(=O)Cc1cccc(c1)C#N 1458a_100000684415_100000210202 [0,3,0,0,0,0|1,0,0]=4 22611 B13R1.81 CCC(=O)Cc1cccc(c1)C=O 1458a_100000210414_100009816774 [0,3,0,0,0,0|1,0,0]=4 22612 B13R1.81 CCC(=O)Cc1cccc(c1)CO 1458a_100000210414_100010188025 [0,3,0,0,0,0|1,0,0]=4 22613 B13R1.81 CCC(=O)Cc1cccc(c1)OC 1458a_100000210414_100000211672 [0,3,0,0,0,0|1,0,0]=4 22614 B13R1.81 CCC(=O)Cc1cccc(c1)OC 1458a_100000211281_100000210202 [0,3,0,0,0,0|1,0,0]=4 22615 B13R1.81 CCC(=O)Cc1cccc(c1)SC 1458a_100000035702_100000210202 [0,3,0,0,0,0|1,0,0]=4 22616 B13R1.81 CNC(=O)Cc1cccc(c1)C#N 11a_106832991635_100000684415 [0,3,0,0,0,0|1,0,0]=4 22617 B13R1.81 CNC(=O)Cc1cccc(c1)C#N 1626a_100102657272_100000684415 [0,3,0,0,0,0|1,0,0]=4 22618 B13R1.81 CNC(=O)Cc1cccc(c1)C#N 240690a_100102657272_100000684415 [0,3,0,0,0,0|1,0,0]=4 22619 B13R1.81 CNC(=O)Cc1cccc(c1)C#N 527a_100102657272_100000684415 [0,3,0,0,0,0|1,0,0]=4 22620 B13R1.81 CNC(=O)Cc1cccc(c1)NC 2230a_100011690097_200000210301 [0,3,0,0,0,0|1,0,0]=4 22621 B13R1.81 CNC(=O)Cc1cccc(c1)NC 34a_100011690097_200000210301 [0,3,0,0,0,0|1,0,0]=4 22622 B13R1.81 CNC(=O)Cc1cccc(c1)N[13CH3] 2230a_100011690097_200025704644 [0,3,0,0,0,0|1,0,0]=4 22623 B13R1.81 CNC(=O)Cc1cccc(c1)N[13CH3] 34a_100011690097_200025704644 [0,3,0,0,0,0|1,0,0]=4 22624 B13R1.81 CNC(=O)Cc1cccc(c1)OC 11a_106832991635_100000211281 [0,3,0,0,0,0|1,0,0]=4 22625 B13R1.81 CNC(=O)Cc1cccc(c1)OC 1626a_100102657272_100000211281 [0,3,0,0,0,0|1,0,0]=4 22626 B13R1.81 CNC(=O)Cc1cccc(c1)OC 240690a_100102657272_100000211281 [0,3,0,0,0,0|1,0,0]=4 22627 B13R1.81 CNC(=O)Cc1cccc(c1)OC 527a_100102657272_100000211281 [0,3,0,0,0,0|1,0,0]=4 22628 B13R1.81 CNC(=O)Cc1cccc(c1)SC 11a_106832991635_100000035702 [0,3,0,0,0,0|1,0,0]=4 22629 B13R1.81 CNC(=O)Cc1cccc(c1)SC 1626a_100102657272_100000035702 [0,3,0,0,0,0|1,0,0]=4 22630 B13R1.81 CNC(=O)Cc1cccc(c1)SC 240690a_100102657272_100000035702 [0,3,0,0,0,0|1,0,0]=4 22631 B13R1.81 CNC(=O)Cc1cccc(c1)SC 527a_100102657272_100000035702 [0,3,0,0,0,0|1,0,0]=4 22632 B13R1.81 COC(=O)Cc1cccc(c1)SC 62a_100000699549_200000210301 [0,3,0,0,0,0|1,0,0]=4 22633 B13R1.81 COC(=O)Cc1cccc(c1)SC 62a_200000210301_100000699549 [0,3,0,0,0,0|1,0,0]=4 22634 B13R1.81 COC(=O)Cc1cccc(c1)S[13CH3] 62a_100000699549_200025704644 [0,3,0,0,0,0|1,0,0]=4 22635 B13R1.81 COC(=O)Cc1cccc(c1)S[13CH3] 62a_200025704644_100000699549 [0,3,0,0,0,0|1,0,0]=4 22636 B13R1.81 COc1cccc(c1)CC(=O)CF 1458a_100000211281_100015361967 [0,3,0,0,0,0|1,0,0]=4 22637 B13R1.81 COc1cccc(c1)CC(=O)CO 1458a_100000210174_100000211672 [0,3,0,0,0,0|1,0,0]=4 22638 B13R1.81 CSc1cccc(c1)CC(=O)CF 1458a_100000035702_100015361967 [0,3,0,0,0,0|1,0,0]=4 22639 B13R1.81 N#Cc1cccc(c1)CC(=O)CF 1458a_100000684415_100015361967 [0,3,0,0,0,0|1,0,0]=4 22640 B13R1.81 N#Cc1cccc(c1)CC(=O)CO 1458a_100000210174_100000233786 [0,3,0,0,0,0|1,0,0]=4 22641 B13R1.81 O=C(CO)Cc1cccc(c1)CO 1458a_100000210174_100010188025 [0,3,0,0,0,0|1,0,0]=4 22642 B13R1.81 O=Cc1cccc(c1)CC(=O)CO 1458a_100000210174_100009816774 [0,3,0,0,0,0|1,0,0]=4 22643 B13R1.2872 C=CC(=O)Cc1cc(ccc1Br)Br 1458a_100000185746_100011982794 [0,3,0,0,0,0|1,0,0]=4 22644 B13R1.2872 C=CC(=O)Cc1cc(ccc1Br)Cl 1458a_100000185746_100000733903 [0,3,0,0,0,0|1,0,0]=4 22645 B13R1.2872 C=CC(=O)Cc1cc(ccc1Br)F 1458a_100000185746_100000736370 [0,3,0,0,0,0|1,0,0]=4 22646 B13R1.2872 C=CC(=O)Cc1cc(ccc1Br)I 1458a_100000185746_100012355412 [0,3,0,0,0,0|1,0,0]=4 22647 B13R1.2872 C=CC(=O)Cc1cc(ccc1C)C 1458a_100000185746_100000184699 [0,3,0,0,0,0|1,0,0]=4 22648 B13R1.2872 C=CC(=O)Cc1cc(ccc1C)Cl 1458a_100000185746_100012186985 [0,3,0,0,0,0|1,0,0]=4 22649 B13R1.2872 C=CC(=O)Cc1cc(ccc1C)F 1458a_100000185746_100000709795 [0,3,0,0,0,0|1,0,0]=4 22650 B13R1.2872 C=CC(=O)Cc1cc(ccc1Cl)Br 1458a_100000185746_100000763347 [0,3,0,0,0,0|1,0,0]=4 22651 B13R1.2872 C=CC(=O)Cc1cc(ccc1Cl)C 1458a_100000185746_100009871730 [0,3,0,0,0,0|1,0,0]=4 22652 B13R1.2872 C=CC(=O)Cc1cc(ccc1Cl)Cl 1458a_100000185746_100000754809 [0,3,0,0,0,0|1,0,0]=4 22653 B13R1.2872 C=CC(=O)Cc1cc(ccc1Cl)F 1458a_100000185746_100000709952 [0,3,0,0,0,0|1,0,0]=4 22654 B13R1.2872 C=CC(=O)Cc1cc(ccc1Cl)I 1458a_100000185746_100010188191 [0,3,0,0,0,0|1,0,0]=4 22655 B13R1.2872 C=CC(=O)Cc1cc(ccc1F)Br 1458a_100000185746_100000736399 [0,3,0,0,0,0|1,0,0]=4 22656 B13R1.2872 C=CC(=O)Cc1cc(ccc1F)C 1458a_100000185746_100011260760 [0,3,0,0,0,0|1,0,0]=4 22657 B13R1.2872 C=CC(=O)Cc1cc(ccc1F)Cl 1458a_100000185746_100000716957 [0,3,0,0,0,0|1,0,0]=4 22658 B13R1.2872 C=CC(=O)Cc1cc(ccc1F)F 1458a_100000185746_100000741279 [0,3,0,0,0,0|1,0,0]=4 22659 B13R1.2872 C=CC(=O)Cc1cc(ccc1F)I 1458a_100000185746_200010149601 [0,3,0,0,0,0|1,0,0]=4 22660 B13R1.2872 C=CC(=O)Cc1cc(ccc1I)Br 1458a_100000185746_100012362523 [0,3,0,0,0,0|1,0,0]=4 22661 B13R1.2872 C=CC(=O)Cc1cc(ccc1I)Cl 1458a_100000185746_100012348826 [0,3,0,0,0,0|1,0,0]=4 22662 B13R1.2872 C=CC(=O)Cc1cc(ccc1I)F 1458a_100000185746_100010149606 [0,3,0,0,0,0|1,0,0]=4 22663 B13R1.2872 C=CC(=O)Cc1cc(ccc1O)F 1458a_100000185746_100010161318 [0,3,0,0,0,0|1,0,0]=4 22664 B13R1.2872 CCC(=O)Cc1cc(ccc1Br)Br 1458a_100000210414_100011982794 [0,3,0,0,0,0|1,0,0]=4 22665 B13R1.2872 CCC(=O)Cc1cc(ccc1Br)Br 1458a_100010004897_100000210202 [0,3,0,0,0,0|1,0,0]=4 22666 B13R1.2872 CCC(=O)Cc1cc(ccc1Br)C 1458a_100010004923_100000210202 [0,3,0,0,0,0|1,0,0]=4 22667 B13R1.2872 CCC(=O)Cc1cc(ccc1Br)Cl 1458a_100000210414_100000733903 [0,3,0,0,0,0|1,0,0]=4 22668 B13R1.2872 CCC(=O)Cc1cc(ccc1Br)Cl 1458a_100000690875_100000210202 [0,3,0,0,0,0|1,0,0]=4 22669 B13R1.2872 CCC(=O)Cc1cc(ccc1Br)F 1458a_100000210414_100000736370 [0,3,0,0,0,0|1,0,0]=4 22670 B13R1.2872 CCC(=O)Cc1cc(ccc1Br)F 1458a_100000690878_100000210202 [0,3,0,0,0,0|1,0,0]=4 22671 B13R1.2872 CCC(=O)Cc1cc(ccc1Br)I 1458a_100000210414_100012355412 [0,3,0,0,0,0|1,0,0]=4 22672 B13R1.2872 CCC(=O)Cc1cc(ccc1C)Br 1458a_100010244045_100000210202 [0,3,0,0,0,0|1,0,0]=4 22673 B13R1.2872 CCC(=O)Cc1cc(ccc1C)C 1458a_100000210414_100000184699 [0,3,0,0,0,0|1,0,0]=4 22674 B13R1.2872 CCC(=O)Cc1cc(ccc1C)C 1458a_100000749331_100000210202 [0,3,0,0,0,0|1,0,0]=4 22675 B13R1.2872 CCC(=O)Cc1cc(ccc1C)Cl 1458a_100000210414_100012186985 [0,3,0,0,0,0|1,0,0]=4 22676 B13R1.2872 CCC(=O)Cc1cc(ccc1C)F 1458a_100000210414_100000709795 [0,3,0,0,0,0|1,0,0]=4 22677 B13R1.2872 CCC(=O)Cc1cc(ccc1C)F 1458a_100011219217_100000210202 [0,3,0,0,0,0|1,0,0]=4 22678 B13R1.2872 CCC(=O)Cc1cc(ccc1Cl)Br 1458a_100000210414_100000763347 [0,3,0,0,0,0|1,0,0]=4 22679 B13R1.2872 CCC(=O)Cc1cc(ccc1Cl)Br 1458a_100011600618_100000210202 [0,3,0,0,0,0|1,0,0]=4 22680 B13R1.2872 CCC(=O)Cc1cc(ccc1Cl)C 1458a_100000210414_100009871730 [0,3,0,0,0,0|1,0,0]=4 22681 B13R1.2872 CCC(=O)Cc1cc(ccc1Cl)Cl 1458a_100000210414_100000754809 [0,3,0,0,0,0|1,0,0]=4 22682 B13R1.2872 CCC(=O)Cc1cc(ccc1Cl)Cl 1458a_100000748246_100000210202 [0,3,0,0,0,0|1,0,0]=4 22683 B13R1.2872 CCC(=O)Cc1cc(ccc1Cl)F 1458a_100000210414_100000709952 [0,3,0,0,0,0|1,0,0]=4 22684 B13R1.2872 CCC(=O)Cc1cc(ccc1Cl)F 1458a_100011830335_100000210202 [0,3,0,0,0,0|1,0,0]=4 22685 B13R1.2872 CCC(=O)Cc1cc(ccc1Cl)I 1458a_100000210414_100010188191 [0,3,0,0,0,0|1,0,0]=4 22686 B13R1.2872 CCC(=O)Cc1cc(ccc1F)Br 1458a_100000210414_100000736399 [0,3,0,0,0,0|1,0,0]=4 22687 B13R1.2872 CCC(=O)Cc1cc(ccc1F)Br 1458a_100000690877_100000210202 [0,3,0,0,0,0|1,0,0]=4 22688 B13R1.2872 CCC(=O)Cc1cc(ccc1F)C 1458a_100000210414_100011260760 [0,3,0,0,0,0|1,0,0]=4 22689 B13R1.2872 CCC(=O)Cc1cc(ccc1F)C 1458a_100011667363_100000210202 [0,3,0,0,0,0|1,0,0]=4 22690 B13R1.2872 CCC(=O)Cc1cc(ccc1F)Cl 1458a_100000210414_100000716957 [0,3,0,0,0,0|1,0,0]=4 22691 B13R1.2872 CCC(=O)Cc1cc(ccc1F)Cl 1458a_100011217548_100000210202 [0,3,0,0,0,0|1,0,0]=4 22692 B13R1.2872 CCC(=O)Cc1cc(ccc1F)F 1458a_100000210414_100000741279 [0,3,0,0,0,0|1,0,0]=4 22693 B13R1.2872 CCC(=O)Cc1cc(ccc1F)F 1458a_100000762760_100000210202 [0,3,0,0,0,0|1,0,0]=4 22694 B13R1.2872 CCC(=O)Cc1cc(ccc1F)I 1458a_100000210414_200010149601 [0,3,0,0,0,0|1,0,0]=4 22695 B13R1.2872 CCC(=O)Cc1cc(ccc1I)Br 1458a_100000210414_100012362523 [0,3,0,0,0,0|1,0,0]=4 22696 B13R1.2872 CCC(=O)Cc1cc(ccc1I)Cl 1458a_100000210414_100012348826 [0,3,0,0,0,0|1,0,0]=4 22697 B13R1.2872 CCC(=O)Cc1cc(ccc1I)F 1458a_100000210414_100010149606 [0,3,0,0,0,0|1,0,0]=4 22698 B13R1.2872 CCC(=O)Cc1cc(ccc1O)Br 1458a_100010072483_100000210202 [0,3,0,0,0,0|1,0,0]=4 22699 B13R1.2872 CCC(=O)Cc1cc(ccc1O)F 1458a_100000210414_100010161318 [0,3,0,0,0,0|1,0,0]=4 22700 B13R1.2872 CCC(=O)Cc1cc(ccc1O)O 1458a_100000038496_100000210202 [0,3,0,0,0,0|1,0,0]=4 22701 B13R1.2872 CNC(=O)Cc1cc(ccc1Br)Br 11a_106832991635_100010004897 [0,3,0,0,0,0|1,0,0]=4 22702 B13R1.2872 CNC(=O)Cc1cc(ccc1Br)Br 240690a_100102657272_100010004897 [0,3,0,0,0,0|1,0,0]=4 22703 B13R1.2872 CNC(=O)Cc1cc(ccc1Br)Br 527a_100102657272_100010004897 [0,3,0,0,0,0|1,0,0]=4 22704 B13R1.2872 CNC(=O)Cc1cc(ccc1Br)C 11a_106832991635_100010004923 [0,3,0,0,0,0|1,0,0]=4 22705 B13R1.2872 CNC(=O)Cc1cc(ccc1Br)C 1626a_100102657272_100010004923 [0,3,0,0,0,0|1,0,0]=4 22706 B13R1.2872 CNC(=O)Cc1cc(ccc1Br)C 240690a_100102657272_100010004923 [0,3,0,0,0,0|1,0,0]=4 22707 B13R1.2872 CNC(=O)Cc1cc(ccc1Br)C 527a_100102657272_100010004923 [0,3,0,0,0,0|1,0,0]=4 22708 B13R1.2872 CNC(=O)Cc1cc(ccc1Br)Cl 11a_106832991635_100000690875 [0,3,0,0,0,0|1,0,0]=4 22709 B13R1.2872 CNC(=O)Cc1cc(ccc1Br)Cl 1626a_100102657272_100000690875 [0,3,0,0,0,0|1,0,0]=4 22710 B13R1.2872 CNC(=O)Cc1cc(ccc1Br)Cl 240690a_100102657272_100000690875 [0,3,0,0,0,0|1,0,0]=4 22711 B13R1.2872 CNC(=O)Cc1cc(ccc1Br)Cl 527a_100102657272_100000690875 [0,3,0,0,0,0|1,0,0]=4 22712 B13R1.2872 CNC(=O)Cc1cc(ccc1Br)F 11a_106832991635_100000690878 [0,3,0,0,0,0|1,0,0]=4 22713 B13R1.2872 CNC(=O)Cc1cc(ccc1Br)F 1626a_100102657272_100000690878 [0,3,0,0,0,0|1,0,0]=4 22714 B13R1.2872 CNC(=O)Cc1cc(ccc1Br)F 240690a_100102657272_100000690878 [0,3,0,0,0,0|1,0,0]=4 22715 B13R1.2872 CNC(=O)Cc1cc(ccc1Br)F 527a_100102657272_100000690878 [0,3,0,0,0,0|1,0,0]=4 22716 B13R1.2872 CNC(=O)Cc1cc(ccc1C)Br 11a_106832991635_100010244045 [0,3,0,0,0,0|1,0,0]=4 22717 B13R1.2872 CNC(=O)Cc1cc(ccc1C)Br 1626a_100102657272_100010244045 [0,3,0,0,0,0|1,0,0]=4 22718 B13R1.2872 CNC(=O)Cc1cc(ccc1C)Br 240690a_100102657272_100010244045 [0,3,0,0,0,0|1,0,0]=4 22719 B13R1.2872 CNC(=O)Cc1cc(ccc1C)Br 527a_100102657272_100010244045 [0,3,0,0,0,0|1,0,0]=4 22720 B13R1.2872 CNC(=O)Cc1cc(ccc1C)C 11a_106832991635_100000749331 [0,3,0,0,0,0|1,0,0]=4 22721 B13R1.2872 CNC(=O)Cc1cc(ccc1C)C 1626a_100102657272_100000749331 [0,3,0,0,0,0|1,0,0]=4 22722 B13R1.2872 CNC(=O)Cc1cc(ccc1C)C 240690a_100102657272_100000749331 [0,3,0,0,0,0|1,0,0]=4 22723 B13R1.2872 CNC(=O)Cc1cc(ccc1C)C 527a_100102657272_100000749331 [0,3,0,0,0,0|1,0,0]=4 22724 B13R1.2872 CNC(=O)Cc1cc(ccc1C)F 11a_106832991635_100011219217 [0,3,0,0,0,0|1,0,0]=4 22725 B13R1.2872 CNC(=O)Cc1cc(ccc1C)F 1626a_100102657272_100011219217 [0,3,0,0,0,0|1,0,0]=4 22726 B13R1.2872 CNC(=O)Cc1cc(ccc1C)F 240690a_100102657272_100011219217 [0,3,0,0,0,0|1,0,0]=4 22727 B13R1.2872 CNC(=O)Cc1cc(ccc1C)F 527a_100102657272_100011219217 [0,3,0,0,0,0|1,0,0]=4 22728 B13R1.2872 CNC(=O)Cc1cc(ccc1Cl)Br 11a_106832991635_100011600618 [0,3,0,0,0,0|1,0,0]=4 22729 B13R1.2872 CNC(=O)Cc1cc(ccc1Cl)Br 1626a_100102657272_100011600618 [0,3,0,0,0,0|1,0,0]=4 22730 B13R1.2872 CNC(=O)Cc1cc(ccc1Cl)Br 240690a_100102657272_100011600618 [0,3,0,0,0,0|1,0,0]=4 22731 B13R1.2872 CNC(=O)Cc1cc(ccc1Cl)Br 527a_100102657272_100011600618 [0,3,0,0,0,0|1,0,0]=4 22732 B13R1.2872 CNC(=O)Cc1cc(ccc1Cl)Cl 11a_106832991635_100000748246 [0,3,0,0,0,0|1,0,0]=4 22733 B13R1.2872 CNC(=O)Cc1cc(ccc1Cl)Cl 1626a_100102657272_100000748246 [0,3,0,0,0,0|1,0,0]=4 22734 B13R1.2872 CNC(=O)Cc1cc(ccc1Cl)Cl 240690a_100102657272_100000748246 [0,3,0,0,0,0|1,0,0]=4 22735 B13R1.2872 CNC(=O)Cc1cc(ccc1Cl)Cl 527a_100102657272_100000748246 [0,3,0,0,0,0|1,0,0]=4 22736 B13R1.2872 CNC(=O)Cc1cc(ccc1Cl)F 11a_106832991635_100011830335 [0,3,0,0,0,0|1,0,0]=4 22737 B13R1.2872 CNC(=O)Cc1cc(ccc1Cl)F 1626a_100102657272_100011830335 [0,3,0,0,0,0|1,0,0]=4 22738 B13R1.2872 CNC(=O)Cc1cc(ccc1Cl)F 240690a_100102657272_100011830335 [0,3,0,0,0,0|1,0,0]=4 22739 B13R1.2872 CNC(=O)Cc1cc(ccc1Cl)F 527a_100102657272_100011830335 [0,3,0,0,0,0|1,0,0]=4 22740 B13R1.2872 CNC(=O)Cc1cc(ccc1F)Br 11a_106832991635_100000690877 [0,3,0,0,0,0|1,0,0]=4 22741 B13R1.2872 CNC(=O)Cc1cc(ccc1F)Br 1626a_100102657272_100000690877 [0,3,0,0,0,0|1,0,0]=4 22742 B13R1.2872 CNC(=O)Cc1cc(ccc1F)Br 240690a_100102657272_100000690877 [0,3,0,0,0,0|1,0,0]=4 22743 B13R1.2872 CNC(=O)Cc1cc(ccc1F)Br 527a_100102657272_100000690877 [0,3,0,0,0,0|1,0,0]=4 22744 B13R1.2872 CNC(=O)Cc1cc(ccc1F)C 11a_106832991635_100011667363 [0,3,0,0,0,0|1,0,0]=4 22745 B13R1.2872 CNC(=O)Cc1cc(ccc1F)C 1626a_100102657272_100011667363 [0,3,0,0,0,0|1,0,0]=4 22746 B13R1.2872 CNC(=O)Cc1cc(ccc1F)C 240690a_100102657272_100011667363 [0,3,0,0,0,0|1,0,0]=4 22747 B13R1.2872 CNC(=O)Cc1cc(ccc1F)C 527a_100102657272_100011667363 [0,3,0,0,0,0|1,0,0]=4 22748 B13R1.2872 CNC(=O)Cc1cc(ccc1F)Cl 11a_106832991635_100011217548 [0,3,0,0,0,0|1,0,0]=4 22749 B13R1.2872 CNC(=O)Cc1cc(ccc1F)Cl 1626a_100102657272_100011217548 [0,3,0,0,0,0|1,0,0]=4 22750 B13R1.2872 CNC(=O)Cc1cc(ccc1F)Cl 240690a_100102657272_100011217548 [0,3,0,0,0,0|1,0,0]=4 22751 B13R1.2872 CNC(=O)Cc1cc(ccc1F)Cl 527a_100102657272_100011217548 [0,3,0,0,0,0|1,0,0]=4 22752 B13R1.2872 CNC(=O)Cc1cc(ccc1F)F 11a_106832991635_100000762760 [0,3,0,0,0,0|1,0,0]=4 22753 B13R1.2872 CNC(=O)Cc1cc(ccc1F)F 1626a_100102657272_100000762760 [0,3,0,0,0,0|1,0,0]=4 22754 B13R1.2872 CNC(=O)Cc1cc(ccc1F)F 240690a_100102657272_100000762760 [0,3,0,0,0,0|1,0,0]=4 22755 B13R1.2872 CNC(=O)Cc1cc(ccc1F)F 527a_100102657272_100000762760 [0,3,0,0,0,0|1,0,0]=4 22756 B13R1.2872 CNC(=O)Cc1cc(ccc1O)Br 240690a_100102657272_100010072483 [0,3,0,0,0,0|1,0,0]=4 22757 B13R1.2872 COC(=O)Cc1cc(ccc1O)O 271570a_203496583355_100010185610 [0,3,0,0,0,0|1,0,0]=4 22758 B13R1.2872 Cc1ccc(c(c1)CC(=O)CF)Br 1458a_100010004923_100015361967 [0,3,0,0,0,0|1,0,0]=4 22759 B13R1.2872 Cc1ccc(c(c1)CC(=O)CF)C 1458a_100000749331_100015361967 [0,3,0,0,0,0|1,0,0]=4 22760 B13R1.2872 Cc1ccc(c(c1)CC(=O)CF)F 1458a_100011667363_100015361967 [0,3,0,0,0,0|1,0,0]=4 22761 B13R1.2872 Cc1ccc(c(c1)CC(=O)CO)C 1458a_100000210174_100000184699 [0,3,0,0,0,0|1,0,0]=4 22762 B13R1.2872 Cc1ccc(c(c1)CC(=O)CO)Cl 1458a_100000210174_100009871730 [0,3,0,0,0,0|1,0,0]=4 22763 B13R1.2872 Cc1ccc(c(c1)CC(=O)CO)F 1458a_100000210174_100011260760 [0,3,0,0,0,0|1,0,0]=4 22764 B13R1.2872 Cc1ccc(cc1CC(=O)CF)Br 1458a_100010244045_100015361967 [0,3,0,0,0,0|1,0,0]=4 22765 B13R1.2872 Cc1ccc(cc1CC(=O)CF)F 1458a_100011219217_100015361967 [0,3,0,0,0,0|1,0,0]=4 22766 B13R1.2872 Cc1ccc(cc1CC(=O)CO)Cl 1458a_100000210174_100012186985 [0,3,0,0,0,0|1,0,0]=4 22767 B13R1.2872 Cc1ccc(cc1CC(=O)CO)F 1458a_100000210174_100000709795 [0,3,0,0,0,0|1,0,0]=4 22768 B13R1.2872 O=C(CF)Cc1cc(ccc1Br)Br 1458a_100010004897_100015361967 [0,3,0,0,0,0|1,0,0]=4 22769 B13R1.2872 O=C(CF)Cc1cc(ccc1Br)Cl 1458a_100000690875_100015361967 [0,3,0,0,0,0|1,0,0]=4 22770 B13R1.2872 O=C(CF)Cc1cc(ccc1Br)F 1458a_100000690878_100015361967 [0,3,0,0,0,0|1,0,0]=4 22771 B13R1.2872 O=C(CF)Cc1cc(ccc1Cl)Br 1458a_100011600618_100015361967 [0,3,0,0,0,0|1,0,0]=4 22772 B13R1.2872 O=C(CF)Cc1cc(ccc1Cl)Cl 1458a_100000748246_100015361967 [0,3,0,0,0,0|1,0,0]=4 22773 B13R1.2872 O=C(CF)Cc1cc(ccc1Cl)F 1458a_100011830335_100015361967 [0,3,0,0,0,0|1,0,0]=4 22774 B13R1.2872 O=C(CF)Cc1cc(ccc1F)Br 1458a_100000690877_100015361967 [0,3,0,0,0,0|1,0,0]=4 22775 B13R1.2872 O=C(CF)Cc1cc(ccc1F)Cl 1458a_100011217548_100015361967 [0,3,0,0,0,0|1,0,0]=4 22776 B13R1.2872 O=C(CF)Cc1cc(ccc1F)F 1458a_100000762760_100015361967 [0,3,0,0,0,0|1,0,0]=4 22777 B13R1.2872 O=C(CF)Cc1cc(ccc1O)Br 1458a_100010072483_100015361967 [0,3,0,0,0,0|1,0,0]=4 22778 B13R1.2872 O=C(CF)Cc1cc(ccc1O)O 1458a_100000038496_100015361967 [0,3,0,0,0,0|1,0,0]=4 22779 B13R1.2872 O=C(CO)Cc1cc(ccc1Br)Br 1458a_100000210174_100011982794 [0,3,0,0,0,0|1,0,0]=4 22780 B13R1.2872 O=C(CO)Cc1cc(ccc1Br)Cl 1458a_100000210174_100000733903 [0,3,0,0,0,0|1,0,0]=4 22781 B13R1.2872 O=C(CO)Cc1cc(ccc1Br)F 1458a_100000210174_100000736370 [0,3,0,0,0,0|1,0,0]=4 22782 B13R1.2872 O=C(CO)Cc1cc(ccc1Br)I 1458a_100000210174_100012355412 [0,3,0,0,0,0|1,0,0]=4 22783 B13R1.2872 O=C(CO)Cc1cc(ccc1Cl)Br 1458a_100000210174_100000763347 [0,3,0,0,0,0|1,0,0]=4 22784 B13R1.2872 O=C(CO)Cc1cc(ccc1Cl)Cl 1458a_100000210174_100000754809 [0,3,0,0,0,0|1,0,0]=4 22785 B13R1.2872 O=C(CO)Cc1cc(ccc1Cl)F 1458a_100000210174_100000709952 [0,3,0,0,0,0|1,0,0]=4 22786 B13R1.2872 O=C(CO)Cc1cc(ccc1Cl)I 1458a_100000210174_100010188191 [0,3,0,0,0,0|1,0,0]=4 22787 B13R1.2872 O=C(CO)Cc1cc(ccc1F)Br 1458a_100000210174_100000736399 [0,3,0,0,0,0|1,0,0]=4 22788 B13R1.2872 O=C(CO)Cc1cc(ccc1F)Cl 1458a_100000210174_100000716957 [0,3,0,0,0,0|1,0,0]=4 22789 B13R1.2872 O=C(CO)Cc1cc(ccc1F)F 1458a_100000210174_100000741279 [0,3,0,0,0,0|1,0,0]=4 22790 B13R1.2872 O=C(CO)Cc1cc(ccc1F)I 1458a_100000210174_200010149601 [0,3,0,0,0,0|1,0,0]=4 22791 B13R1.2872 O=C(CO)Cc1cc(ccc1I)Br 1458a_100000210174_100012362523 [0,3,0,0,0,0|1,0,0]=4 22792 B13R1.2872 O=C(CO)Cc1cc(ccc1I)Cl 1458a_100000210174_100012348826 [0,3,0,0,0,0|1,0,0]=4 22793 B13R1.2872 O=C(CO)Cc1cc(ccc1I)F 1458a_100000210174_100010149606 [0,3,0,0,0,0|1,0,0]=4 22794 B13R1.2872 O=C(CO)Cc1cc(ccc1O)F 1458a_100000210174_100010161318 [0,3,0,0,0,0|1,0,0]=4 22795 B13R1.2874 C=CC(=O)Cc1cc(cc(c1)Br)Br 1458a_100000185746_100011216082 [0,3,0,0,0,0|1,0,0]=4 22796 B13R1.2874 C=CC(=O)Cc1cc(cc(c1)Br)C 1458a_100000185746_100012348363 [0,3,0,0,0,0|1,0,0]=4 22797 B13R1.2874 C=CC(=O)Cc1cc(cc(c1)Br)F 1458a_100000185746_100000766940 [0,3,0,0,0,0|1,0,0]=4 22798 B13R1.2874 C=CC(=O)Cc1cc(cc(c1)C)C 1458a_100000185746_100000181317 [0,3,0,0,0,0|1,0,0]=4 22799 B13R1.2874 C=CC(=O)Cc1cc(cc(c1)Cl)Cl 1458a_100000185746_100011219208 [0,3,0,0,0,0|1,0,0]=4 22800 B13R1.2874 C=CC(=O)Cc1cc(cc(c1)Cl)F 1458a_100000185746_100011219885 [0,3,0,0,0,0|1,0,0]=4 22801 B13R1.2874 C=CC(=O)Cc1cc(cc(c1)F)C 1458a_100000185746_100011219130 [0,3,0,0,0,0|1,0,0]=4 22802 B13R1.2874 C=CC(=O)Cc1cc(cc(c1)F)F 1458a_100000185746_100000697002 [0,3,0,0,0,0|1,0,0]=4 22803 B13R1.2874 C=CC(=O)Cc1cc(cc(c1)I)Br 1458a_100000185746_100010146614 [0,3,0,0,0,0|1,0,0]=4 22804 B13R1.2874 C=CC(=O)Cc1cc(cc(c1)I)F 1458a_100000185746_100010149605 [0,3,0,0,0,0|1,0,0]=4 22805 B13R1.2874 CCC(=O)Cc1cc(cc(c1)Br)Br 1458a_100000210414_100011216082 [0,3,0,0,0,0|1,0,0]=4 22806 B13R1.2874 CCC(=O)Cc1cc(cc(c1)Br)Br 1458a_100010186705_100000210202 [0,3,0,0,0,0|1,0,0]=4 22807 B13R1.2874 CCC(=O)Cc1cc(cc(c1)Br)C 1458a_100000210414_100012348363 [0,3,0,0,0,0|1,0,0]=4 22808 B13R1.2874 CCC(=O)Cc1cc(cc(c1)Br)F 1458a_100000210414_100000766940 [0,3,0,0,0,0|1,0,0]=4 22809 B13R1.2874 CCC(=O)Cc1cc(cc(c1)Br)F 1458a_100011935118_100000210202 [0,3,0,0,0,0|1,0,0]=4 22810 B13R1.2874 CCC(=O)Cc1cc(cc(c1)C)C 1458a_100000210414_100000181317 [0,3,0,0,0,0|1,0,0]=4 22811 B13R1.2874 CCC(=O)Cc1cc(cc(c1)C)C 1458a_100011202310_100000210202 [0,3,0,0,0,0|1,0,0]=4 22812 B13R1.2874 CCC(=O)Cc1cc(cc(c1)Cl)Cl 1458a_100000210414_100011219208 [0,3,0,0,0,0|1,0,0]=4 22813 B13R1.2874 CCC(=O)Cc1cc(cc(c1)Cl)Cl 1458a_100012340057_100000210202 [0,3,0,0,0,0|1,0,0]=4 22814 B13R1.2874 CCC(=O)Cc1cc(cc(c1)Cl)F 1458a_100000210414_100011219885 [0,3,0,0,0,0|1,0,0]=4 22815 B13R1.2874 CCC(=O)Cc1cc(cc(c1)Cl)F 1458a_100011217690_100000210202 [0,3,0,0,0,0|1,0,0]=4 22816 B13R1.2874 CCC(=O)Cc1cc(cc(c1)F)C 1458a_100000210414_100011219130 [0,3,0,0,0,0|1,0,0]=4 22817 B13R1.2874 CCC(=O)Cc1cc(cc(c1)F)C 1458a_100011216671_100000210202 [0,3,0,0,0,0|1,0,0]=4 22818 B13R1.2874 CCC(=O)Cc1cc(cc(c1)F)F 1458a_100000210414_100000697002 [0,3,0,0,0,0|1,0,0]=4 22819 B13R1.2874 CCC(=O)Cc1cc(cc(c1)F)F 1458a_100011220011_100000210202 [0,3,0,0,0,0|1,0,0]=4 22820 B13R1.2874 CCC(=O)Cc1cc(cc(c1)I)Br 1458a_100000210414_100010146614 [0,3,0,0,0,0|1,0,0]=4 22821 B13R1.2874 CCC(=O)Cc1cc(cc(c1)I)F 1458a_100000210414_100010149605 [0,3,0,0,0,0|1,0,0]=4 22822 B13R1.2874 CNC(=O)Cc1cc(cc(c1)Br)Br 11a_106832991635_100010186705 [0,3,0,0,0,0|1,0,0]=4 22823 B13R1.2874 CNC(=O)Cc1cc(cc(c1)Br)Br 240690a_100102657272_100010186705 [0,3,0,0,0,0|1,0,0]=4 22824 B13R1.2874 CNC(=O)Cc1cc(cc(c1)Br)Br 527a_100102657272_100010186705 [0,3,0,0,0,0|1,0,0]=4 22825 B13R1.2874 CNC(=O)Cc1cc(cc(c1)Br)F 11a_106832991635_100011935118 [0,3,0,0,0,0|1,0,0]=4 22826 B13R1.2874 CNC(=O)Cc1cc(cc(c1)Br)F 240690a_100102657272_100011935118 [0,3,0,0,0,0|1,0,0]=4 22827 B13R1.2874 CNC(=O)Cc1cc(cc(c1)Br)F 527a_100102657272_100011935118 [0,3,0,0,0,0|1,0,0]=4 22828 B13R1.2874 CNC(=O)Cc1cc(cc(c1)C)C 11a_106832991635_100011202310 [0,3,0,0,0,0|1,0,0]=4 22829 B13R1.2874 CNC(=O)Cc1cc(cc(c1)C)C 240690a_100102657272_100011202310 [0,3,0,0,0,0|1,0,0]=4 22830 B13R1.2874 CNC(=O)Cc1cc(cc(c1)C)C 527a_100102657272_100011202310 [0,3,0,0,0,0|1,0,0]=4 22831 B13R1.2874 CNC(=O)Cc1cc(cc(c1)Cl)Cl 11a_106832991635_100012340057 [0,3,0,0,0,0|1,0,0]=4 22832 B13R1.2874 CNC(=O)Cc1cc(cc(c1)Cl)Cl 1626a_100102657272_100012340057 [0,3,0,0,0,0|1,0,0]=4 22833 B13R1.2874 CNC(=O)Cc1cc(cc(c1)Cl)Cl 240690a_100102657272_100012340057 [0,3,0,0,0,0|1,0,0]=4 22834 B13R1.2874 CNC(=O)Cc1cc(cc(c1)Cl)Cl 527a_100102657272_100012340057 [0,3,0,0,0,0|1,0,0]=4 22835 B13R1.2874 CNC(=O)Cc1cc(cc(c1)Cl)F 11a_106832991635_100011217690 [0,3,0,0,0,0|1,0,0]=4 22836 B13R1.2874 CNC(=O)Cc1cc(cc(c1)Cl)F 1626a_100102657272_100011217690 [0,3,0,0,0,0|1,0,0]=4 22837 B13R1.2874 CNC(=O)Cc1cc(cc(c1)Cl)F 240690a_100102657272_100011217690 [0,3,0,0,0,0|1,0,0]=4 22838 B13R1.2874 CNC(=O)Cc1cc(cc(c1)Cl)F 527a_100102657272_100011217690 [0,3,0,0,0,0|1,0,0]=4 22839 B13R1.2874 CNC(=O)Cc1cc(cc(c1)F)C 11a_106832991635_100011216671 [0,3,0,0,0,0|1,0,0]=4 22840 B13R1.2874 CNC(=O)Cc1cc(cc(c1)F)C 1626a_100102657272_100011216671 [0,3,0,0,0,0|1,0,0]=4 22841 B13R1.2874 CNC(=O)Cc1cc(cc(c1)F)C 240690a_100102657272_100011216671 [0,3,0,0,0,0|1,0,0]=4 22842 B13R1.2874 CNC(=O)Cc1cc(cc(c1)F)C 527a_100102657272_100011216671 [0,3,0,0,0,0|1,0,0]=4 22843 B13R1.2874 CNC(=O)Cc1cc(cc(c1)F)F 11a_106832991635_100011220011 [0,3,0,0,0,0|1,0,0]=4 22844 B13R1.2874 CNC(=O)Cc1cc(cc(c1)F)F 1626a_100102657272_100011220011 [0,3,0,0,0,0|1,0,0]=4 22845 B13R1.2874 CNC(=O)Cc1cc(cc(c1)F)F 240690a_100102657272_100011220011 [0,3,0,0,0,0|1,0,0]=4 22846 B13R1.2874 CNC(=O)Cc1cc(cc(c1)F)F 527a_100102657272_100011220011 [0,3,0,0,0,0|1,0,0]=4 22847 B13R1.2874 CNC(=O)Cc1cc(cc(c1)O)O 240690a_100102657272_100000080560 [0,3,0,0,0,0|1,0,0]=4 22848 B13R1.2874 CNC(=O)Cc1cc(cc(c1)O)O 527a_100102657272_100000080560 [0,3,0,0,0,0|1,0,0]=4 22849 B13R1.2874 COC(=O)Cc1cc(cc(c1)F)O 271570a_203496583355_100012569085 [0,3,0,0,0,0|1,0,0]=4 22850 B13R1.2874 Cc1cc(cc(c1)CC(=O)CF)C 1458a_100011202310_100015361967 [0,3,0,0,0,0|1,0,0]=4 22851 B13R1.2874 Cc1cc(cc(c1)CC(=O)CF)F 1458a_100011216671_100015361967 [0,3,0,0,0,0|1,0,0]=4 22852 B13R1.2874 Cc1cc(cc(c1)CC(=O)CO)Br 1458a_100000210174_100012348363 [0,3,0,0,0,0|1,0,0]=4 22853 B13R1.2874 Cc1cc(cc(c1)CC(=O)CO)C 1458a_100000210174_100000181317 [0,3,0,0,0,0|1,0,0]=4 22854 B13R1.2874 Cc1cc(cc(c1)CC(=O)CO)F 1458a_100000210174_100011219130 [0,3,0,0,0,0|1,0,0]=4 22855 B13R1.2874 O=C(CF)Cc1cc(cc(c1)Br)Br 1458a_100010186705_100015361967 [0,3,0,0,0,0|1,0,0]=4 22856 B13R1.2874 O=C(CF)Cc1cc(cc(c1)Br)F 1458a_100011935118_100015361967 [0,3,0,0,0,0|1,0,0]=4 22857 B13R1.2874 O=C(CF)Cc1cc(cc(c1)Cl)Cl 1458a_100012340057_100015361967 [0,3,0,0,0,0|1,0,0]=4 22858 B13R1.2874 O=C(CF)Cc1cc(cc(c1)Cl)F 1458a_100011217690_100015361967 [0,3,0,0,0,0|1,0,0]=4 22859 B13R1.2874 O=C(CF)Cc1cc(cc(c1)F)F 1458a_100011220011_100015361967 [0,3,0,0,0,0|1,0,0]=4 22860 B13R1.2874 O=C(CO)Cc1cc(cc(c1)Br)Br 1458a_100000210174_100011216082 [0,3,0,0,0,0|1,0,0]=4 22861 B13R1.2874 O=C(CO)Cc1cc(cc(c1)Br)F 1458a_100000210174_100000766940 [0,3,0,0,0,0|1,0,0]=4 22862 B13R1.2874 O=C(CO)Cc1cc(cc(c1)Cl)Cl 1458a_100000210174_100011219208 [0,3,0,0,0,0|1,0,0]=4 22863 B13R1.2874 O=C(CO)Cc1cc(cc(c1)Cl)F 1458a_100000210174_100011219885 [0,3,0,0,0,0|1,0,0]=4 22864 B13R1.2874 O=C(CO)Cc1cc(cc(c1)F)F 1458a_100000210174_100000697002 [0,3,0,0,0,0|1,0,0]=4 22865 B13R1.2874 O=C(CO)Cc1cc(cc(c1)I)Br 1458a_100000210174_100010146614 [0,3,0,0,0,0|1,0,0]=4 22866 B13R1.2874 O=C(CO)Cc1cc(cc(c1)I)F 1458a_100000210174_100010149605 [0,3,0,0,0,0|1,0,0]=4 22867 B13R1.91 C=CC(=O)Cc1ccccc1C#N 1458a_100000185746_100000181865 [0,3,0,0,0,0|1,0,0]=4 22868 B13R1.91 C=CC(=O)Cc1ccccc1C=O 1458a_100000185746_200009853537 [0,3,0,0,0,0|1,0,0]=4 22869 B13R1.91 C=CC(=O)Cc1ccccc1CO 1458a_100000185746_100009816955 [0,3,0,0,0,0|1,0,0]=4 22870 B13R1.91 C=CC(=O)Cc1ccccc1OC 1458a_100000185746_100000210004 [0,3,0,0,0,0|1,0,0]=4 22871 B13R1.91 C=CC(=O)Cc1ccccc1SC 1458a_100000185746_100000699184 [0,3,0,0,0,0|1,0,0]=4 22872 B13R1.91 C=Cc1ccccc1CC(=O)NC 271570a_100011290941_200009816160 [0,3,0,0,0,0|1,0,0]=4 22873 B13R1.91 C=Cc1ccccc1CC(=O)OC 271570a_100011290941_100000699816 [0,3,0,0,0,0|1,0,0]=4 22874 B13R1.91 CCC(=O)Cc1ccccc1C#N 1458a_100000210414_100000181865 [0,3,0,0,0,0|1,0,0]=4 22875 B13R1.91 CCC(=O)Cc1ccccc1C#N 1458a_100000238613_100000210202 [0,3,0,0,0,0|1,0,0]=4 22876 B13R1.91 CCC(=O)Cc1ccccc1C=O 1458a_100000210414_200009853537 [0,3,0,0,0,0|1,0,0]=4 22877 B13R1.91 CCC(=O)Cc1ccccc1CO 1458a_100000210414_100009816955 [0,3,0,0,0,0|1,0,0]=4 22878 B13R1.91 CCC(=O)Cc1ccccc1OC 1458a_100000210414_100000210004 [0,3,0,0,0,0|1,0,0]=4 22879 B13R1.91 CCC(=O)Cc1ccccc1OC 1458a_100000211604_100000210202 [0,3,0,0,0,0|1,0,0]=4 22880 B13R1.91 CCC(=O)Cc1ccccc1SC 1458a_100000210414_100000699184 [0,3,0,0,0,0|1,0,0]=4 22881 B13R1.91 CNC(=O)Cc1ccccc1C#N 11a_106832991635_100000238613 [0,3,0,0,0,0|1,0,0]=4 22882 B13R1.91 CNC(=O)Cc1ccccc1C#N 527a_100102657272_100000238613 [0,3,0,0,0,0|1,0,0]=4 22883 B13R1.91 CNC(=O)Cc1ccccc1NC 2230a_100000738506_200000210301 [0,3,0,0,0,0|1,0,0]=4 22884 B13R1.91 CNC(=O)Cc1ccccc1NC 34a_100000738506_200000210301 [0,3,0,0,0,0|1,0,0]=4 22885 B13R1.91 CNC(=O)Cc1ccccc1N[13CH3] 2230a_100000738506_200025704644 [0,3,0,0,0,0|1,0,0]=4 22886 B13R1.91 CNC(=O)Cc1ccccc1N[13CH3] 34a_100000738506_200025704644 [0,3,0,0,0,0|1,0,0]=4 22887 B13R1.91 CNC(=O)Cc1ccccc1OC 11a_106832991635_100000211604 [0,3,0,0,0,0|1,0,0]=4 22888 B13R1.91 CNC(=O)Cc1ccccc1OC 1626a_100102657272_100000211604 [0,3,0,0,0,0|1,0,0]=4 22889 B13R1.91 CNC(=O)Cc1ccccc1OC 240690a_100102657272_100000211604 [0,3,0,0,0,0|1,0,0]=4 22890 B13R1.91 CNC(=O)Cc1ccccc1OC 527a_100102657272_100000211604 [0,3,0,0,0,0|1,0,0]=4 22891 B13R1.91 CNC(=O)Cc1ccccc1SC 62a_200000210301_200009816160 [0,3,0,0,0,0|1,0,0]=4 22892 B13R1.91 CNC(=O)Cc1ccccc1SC 62a_200009816160_200000210301 [0,3,0,0,0,0|1,0,0]=4 22893 B13R1.91 CNC(=O)Cc1ccccc1S[13CH3] 62a_200009816160_200025704644 [0,3,0,0,0,0|1,0,0]=4 22894 B13R1.91 CNC(=O)Cc1ccccc1S[13CH3] 62a_200025704644_200009816160 [0,3,0,0,0,0|1,0,0]=4 22895 B13R1.91 COC(=O)Cc1ccccc1OC 7a_100000758901_200000210301 [0,3,0,0,0,0|1,0,0]=4 22896 B13R1.91 COC(=O)Cc1ccccc1O[13CH3] 7a_100000758901_200025704644 [0,3,0,0,0,0|1,0,0]=4 22897 B13R1.91 COC(=O)Cc1ccccc1SC 62a_100000699816_200000210301 [0,3,0,0,0,0|1,0,0]=4 22898 B13R1.91 COC(=O)Cc1ccccc1SC 62a_200000210301_100000699816 [0,3,0,0,0,0|1,0,0]=4 22899 B13R1.91 COC(=O)Cc1ccccc1S[13CH3] 62a_100000699816_200025704644 [0,3,0,0,0,0|1,0,0]=4 22900 B13R1.91 COC(=O)Cc1ccccc1S[13CH3] 62a_200025704644_100000699816 [0,3,0,0,0,0|1,0,0]=4 22901 B13R1.91 COc1ccccc1CC(=O)CF 1458a_100000211604_100015361967 [0,3,0,0,0,0|1,0,0]=4 22902 B13R1.91 COc1ccccc1CC(=O)CO 1458a_100000210174_100000210004 [0,3,0,0,0,0|1,0,0]=4 22903 B13R1.91 CSc1ccccc1CC(=O)CO 1458a_100000210174_100000699184 [0,3,0,0,0,0|1,0,0]=4 22904 B13R1.91 N#Cc1ccccc1CC(=O)CF 1458a_100000238613_100015361967 [0,3,0,0,0,0|1,0,0]=4 22905 B13R1.91 N#Cc1ccccc1CC(=O)CO 1458a_100000210174_100000181865 [0,3,0,0,0,0|1,0,0]=4 22906 B13R1.91 O=C(CO)Cc1ccccc1CO 1458a_100000210174_100009816955 [0,3,0,0,0,0|1,0,0]=4 22907 B13R1.91 O=Cc1ccccc1CC(=O)CO 1458a_100000210174_200009853537 [0,3,0,0,0,0|1,0,0]=4 22908 B13R1.4928 C=CC(=O)Cc1c(cccc1Br)C 1458a_100000185746_100010146847 [0,3,0,0,0,0|1,0,0]=4 22909 B13R1.4928 C=CC(=O)Cc1c(cccc1Br)Cl 1458a_100000185746_100010138402 [0,3,0,0,0,0|1,0,0]=4 22910 B13R1.4928 C=CC(=O)Cc1c(cccc1Br)F 1458a_100000185746_100000696636 [0,3,0,0,0,0|1,0,0]=4 22911 B13R1.4928 C=CC(=O)Cc1c(cccc1C)C 1458a_100000185746_100000758300 [0,3,0,0,0,0|1,0,0]=4 22912 B13R1.4928 C=CC(=O)Cc1c(cccc1Cl)Cl 1458a_100000185746_100000187851 [0,3,0,0,0,0|1,0,0]=4 22913 B13R1.4928 C=CC(=O)Cc1c(cccc1Cl)F 1458a_100000185746_100000187852 [0,3,0,0,0,0|1,0,0]=4 22914 B13R1.4928 C=CC(=O)Cc1c(cccc1F)C 1458a_100000185746_100009814554 [0,3,0,0,0,0|1,0,0]=4 22915 B13R1.4928 C=CC(=O)Cc1c(cccc1F)F 1458a_100000185746_100000698325 [0,3,0,0,0,0|1,0,0]=4 22916 B13R1.4928 C=CC(=O)Cc1c(cccc1I)Br 1458a_100000185746_100010146611 [0,3,0,0,0,0|1,0,0]=4 22917 B13R1.4928 C=CC(=O)Cc1c(cccc1I)C 1458a_100000185746_100010150146 [0,3,0,0,0,0|1,0,0]=4 22918 B13R1.4928 C=CC(=O)Cc1c(cccc1I)F 1458a_100000185746_100010149602 [0,3,0,0,0,0|1,0,0]=4 22919 B13R1.4928 CCC(=O)Cc1c(cccc1Br)Br 1458a_100010209379_100000210202 [0,3,0,0,0,0|1,0,0]=4 22920 B13R1.4928 CCC(=O)Cc1c(cccc1Br)C 1458a_100000210414_100010146847 [0,3,0,0,0,0|1,0,0]=4 22921 B13R1.4928 CCC(=O)Cc1c(cccc1Br)C 1458a_100010147022_100000210202 [0,3,0,0,0,0|1,0,0]=4 22922 B13R1.4928 CCC(=O)Cc1c(cccc1Br)Cl 1458a_100000210414_100010138402 [0,3,0,0,0,0|1,0,0]=4 22923 B13R1.4928 CCC(=O)Cc1c(cccc1Br)Cl 1458a_100013084675_100000210202 [0,3,0,0,0,0|1,0,0]=4 22924 B13R1.4928 CCC(=O)Cc1c(cccc1Br)F 1458a_100000210414_100000696636 [0,3,0,0,0,0|1,0,0]=4 22925 B13R1.4928 CCC(=O)Cc1c(cccc1Br)F 1458a_100010172741_100000210202 [0,3,0,0,0,0|1,0,0]=4 22926 B13R1.4928 CCC(=O)Cc1c(cccc1C)C 1458a_100000210414_100000758300 [0,3,0,0,0,0|1,0,0]=4 22927 B13R1.4928 CCC(=O)Cc1c(cccc1C)C 1458a_100000689862_100000210202 [0,3,0,0,0,0|1,0,0]=4 22928 B13R1.4928 CCC(=O)Cc1c(cccc1Cl)Cl 1458a_100000210414_100000187851 [0,3,0,0,0,0|1,0,0]=4 22929 B13R1.4928 CCC(=O)Cc1c(cccc1Cl)Cl 1458a_100000211232_100000210202 [0,3,0,0,0,0|1,0,0]=4 22930 B13R1.4928 CCC(=O)Cc1c(cccc1Cl)F 1458a_100000185183_100000210202 [0,3,0,0,0,0|1,0,0]=4 22931 B13R1.4928 CCC(=O)Cc1c(cccc1Cl)F 1458a_100000210414_100000187852 [0,3,0,0,0,0|1,0,0]=4 22932 B13R1.4928 CCC(=O)Cc1c(cccc1F)C 1458a_100000210414_100009814554 [0,3,0,0,0,0|1,0,0]=4 22933 B13R1.4928 CCC(=O)Cc1c(cccc1F)F 1458a_100000210414_100000698325 [0,3,0,0,0,0|1,0,0]=4 22934 B13R1.4928 CCC(=O)Cc1c(cccc1F)F 1458a_100000684726_100000210202 [0,3,0,0,0,0|1,0,0]=4 22935 B13R1.4928 CCC(=O)Cc1c(cccc1I)Br 1458a_100000210414_100010146611 [0,3,0,0,0,0|1,0,0]=4 22936 B13R1.4928 CCC(=O)Cc1c(cccc1I)C 1458a_100000210414_100010150146 [0,3,0,0,0,0|1,0,0]=4 22937 B13R1.4928 CCC(=O)Cc1c(cccc1I)F 1458a_100000210414_100010149602 [0,3,0,0,0,0|1,0,0]=4 22938 B13R1.4928 CNC(=O)Cc1c(cccc1Br)Br 11a_106832991635_100010209379 [0,3,0,0,0,0|1,0,0]=4 22939 B13R1.4928 CNC(=O)Cc1c(cccc1Br)Br 240690a_100102657272_100010209379 [0,3,0,0,0,0|1,0,0]=4 22940 B13R1.4928 CNC(=O)Cc1c(cccc1Br)Br 527a_100102657272_100010209379 [0,3,0,0,0,0|1,0,0]=4 22941 B13R1.4928 CNC(=O)Cc1c(cccc1Br)C 11a_106832991635_100010147022 [0,3,0,0,0,0|1,0,0]=4 22942 B13R1.4928 CNC(=O)Cc1c(cccc1Br)C 1626a_100102657272_100010147022 [0,3,0,0,0,0|1,0,0]=4 22943 B13R1.4928 CNC(=O)Cc1c(cccc1Br)C 240690a_100102657272_100010147022 [0,3,0,0,0,0|1,0,0]=4 22944 B13R1.4928 CNC(=O)Cc1c(cccc1Br)C 527a_100102657272_100010147022 [0,3,0,0,0,0|1,0,0]=4 22945 B13R1.4928 CNC(=O)Cc1c(cccc1Br)Cl 11a_106832991635_100013084675 [0,3,0,0,0,0|1,0,0]=4 22946 B13R1.4928 CNC(=O)Cc1c(cccc1Br)Cl 1626a_100102657272_100013084675 [0,3,0,0,0,0|1,0,0]=4 22947 B13R1.4928 CNC(=O)Cc1c(cccc1Br)Cl 240690a_100102657272_100013084675 [0,3,0,0,0,0|1,0,0]=4 22948 B13R1.4928 CNC(=O)Cc1c(cccc1Br)Cl 527a_100102657272_100013084675 [0,3,0,0,0,0|1,0,0]=4 22949 B13R1.4928 CNC(=O)Cc1c(cccc1Br)F 11a_106832991635_100010172741 [0,3,0,0,0,0|1,0,0]=4 22950 B13R1.4928 CNC(=O)Cc1c(cccc1Br)F 1626a_100102657272_100010172741 [0,3,0,0,0,0|1,0,0]=4 22951 B13R1.4928 CNC(=O)Cc1c(cccc1Br)F 240690a_100102657272_100010172741 [0,3,0,0,0,0|1,0,0]=4 22952 B13R1.4928 CNC(=O)Cc1c(cccc1Br)F 527a_100102657272_100010172741 [0,3,0,0,0,0|1,0,0]=4 22953 B13R1.4928 CNC(=O)Cc1c(cccc1C)C 11a_106832991635_100000689862 [0,3,0,0,0,0|1,0,0]=4 22954 B13R1.4928 CNC(=O)Cc1c(cccc1C)C 1626a_100102657272_100000689862 [0,3,0,0,0,0|1,0,0]=4 22955 B13R1.4928 CNC(=O)Cc1c(cccc1C)C 240690a_100102657272_100000689862 [0,3,0,0,0,0|1,0,0]=4 22956 B13R1.4928 CNC(=O)Cc1c(cccc1C)C 527a_100102657272_100000689862 [0,3,0,0,0,0|1,0,0]=4 22957 B13R1.4928 CNC(=O)Cc1c(cccc1Cl)Cl 11a_106832991635_100000211232 [0,3,0,0,0,0|1,0,0]=4 22958 B13R1.4928 CNC(=O)Cc1c(cccc1Cl)Cl 1626a_100102657272_100000211232 [0,3,0,0,0,0|1,0,0]=4 22959 B13R1.4928 CNC(=O)Cc1c(cccc1Cl)Cl 240690a_100102657272_100000211232 [0,3,0,0,0,0|1,0,0]=4 22960 B13R1.4928 CNC(=O)Cc1c(cccc1Cl)Cl 527a_100102657272_100000211232 [0,3,0,0,0,0|1,0,0]=4 22961 B13R1.4928 CNC(=O)Cc1c(cccc1Cl)F 11a_106832991635_100000185183 [0,3,0,0,0,0|1,0,0]=4 22962 B13R1.4928 CNC(=O)Cc1c(cccc1Cl)F 1626a_100102657272_100000185183 [0,3,0,0,0,0|1,0,0]=4 22963 B13R1.4928 CNC(=O)Cc1c(cccc1Cl)F 240690a_100102657272_100000185183 [0,3,0,0,0,0|1,0,0]=4 22964 B13R1.4928 CNC(=O)Cc1c(cccc1Cl)F 527a_100102657272_100000185183 [0,3,0,0,0,0|1,0,0]=4 22965 B13R1.4928 CNC(=O)Cc1c(cccc1F)F 11a_106832991635_100000684726 [0,3,0,0,0,0|1,0,0]=4 22966 B13R1.4928 CNC(=O)Cc1c(cccc1F)F 1626a_100102657272_100000684726 [0,3,0,0,0,0|1,0,0]=4 22967 B13R1.4928 CNC(=O)Cc1c(cccc1F)F 240690a_100102657272_100000684726 [0,3,0,0,0,0|1,0,0]=4 22968 B13R1.4928 CNC(=O)Cc1c(cccc1F)F 527a_100102657272_100000684726 [0,3,0,0,0,0|1,0,0]=4 22969 B13R1.4928 COC(=O)Cc1c(cccc1F)O 271570a_203496583355_100010741561 [0,3,0,0,0,0|1,0,0]=4 22970 B13R1.4928 Cc1cccc(c1CC(=O)CF)Br 1458a_100010147022_100015361967 [0,3,0,0,0,0|1,0,0]=4 22971 B13R1.4928 Cc1cccc(c1CC(=O)CF)C 1458a_100000689862_100015361967 [0,3,0,0,0,0|1,0,0]=4 22972 B13R1.4928 Cc1cccc(c1CC(=O)CO)Br 1458a_100000210174_100010146847 [0,3,0,0,0,0|1,0,0]=4 22973 B13R1.4928 Cc1cccc(c1CC(=O)CO)C 1458a_100000210174_100000758300 [0,3,0,0,0,0|1,0,0]=4 22974 B13R1.4928 Cc1cccc(c1CC(=O)CO)F 1458a_100000210174_100009814554 [0,3,0,0,0,0|1,0,0]=4 22975 B13R1.4928 Cc1cccc(c1CC(=O)CO)I 1458a_100000210174_100010150146 [0,3,0,0,0,0|1,0,0]=4 22976 B13R1.4928 O=C(CF)Cc1c(cccc1Br)Br 1458a_100010209379_100015361967 [0,3,0,0,0,0|1,0,0]=4 22977 B13R1.4928 O=C(CF)Cc1c(cccc1Br)Cl 1458a_100013084675_100015361967 [0,3,0,0,0,0|1,0,0]=4 22978 B13R1.4928 O=C(CF)Cc1c(cccc1Br)F 1458a_100010172741_100015361967 [0,3,0,0,0,0|1,0,0]=4 22979 B13R1.4928 O=C(CF)Cc1c(cccc1Cl)Cl 1458a_100000211232_100015361967 [0,3,0,0,0,0|1,0,0]=4 22980 B13R1.4928 O=C(CF)Cc1c(cccc1Cl)F 1458a_100000185183_100015361967 [0,3,0,0,0,0|1,0,0]=4 22981 B13R1.4928 O=C(CF)Cc1c(cccc1F)F 1458a_100000684726_100015361967 [0,3,0,0,0,0|1,0,0]=4 22982 B13R1.4928 O=C(CO)Cc1c(cccc1Br)Cl 1458a_100000210174_100010138402 [0,3,0,0,0,0|1,0,0]=4 22983 B13R1.4928 O=C(CO)Cc1c(cccc1Br)F 1458a_100000210174_100000696636 [0,3,0,0,0,0|1,0,0]=4 22984 B13R1.4928 O=C(CO)Cc1c(cccc1Cl)Cl 1458a_100000210174_100000187851 [0,3,0,0,0,0|1,0,0]=4 22985 B13R1.4928 O=C(CO)Cc1c(cccc1Cl)F 1458a_100000210174_100000187852 [0,3,0,0,0,0|1,0,0]=4 22986 B13R1.4928 O=C(CO)Cc1c(cccc1F)F 1458a_100000210174_100000698325 [0,3,0,0,0,0|1,0,0]=4 22987 B13R1.4928 O=C(CO)Cc1c(cccc1I)Br 1458a_100000210174_100010146611 [0,3,0,0,0,0|1,0,0]=4 22988 B13R1.4928 O=C(CO)Cc1c(cccc1I)F 1458a_100000210174_100010149602 [0,3,0,0,0,0|1,0,0]=4 22989 B13R1.115 CC(=O)Cc1cccc(c1C#N)Br 1458a_100000070787_200010145453 [0,3,0,0,0,0|1,0,0]=4 22990 B13R1.115 CC(=O)Cc1cccc(c1C#N)F 1458a_100000070787_100000707650 [0,3,0,0,0,0|1,0,0]=4 22991 B13R1.115 COc1c(cccc1CC(=O)C)Br 1458a_100000070787_100011470457 [0,3,0,0,0,0|1,0,0]=4 22992 B13R1.115 COc1c(cccc1CC(=O)C)C 1458a_100000070787_100012349798 [0,3,0,0,0,0|1,0,0]=4 22993 B13R1.115 COc1c(cccc1CC(=O)C)F 1458a_100000061543_200000210301 [0,3,0,0,0,0|1,0,0]=4 22994 B13R1.115 COc1c(cccc1CC(=O)[13CH3])F 1458a_100000061543_200025704644 [0,3,0,0,0,0|1,0,0]=4 22995 B13R1.380 C=C=Cc1ccccc1CC(=O)C 271570a_100015277604_100011350739 [0,3,0,0,0,0|1,0,0]=4 22996 B13R1.380 CC(=O)Cc1ccccc1CC#N 1458a_100000070787_100010402002 [0,3,0,0,0,0|1,0,0]=4 22997 B13R1.380 CC(=O)Cc1ccccc1SCF 62a_100011350739_100015361967 [0,3,0,0,0,0|1,0,0]=4 22998 B13R1.380 CC(=O)Cc1ccccc1SCF 62a_100015361967_100011350739 [0,3,0,0,0,0|1,0,0]=4 22999 B13R1.380 CC=Cc1ccccc1CC(=O)C 271570a_100016259895_100011350739 [0,3,0,0,0,0|1,0,0]=4 23000 B13R1.380 CCOc1ccccc1CC(=O)C 1458a_100011247627_200000210301 [0,3,0,0,0,0|1,0,0]=4 23001 B13R1.380 CCOc1ccccc1CC(=O)[13CH3] 1458a_100011247627_200025704644 [0,3,0,0,0,0|1,0,0]=4 23002 B13R1.380 CCSc1ccccc1CC(=O)C 62a_100000210202_100011350739 [0,3,0,0,0,0|1,0,0]=4 23003 B13R1.380 CCSc1ccccc1CC(=O)C 62a_100011350739_100000210202 [0,3,0,0,0,0|1,0,0]=4 23004 B13R1.589 C=C(C)c1ccccc1CC(=O)C 271570a_100000694244_100011350739 [0,3,0,0,0,0|1,0,0]=4 23005 B13R1.589 CC(=O)Cc1ccccc1B(O)O 1458a_100000070787_100009814197 [0,3,0,0,0,0|1,0,0]=4 23006 B13R1.589 CC(=O)Cc1ccccc1[N+](=O)[O-] 1458a_100000070787_100000181388 [0,3,0,0,0,0|1,0,0]=4 23007 B13R1.589 CC(=O)Cc1ccccc1[N+](=O)[O-] 1458a_100000188737_200000210301 [0,3,0,0,0,0|1,0,0]=4 23008 B13R1.589 [13CH3]C(=O)Cc1ccccc1[N+](=O)[O-] 1458a_100000188737_200025704644 [0,3,0,0,0,0|1,0,0]=4 23009 B13R1.2135 CC(=O)Cc1c(cccc1C#N)Br 1458a_100000070787_100010145454 [0,3,0,0,0,0|1,0,0]=4 23010 B13R1.2135 CC(=O)Cc1c(cccc1C#N)Cl 1458a_100000070787_100010254528 [0,3,0,0,0,0|1,0,0]=4 23011 B13R1.2135 CC(=O)Cc1c(cccc1C#N)F 1458a_100000070787_100010254529 [0,3,0,0,0,0|1,0,0]=4 23012 B13R1.2135 CC(=O)Cc1c(cccc1C=O)F 1458a_100000070787_100010132767 [0,3,0,0,0,0|1,0,0]=4 23013 B13R1.2135 COc1cccc(c1CC(=O)C)Cl 1458a_100000070787_100012349678 [0,3,0,0,0,0|1,0,0]=4 23014 B13R1.2135 COc1cccc(c1CC(=O)C)F 1458a_100000070787_100011216731 [0,3,0,0,0,0|1,0,0]=4 23015 B13R1.2135 COc1cccc(c1CC(=O)C)F 1458a_100011216732_200000210301 [0,3,0,0,0,0|1,0,0]=4 23016 B13R1.2135 COc1cccc(c1CC(=O)[13CH3])F 1458a_100011216732_200025704644 [0,3,0,0,0,0|1,0,0]=4 23017 B13R1.3089 CC(=O)Cc1cc(ccc1C#N)Br 1458a_100000070787_100000718229 [0,3,0,0,0,0|1,0,0]=4 23018 B13R1.3089 CC(=O)Cc1cc(ccc1C#N)F 1458a_100000070787_100000759424 [0,3,0,0,0,0|1,0,0]=4 23019 B13R1.3089 CC(=O)Cc1cc(ccc1C=O)F 1458a_100000070787_100010132768 [0,3,0,0,0,0|1,0,0]=4 23020 B13R1.3089 CC(=O)Cc1cc(ccc1O[13CH3])Br 34a_200010006938_200025704644 [0,3,0,0,0,0|1,0,0]=4 23021 B13R1.3089 CC(=O)Cc1cc(ccc1O[13CH3])Br 7a_200010006938_200025704644 [0,3,0,0,0,0|1,0,0]=4 23022 B13R1.3089 COc1ccc(cc1CC(=O)C)Br 1458a_100000070787_100000204665 [0,3,0,0,0,0|1,0,0]=4 23023 B13R1.3089 COc1ccc(cc1CC(=O)C)Br 1458a_100000763194_200000210301 [0,3,0,0,0,0|1,0,0]=4 23024 B13R1.3089 COc1ccc(cc1CC(=O)C)Br 34a_200010006938_200000210301 [0,3,0,0,0,0|1,0,0]=4 23025 B13R1.3089 COc1ccc(cc1CC(=O)C)Br 7a_200010006938_200000210301 [0,3,0,0,0,0|1,0,0]=4 23026 B13R1.3089 COc1ccc(cc1CC(=O)C)C 1458a_100000070787_100000199068 [0,3,0,0,0,0|1,0,0]=4 23027 B13R1.3089 COc1ccc(cc1CC(=O)C)C 1458a_100000204598_200000210301 [0,3,0,0,0,0|1,0,0]=4 23028 B13R1.3089 COc1ccc(cc1CC(=O)C)Cl 1458a_100000070787_100000209806 [0,3,0,0,0,0|1,0,0]=4 23029 B13R1.3089 COc1ccc(cc1CC(=O)C)Cl 1458a_100000209874_200000210301 [0,3,0,0,0,0|1,0,0]=4 23030 B13R1.3089 COc1ccc(cc1CC(=O)C)F 1458a_100000070787_100011830354 [0,3,0,0,0,0|1,0,0]=4 23031 B13R1.3089 COc1ccc(cc1CC(=O)C)F 1458a_100000707523_200000210301 [0,3,0,0,0,0|1,0,0]=4 23032 B13R1.3089 COc1ccc(cc1CC(=O)C)O 271570a_203496583355_200011493461 [0,3,0,0,0,0|1,0,0]=4 23033 B13R1.3089 COc1ccc(cc1CC(=O)[13CH3])Br 1458a_100000763194_200025704644 [0,3,0,0,0,0|1,0,0]=4 23034 B13R1.3089 COc1ccc(cc1CC(=O)[13CH3])C 1458a_100000204598_200025704644 [0,3,0,0,0,0|1,0,0]=4 23035 B13R1.3089 COc1ccc(cc1CC(=O)[13CH3])Cl 1458a_100000209874_200025704644 [0,3,0,0,0,0|1,0,0]=4 23036 B13R1.3089 COc1ccc(cc1CC(=O)[13CH3])F 1458a_100000707523_200025704644 [0,3,0,0,0,0|1,0,0]=4 23037 B13R1.97 C=Cc1ccc(c(c1)CC(=O)C)O 271570a_100011290941_200010006938 [0,3,0,0,0,0|1,0,0]=4 23038 B13R1.97 CC(=O)Cc1cc(ccc1Br)C#N 1458a_100000070787_100012145668 [0,3,0,0,0,0|1,0,0]=4 23039 B13R1.97 CC(=O)Cc1cc(ccc1F)C#N 1458a_100000070787_100000239971 [0,3,0,0,0,0|1,0,0]=4 23040 B13R1.97 CC(=O)Cc1cc(ccc1O)S[13CH3] 62a_200010006938_200025704644 [0,3,0,0,0,0|1,0,0]=4 23041 B13R1.97 CC(=O)Cc1cc(ccc1O)S[13CH3] 62a_200025704644_200010006938 [0,3,0,0,0,0|1,0,0]=4 23042 B13R1.97 COc1ccc(c(c1)CC(=O)C)Br 1458a_100000070787_100000761528 [0,3,0,0,0,0|1,0,0]=4 23043 B13R1.97 COc1ccc(c(c1)CC(=O)C)Br 1458a_100000690513_200000210301 [0,3,0,0,0,0|1,0,0]=4 23044 B13R1.97 COc1ccc(c(c1)CC(=O)C)Cl 1458a_100000070787_100000718613 [0,3,0,0,0,0|1,0,0]=4 23045 B13R1.97 COc1ccc(c(c1)CC(=O)C)Cl 1458a_100010217559_200000210301 [0,3,0,0,0,0|1,0,0]=4 23046 B13R1.97 COc1ccc(c(c1)CC(=O)C)F 1458a_100000070787_100010243555 [0,3,0,0,0,0|1,0,0]=4 23047 B13R1.97 COc1ccc(c(c1)CC(=O)C)F 1458a_100009868546_200000210301 [0,3,0,0,0,0|1,0,0]=4 23048 B13R1.97 COc1ccc(c(c1)CC(=O)[13CH3])Br 1458a_100000690513_200025704644 [0,3,0,0,0,0|1,0,0]=4 23049 B13R1.97 COc1ccc(c(c1)CC(=O)[13CH3])Cl 1458a_100010217559_200025704644 [0,3,0,0,0,0|1,0,0]=4 23050 B13R1.97 COc1ccc(c(c1)CC(=O)[13CH3])F 1458a_100009868546_200025704644 [0,3,0,0,0,0|1,0,0]=4 23051 B13R1.97 CSc1ccc(c(c1)CC(=O)C)O 62a_200000210301_200010006938 [0,3,0,0,0,0|1,0,0]=4 23052 B13R1.97 CSc1ccc(c(c1)CC(=O)C)O 62a_200010006938_200000210301 [0,3,0,0,0,0|1,0,0]=4 23053 B13R1.885 CC(=O)Cc1c(ccc(c1Br)Cl)F 1458a_100000070787_100011099539 [0,3,0,0,0,0|1,0,0]=4 23054 B13R1.885 CC(=O)Cc1c(ccc(c1Br)F)F 1458a_100016070055_200000210301 [0,3,0,0,0,0|1,0,0]=4 23055 B13R1.885 CC(=O)Cc1c(ccc(c1Cl)C)Cl 1458a_100000070787_200010220899 [0,3,0,0,0,0|1,0,0]=4 23056 B13R1.885 CC(=O)Cc1c(ccc(c1Cl)C)F 1458a_100000038137_200000210301 [0,3,0,0,0,0|1,0,0]=4 23057 B13R1.885 CC(=O)Cc1c(ccc(c1Cl)C)F 1458a_100000070787_100009813558 [0,3,0,0,0,0|1,0,0]=4 23058 B13R1.885 CC(=O)Cc1c(ccc(c1Cl)Cl)F 1458a_100000062034_200000210301 [0,3,0,0,0,0|1,0,0]=4 23059 B13R1.885 CC(=O)Cc1c(ccc(c1Cl)F)F 1458a_100000037411_200000210301 [0,3,0,0,0,0|1,0,0]=4 23060 B13R1.885 CC(=O)Cc1c(ccc(c1Cl)F)F 1458a_100000070787_100009813715 [0,3,0,0,0,0|1,0,0]=4 23061 B13R1.885 CC(=O)Cc1c(ccc(c1F)Br)Cl 1458a_100000070787_100010993448 [0,3,0,0,0,0|1,0,0]=4 23062 B13R1.885 CC(=O)Cc1c(ccc(c1F)C)Cl 1458a_100000035286_200000210301 [0,3,0,0,0,0|1,0,0]=4 23063 B13R1.885 CC(=O)Cc1c(ccc(c1F)C)Cl 1458a_100000070787_100009813557 [0,3,0,0,0,0|1,0,0]=4 23064 B13R1.885 CC(=O)Cc1c(ccc(c1F)C)F 1458a_100000070787_100011217880 [0,3,0,0,0,0|1,0,0]=4 23065 B13R1.885 CC(=O)Cc1c(ccc(c1F)C)F 1458a_100011218906_200000210301 [0,3,0,0,0,0|1,0,0]=4 23066 B13R1.885 CC(=O)Cc1c(ccc(c1F)Cl)Br 1458a_100000070787_100011071994 [0,3,0,0,0,0|1,0,0]=4 23067 B13R1.885 CC(=O)Cc1c(ccc(c1F)Cl)Cl 1458a_100000070787_100009814555 [0,3,0,0,0,0|1,0,0]=4 23068 B13R1.885 CC(=O)Cc1c(ccc(c1F)Cl)F 1458a_100000038211_200000210301 [0,3,0,0,0,0|1,0,0]=4 23069 B13R1.885 CC(=O)Cc1c(ccc(c1F)Cl)F 1458a_100000070787_100009813610 [0,3,0,0,0,0|1,0,0]=4 23070 B13R1.885 CC(=O)Cc1c(ccc(c1F)F)Br 1458a_100000070787_100011070584 [0,3,0,0,0,0|1,0,0]=4 23071 B13R1.885 CC(=O)Cc1c(ccc(c1F)F)Br 1458a_100010177769_200000210301 [0,3,0,0,0,0|1,0,0]=4 23072 B13R1.885 CC(=O)Cc1c(ccc(c1F)F)Cl 1458a_100000070787_100010381632 [0,3,0,0,0,0|1,0,0]=4 23073 B13R1.885 CC(=O)Cc1c(ccc(c1F)F)F 1458a_100000042514_200000210301 [0,3,0,0,0,0|1,0,0]=4 23074 B13R1.885 CC(=O)Cc1c(ccc(c1F)F)F 1458a_100000070787_100009813269 [0,3,0,0,0,0|1,0,0]=4 23075 B13R1.885 Cc1ccc(c(c1Cl)CC(=O)[13CH3])F 1458a_100000038137_200025704644 [0,3,0,0,0,0|1,0,0]=4 23076 B13R1.885 Cc1ccc(c(c1F)CC(=O)[13CH3])Cl 1458a_100000035286_200025704644 [0,3,0,0,0,0|1,0,0]=4 23077 B13R1.885 Cc1ccc(c(c1F)CC(=O)[13CH3])F 1458a_100011218906_200025704644 [0,3,0,0,0,0|1,0,0]=4 23078 B13R1.885 [13CH3]C(=O)Cc1c(ccc(c1Br)F)F 1458a_100016070055_200025704644 [0,3,0,0,0,0|1,0,0]=4 23079 B13R1.885 [13CH3]C(=O)Cc1c(ccc(c1Cl)Cl)F 1458a_100000062034_200025704644 [0,3,0,0,0,0|1,0,0]=4 23080 B13R1.885 [13CH3]C(=O)Cc1c(ccc(c1Cl)F)F 1458a_100000037411_200025704644 [0,3,0,0,0,0|1,0,0]=4 23081 B13R1.885 [13CH3]C(=O)Cc1c(ccc(c1F)Cl)F 1458a_100000038211_200025704644 [0,3,0,0,0,0|1,0,0]=4 23082 B13R1.885 [13CH3]C(=O)Cc1c(ccc(c1F)F)Br 1458a_100010177769_200025704644 [0,3,0,0,0,0|1,0,0]=4 23083 B13R1.885 [13CH3]C(=O)Cc1c(ccc(c1F)F)F 1458a_100000042514_200025704644 [0,3,0,0,0,0|1,0,0]=4 23084 B13R1.2816 CC(=O)Cc1cc(cc(c1Br)F)F 1458a_100000070787_100015714476 [0,3,0,0,0,0|1,0,0]=4 23085 B13R1.2816 CC(=O)Cc1cc(cc(c1Cl)Br)I 1458a_100000070787_100021522891 [0,3,0,0,0,0|1,0,0]=4 23086 B13R1.2816 CC(=O)Cc1cc(cc(c1F)F)C 1458a_100000070787_100015889675 [0,3,0,0,0,0|1,0,0]=4 23087 B13R1.2816 CC(=O)Cc1cc(cc(c1F)F)F 1458a_100000070787_100009813678 [0,3,0,0,0,0|1,0,0]=4 23088 B13R1.2816 CC(=O)Cc1cc(cc(c1F)F)F 1458a_100011217549_200000210301 [0,3,0,0,0,0|1,0,0]=4 23089 B13R1.2816 CC(=O)Cc1cc(cc(c1I)I)I 1458a_100000070787_100010206063 [0,3,0,0,0,0|1,0,0]=4 23090 B13R1.2816 CC(=O)Cc1cc(cc(c1O)Br)Br 1458a_100000070787_200009814416 [0,3,0,0,0,0|1,0,0]=4 23091 B13R1.2816 CC(=O)Cc1cc(cc(c1O)Cl)Cl 1458a_100010323609_200000210301 [0,3,0,0,0,0|1,0,0]=4 23092 B13R1.2816 CC(=O)Cc1cc(cc(c1O)F)F 1458a_200015623426_200000210301 [0,3,0,0,0,0|1,0,0]=4 23093 B13R1.2816 [13CH3]C(=O)Cc1cc(cc(c1F)F)F 1458a_100011217549_200025704644 [0,3,0,0,0,0|1,0,0]=4 23094 B13R1.2816 [13CH3]C(=O)Cc1cc(cc(c1O)Cl)Cl 1458a_100010323609_200025704644 [0,3,0,0,0,0|1,0,0]=4 23095 B13R1.2816 [13CH3]C(=O)Cc1cc(cc(c1O)F)F 1458a_200015623426_200025704644 [0,3,0,0,0,0|1,0,0]=4 23096 B13R1.641 CC(=O)Cc1cccc(c1Br)C#N 1458a_100000070787_100010145452 [0,3,0,0,0,0|1,0,0]=4 23097 B13R1.641 CC(=O)Cc1cccc(c1Cl)C#N 1458a_100000070787_100010147161 [0,3,0,0,0,0|1,0,0]=4 23098 B13R1.641 CC(=O)Cc1cccc(c1F)C#N 1458a_100000070787_100000695645 [0,3,0,0,0,0|1,0,0]=4 23099 B13R1.641 COc1cccc(c1C)CC(=O)C 1458a_100000070787_100009876938 [0,3,0,0,0,0|1,0,0]=4 23100 B13R1.641 COc1cccc(c1Cl)CC(=O)C 1458a_100000070787_200010147866 [0,3,0,0,0,0|1,0,0]=4 23101 B13R1.641 COc1cccc(c1F)CC(=O)C 1458a_100000070787_100011260763 [0,3,0,0,0,0|1,0,0]=4 23102 B13R1.641 COc1cccc(c1F)CC(=O)C 1458a_100000698549_200000210301 [0,3,0,0,0,0|1,0,0]=4 23103 B13R1.641 COc1cccc(c1F)CC(=O)[13CH3] 1458a_100000698549_200025704644 [0,3,0,0,0,0|1,0,0]=4 23104 B13R1.56 CC(=O)Cc1cc(cc(c1)C#N)Br 1458a_100000070787_100010204237 [0,3,0,0,0,0|1,0,0]=4 23105 B13R1.56 CC(=O)Cc1cc(cc(c1)C#N)F 1458a_100000070787_100012349702 [0,3,0,0,0,0|1,0,0]=4 23106 B13R1.56 CC(=O)Cc1cc(cc(c1)C#N)F 1458a_200012184419_200000210301 [0,3,0,0,0,0|1,0,0]=4 23107 B13R1.56 COc1cc(cc(c1)CC(=O)C)Br 1458a_100000070787_100010162483 [0,3,0,0,0,0|1,0,0]=4 23108 B13R1.56 COc1cc(cc(c1)CC(=O)C)Cl 1458a_100000070787_100010188059 [0,3,0,0,0,0|1,0,0]=4 23109 B13R1.56 COc1cc(cc(c1)CC(=O)C)F 1458a_100000070787_100011934817 [0,3,0,0,0,0|1,0,0]=4 23110 B13R1.56 [13CH3]C(=O)Cc1cc(cc(c1)C#N)F 1458a_200012184419_200025704644 [0,3,0,0,0,0|1,0,0]=4 23111 B13R1.373 C=C=Cc1cccc(c1)CC(=O)C 271570a_100015277604_100000689217 [0,3,0,0,0,0|1,0,0]=4 23112 B13R1.373 CC(=O)Cc1cccc(c1)SCF 62a_100000689217_100015361967 [0,3,0,0,0,0|1,0,0]=4 23113 B13R1.373 CC(=O)Cc1cccc(c1)SCF 62a_100015361967_100000689217 [0,3,0,0,0,0|1,0,0]=4 23114 B13R1.373 CC=Cc1cccc(c1)CC(=O)C 271570a_100016259895_100000689217 [0,3,0,0,0,0|1,0,0]=4 23115 B13R1.373 CCOc1cccc(c1)CC(=O)C 1458a_100000690747_200000210301 [0,3,0,0,0,0|1,0,0]=4 23116 B13R1.373 CCOc1cccc(c1)CC(=O)[13CH3] 1458a_100000690747_200025704644 [0,3,0,0,0,0|1,0,0]=4 23117 B13R1.373 CCSc1cccc(c1)CC(=O)C 62a_100000210202_100000689217 [0,3,0,0,0,0|1,0,0]=4 23118 B13R1.373 CCSc1cccc(c1)CC(=O)C 62a_100000689217_100000210202 [0,3,0,0,0,0|1,0,0]=4 23119 B13R1.587 C=C(C)c1cccc(c1)CC(=O)C 271570a_100000694244_100000689217 [0,3,0,0,0,0|1,0,0]=4 23120 B13R1.587 CC(=O)Cc1cccc(c1)B(O)O 1458a_100000070787_100009814088 [0,3,0,0,0,0|1,0,0]=4 23121 B13R1.587 CC(=O)Cc1cccc(c1)C(=O)C 1458a_100000070787_100000084091 [0,3,0,0,0,0|1,0,0]=4 23122 B13R1.587 CC(=O)Cc1cccc(c1)C(=O)N 1458a_100000070787_100000738444 [0,3,0,0,0,0|1,0,0]=4 23123 B13R1.587 CC(=O)Cc1cccc(c1)C(F)F 1458a_100000070787_100012343606 [0,3,0,0,0,0|1,0,0]=4 23124 B13R1.587 CC(=O)Cc1cccc(c1)[N+](=O)[O-] 1458a_100000070787_100000737091 [0,3,0,0,0,0|1,0,0]=4 23125 B13R1.587 CC(=O)Cc1cccc(c1)[N+](=O)[O-] 1458a_100000749288_200000210301 [0,3,0,0,0,0|1,0,0]=4 23126 B13R1.587 [13CH3]C(=O)Cc1cccc(c1)[N+](=O)[O-] 1458a_100000749288_200025704644 [0,3,0,0,0,0|1,0,0]=4 23127 B11R1.9 C=Cc1cc(cc(c1)C=O)C 271570a_100011290941_100000686105 [0,1,1,1,0,0|0,0,1]=4 23128 B11R1.9 C=Cc1cc(nc(c1)C=O)C 271570a_100011290941_100009814795 [0,1,1,1,0,0|1,0,0]=4 23129 B11R2.34 Brc1ccc(cc1)C2CC2 271570a_100011220607_100000752885 [1,1,0,1,0,0|0,0,1]=4 23130 B11R2.34 Cc1ccc(cc1)C2CC2 271570a_100011220607_100000186775 [1,1,0,1,0,0|0,0,1]=4 23131 B11R2.34 Clc1ccc(cc1)C2CC2 271570a_100011220607_100000755918 [1,1,0,1,0,0|0,0,1]=4 23132 B11R2.34 Fc1ccc(cc1)C2CC2 271570a_100011220607_100000211213 [1,1,0,1,0,0|0,0,1]=4 23133 B11R2.34 Nc1ccc(cc1)C2CC2 271570a_100011220607_100000185761 [1,1,0,1,0,0|0,0,1]=4 23134 B11R2.34 Oc1ccc(cc1)C2CC2 271570a_100011220607_100000185759 [1,1,0,1,0,0|0,0,1]=4 23135 B11R2.34 Oc1ccc(cc1)C2CC2 271570a_203496583355_100009820665 [1,1,0,1,0,0|0,0,1]=4 23136 B11R2.988 CNC1Cc2c1cccc2 7a_106832991635_100009813401 [1,1,0,1,0,0|0,0,1]=4 23137 B11R2.988 CSC1Cc2c1cccc2 62a_100009813401_200000210301 [1,1,0,1,0,0|0,0,1]=4 23138 B11R2.988 CSC1Cc2c1cccc2 62a_200000210301_100009813401 [1,1,0,1,0,0|0,0,1]=4 23139 B11R2.988 [13CH3]SC1Cc2c1cccc2 62a_100009813401_200025704644 [1,1,0,1,0,0|0,0,1]=4 23140 B11R2.988 [13CH3]SC1Cc2c1cccc2 62a_200025704644_100009813401 [1,1,0,1,0,0|0,0,1]=4 23141 B13R2.10 Cc1cc(cs1)c2ccccc2 271570a_100000699828_100000210277 [0,0,0,1,0,2|0,0,1]=4 23142 B13R2.10 Cc1cc(cs1)c2ccccc2 271570a_100011218836_100000759034 [0,0,0,1,0,2|0,0,1]=4 23143 B13R2.10 Cc1cc(n[nH]1)c2ccccc2 271570a_100009872134_100000210277 [0,0,0,1,0,2|0,0,1]=4 23144 B13R2.10 Cc1cc(n[nH]1)c2ccccc2 271570a_100011218836_100015199547 [0,0,0,1,0,2|0,0,1]=4 23145 B13R2.10 Cc1cc(sn1)c2ccccc2 271570a_100011218836_100009815735 [0,0,0,1,0,2|0,0,1]=4 23146 B13R2.10 Cc1csc(c1)c2ccccc2 271570a_100000038307_100000210277 [0,0,0,1,0,2|0,0,1]=4 23147 B13R2.10 Cc1csc(c1)c2ccccc2 271570a_100011218836_100009876951 [0,0,0,1,0,2|0,0,1]=4 23148 B13R2.10 O=C1C=C(CC1)c2ccccc2 271570a_100010737933_100000210277 [0,0,0,1,0,2|1,0,0]=4 23149 B13R2.31 O=C1CC(C1)Sc2ccccc2 62a_100009894365_100000041952 [0,0,0,1,0,2|1,0,0]=4 23150 B13R2.72 C=C(C)c1coc2c1cccc2 271570a_100000694244_100009812202 [0,0,0,1,0,2|0,0,1]=4 23151 B13R2.72 C=C(C)c1csc2c1cccc2 271570a_100000694244_100009813928 [0,0,0,1,0,2|0,0,1]=4 23152 B13R2.72 C=C(C)c1n[nH]c2c1cccc2 271570a_100000694244_100000050141 [0,0,0,1,0,2|0,0,1]=4 23153 B13R2.72 CC(=O)C1=CCc2c1cccc2 1458a_100000037392_200000210301 [0,0,0,1,0,2|1,0,0]=4 23154 B13R2.72 CC(=O)C1C=Cc2c1cccc2 1458a_200009832160_200000210301 [0,0,0,1,0,2|1,0,0]=4 23155 B13R2.72 CC(=O)C1CCc2c1cccc2 1458a_100000750891_200000210301 [0,0,0,1,0,2|1,0,0]=4 23156 B13R2.72 [13CH3]C(=O)C1=CCc2c1cccc2 1458a_100000037392_200025704644 [0,0,0,1,0,2|1,0,0]=4 23157 B13R2.72 [13CH3]C(=O)C1C=Cc2c1cccc2 1458a_200009832160_200025704644 [0,0,0,1,0,2|1,0,0]=4 23158 B13R2.72 [13CH3]C(=O)C1CCc2c1cccc2 1458a_100000750891_200025704644 [0,0,0,1,0,2|1,0,0]=4 23159 B13R2.423 CC(=O)[C@@H]1C[C@H]1c2ccccc2 1458a_100009815801_200000210301 [0,0,0,1,0,2|1,0,0]=4 23160 B13R2.423 [13CH3]C(=O)[C@@H]1C[C@H]1c2ccccc2 1458a_100009815801_200025704644 [0,0,0,1,0,2|1,0,0]=4 23161 B13R2.147 O=C1CC(C1)c2ccc(cc2)O 271570a_203496583355_100000741321 [0,1,0,1,0,1|1,0,0]=4 23162 B13R2.155 Cc1cnc2ccc(cc2c1)O 271570a_203496583355_100009817055 [0,1,0,1,0,1|0,0,1]=4 23163 B13R2.155 O=C1CCc2ccc(cc2C1)O 271570a_203496583355_100010138410 [0,1,0,1,0,1|1,0,0]=4 23164 B13R2.27 O=C1CCC1Nc2ccccc2 34a_100000106764_100009892977 [0,1,0,1,0,1|1,0,0]=4 23165 B13R2.27 O=C1CCC1Oc2ccccc2 34a_100000210340_100009892977 [0,1,0,1,0,1|1,0,0]=4 23166 B13R2.27 O=C1CCC1Oc2ccccc2 7a_100000210340_100009892977 [0,1,0,1,0,1|1,0,0]=4 23167 B13R2.27 O=C1CCC1Sc2ccccc2 62a_100000719477_100009892977 [0,1,0,1,0,1|1,0,0]=4 23168 B13R2.27 O=C1CCC1Sc2ccccc2 62a_100009892977_100000041952 [0,1,0,1,0,1|1,0,0]=4 23169 B13R2.32 Cc1ccc2ccccc2c1O 271570a_203496583355_100000759710 [0,1,0,1,0,1|0,0,1]=4 23170 B13R2.32 Cc1cnc2ccccc2c1O 271570a_203496583355_100000092342 [0,1,0,1,0,1|0,0,1]=4 23171 B13R2.57 CNc1ccc2ccccc2c1 34a_100000211940_200000210301 [0,1,0,1,0,1|0,0,1]=4 23172 B13R2.57 CNc1ccc2ccccc2c1 7a_100000211940_200000210301 [0,1,0,1,0,1|0,0,1]=4 23173 B13R2.57 COc1ccc2ccccc2c1 34a_100000185828_200000210301 [0,1,0,1,0,1|0,0,1]=4 23174 B13R2.57 COc1ccc2ccccc2c1 7a_100000185828_200000210301 [0,1,0,1,0,1|0,0,1]=4 23175 B13R2.57 COc1cnc2ccccc2c1 34a_100011934006_200000210301 [0,1,0,1,0,1|0,0,1]=4 23176 B13R2.57 COc1cnc2ccccc2c1 7a_100011934006_200000210301 [0,1,0,1,0,1|0,0,1]=4 23177 B13R2.57 CSc1cc2ccccc2cn1 62a_100009816522_200000210301 [0,1,0,1,0,1|0,0,1]=4 23178 B13R2.57 CSc1cc2ccccc2cn1 62a_200000210301_100000047361 [0,1,0,1,0,1|0,0,1]=4 23179 B13R2.57 CSc1ccc2ccccc2c1 62a_200000210301_100000233703 [0,1,0,1,0,1|0,0,1]=4 23180 B13R2.57 CSc1cnc2ccccc2c1 62a_200000210301_100000737414 [0,1,0,1,0,1|0,0,1]=4 23181 B13R2.57 [13CH3]Nc1ccc2ccccc2c1 34a_100000211940_200025704644 [0,1,0,1,0,1|0,0,1]=4 23182 B13R2.57 [13CH3]Nc1ccc2ccccc2c1 7a_100000211940_200025704644 [0,1,0,1,0,1|0,0,1]=4 23183 B13R2.57 [13CH3]Oc1ccc2ccccc2c1 34a_100000185828_200025704644 [0,1,0,1,0,1|0,0,1]=4 23184 B13R2.57 [13CH3]Oc1ccc2ccccc2c1 7a_100000185828_200025704644 [0,1,0,1,0,1|0,0,1]=4 23185 B13R2.57 [13CH3]Oc1cnc2ccccc2c1 34a_100011934006_200025704644 [0,1,0,1,0,1|0,0,1]=4 23186 B13R2.57 [13CH3]Oc1cnc2ccccc2c1 7a_100011934006_200025704644 [0,1,0,1,0,1|0,0,1]=4 23187 B13R2.57 [13CH3]Sc1cc2ccccc2cn1 62a_100009816522_200025704644 [0,1,0,1,0,1|0,0,1]=4 23188 B13R2.57 [13CH3]Sc1cc2ccccc2cn1 62a_200025704644_100000047361 [0,1,0,1,0,1|0,0,1]=4 23189 B13R2.57 [13CH3]Sc1ccc2ccccc2c1 62a_200025704644_100000233703 [0,1,0,1,0,1|0,0,1]=4 23190 B13R2.57 [13CH3]Sc1cnc2ccccc2c1 62a_200025704644_100000737414 [0,1,0,1,0,1|0,0,1]=4 23191 B13R2.15272 CCC(=O)C1Cc2c1cccc2 1458a_200000238571_100000210202 [0,1,0,1,0,1|1,0,0]=4 23192 B13R2.15272 CNC(=O)C1Cc2c1cccc2 11a_106832991635_200000238571 [0,1,0,1,0,1|1,0,0]=4 23193 B13R2.15272 CNC(=O)C1Cc2c1cccc2 1626a_100102657272_200000238571 [0,1,0,1,0,1|1,0,0]=4 23194 B13R2.15272 CNC(=O)C1Cc2c1cccc2 240690a_100102657272_200000238571 [0,1,0,1,0,1|1,0,0]=4 23195 B13R2.15272 CNC(=O)C1Cc2c1cccc2 527a_100102657272_200000238571 [0,1,0,1,0,1|1,0,0]=4 23196 B13R2.15272 O=C(CF)C1Cc2c1cccc2 1458a_200000238571_100015361967 [0,1,0,1,0,1|1,0,0]=4 23197 B13R2.369 Cc1cc2ccccc2nc1O 271570a_203496583355_100000751756 [0,1,0,1,0,1|0,0,1]=4 23198 B13R2.435 C=C(C)c1cc2ccccc2[nH]1 271570a_100000694244_100010232065 [0,1,0,1,0,1|0,0,1]=4 23199 B13R2.435 C=C(C)c1cc2ccccc2o1 271570a_100000694244_100010159458 [0,1,0,1,0,1|0,0,1]=4 23200 B13R2.435 C=C(C)c1cc2ccccc2s1 271570a_100000694244_100009816949 [0,1,0,1,0,1|0,0,1]=4 23201 B13R2.435 C=C(C)c1nc2ccccc2[nH]1 271570a_100000694244_100009814255 [0,1,0,1,0,1|0,0,1]=4 23202 B13R2.435 C=C(C)c1nc2ccccc2s1 271570a_100000694244_100000751744 [0,1,0,1,0,1|0,0,1]=4 23203 B13R2.435 CC(=O)C1=Cc2ccccc2C1 1458a_100009862756_200000210301 [0,1,0,1,0,1|1,0,0]=4 23204 B13R2.435 CC(=O)C1Cc2ccccc2C1 1458a_100000070787_100000753484 [0,1,0,1,0,1|1,0,0]=4 23205 B13R2.435 CC(=O)C1Cc2ccccc2C1 1458a_100000685393_200000210301 [0,1,0,1,0,1|1,0,0]=4 23206 B13R2.435 CC(=O)C1Cc2ccccc2O1 1458a_100000209886_200000210301 [0,1,0,1,0,1|1,0,0]=4 23207 B13R2.435 CC(=O)C1Cc2ccccc2S1 1458a_100000024912_200000210301 [0,1,0,1,0,1|1,0,0]=4 23208 B13R2.435 CC(=O)N1Cc2ccccc2C1 11a_100000752595_100015343762 [0,1,0,1,0,1|1,0,0]=4 23209 B13R2.435 CC(=O)N1Cc2ccccc2C1 1626a_100000752595_100015343762 [0,1,0,1,0,1|1,0,0]=4 23210 B13R2.435 CC(=O)N1Cc2ccccc2C1 240690a_100000752595_100015343762 [0,1,0,1,0,1|1,0,0]=4 23211 B13R2.435 CC(=O)N1Cc2ccccc2C1 527a_100000752595_100103153847 [0,1,0,1,0,1|1,0,0]=4 23212 B13R2.435 [13CH3]C(=O)C1=Cc2ccccc2C1 1458a_100009862756_200025704644 [0,1,0,1,0,1|1,0,0]=4 23213 B13R2.435 [13CH3]C(=O)C1Cc2ccccc2C1 1458a_100000685393_200025704644 [0,1,0,1,0,1|1,0,0]=4 23214 B13R2.435 [13CH3]C(=O)C1Cc2ccccc2O1 1458a_100000209886_200025704644 [0,1,0,1,0,1|1,0,0]=4 23215 B13R2.435 [13CH3]C(=O)C1Cc2ccccc2S1 1458a_100000024912_200025704644 [0,1,0,1,0,1|1,0,0]=4 23216 B13R2.328 Cc1cc2ccccc2c(n1)O 271570a_203496583355_100000698243 [0,1,0,1,0,1|0,0,1]=4 23217 B13R2.5179 O=C1CCc2c(cccc2C1)O 271570a_203496583355_100010138409 [0,1,0,1,0,1|1,0,0]=4 23218 B13R2.162 O=C1CCc2cccc(c2C1)O 271570a_203496583355_100010006498 [0,1,0,1,0,1|1,0,0]=4 23219 B13R2.3683 Cc1cnc2cc(ccc2c1)O 271570a_203496583355_100010751441 [0,1,0,1,0,1|0,0,1]=4 23220 B13R2.3683 O=C1CCc2cc(ccc2C1)O 271570a_203496583355_100000753102 [0,1,0,1,0,1|1,0,0]=4 23221 B13R2.3683 O=C1Cc2ccc(cc2CN1)O 271570a_203496583355_100010174877 [0,1,0,1,0,1|1,0,0]=4 23222 B13R2.2121 C=Cc1ccc2[nH]c(cc2c1)C 271570a_100011290941_100011214893 [0,2,0,1,0,0|1,0,0]=4 23223 B13R2.2121 C=Cc1ccc2c(c1)CC(=O)C2 271570a_100011290941_100010185598 [0,2,0,1,0,0|1,0,0]=4 23224 B13R2.2121 C=Cc1ccc2cc([nH]c2c1)C 271570a_100011290941_100010196937 [0,2,0,1,0,0|1,0,0]=4 23225 B13R2.2121 C=Cc1ccc2sc(cc2c1)C 271570a_100011290941_100000695401 [0,2,0,1,0,0|1,0,0]=4 23226 B13R2.2121 COc1ccc2[nH]c(cc2c1)C 34a_100000073708_200000210301 [0,2,0,1,0,0|1,0,0]=4 23227 B13R2.2121 COc1ccc2[nH]c(cc2c1)C 7a_100000073708_200000210301 [0,2,0,1,0,0|1,0,0]=4 23228 B13R2.2121 COc1ccc2cc([nH]c2c1)C 34a_100000058111_200000210301 [0,2,0,1,0,0|1,0,0]=4 23229 B13R2.2121 COc1ccc2cc(oc2c1)C 34a_100000095638_200000210301 [0,2,0,1,0,0|1,0,0]=4 23230 B13R2.2121 COc1ccc2cc(oc2c1)C 7a_100000095638_200000210301 [0,2,0,1,0,0|1,0,0]=4 23231 B13R2.2121 CSc1ccc2[nH]c(cc2c1)C 62a_200000210301_100011214893 [0,2,0,1,0,0|1,0,0]=4 23232 B13R2.2121 CSc1ccc2c(c1)CC(=O)C2 62a_100010185598_200000210301 [0,2,0,1,0,0|1,0,0]=4 23233 B13R2.2121 CSc1ccc2cc([nH]c2c1)C 62a_200000210301_100010196937 [0,2,0,1,0,0|1,0,0]=4 23234 B13R2.2121 CSc1ccc2sc(cc2c1)C 62a_100000695401_200000210301 [0,2,0,1,0,0|1,0,0]=4 23235 B13R2.2121 CSc1ccc2sc(cc2c1)C 62a_200000210301_100000695401 [0,2,0,1,0,0|1,0,0]=4 23236 B13R2.2121 Cc1cc2cc(ccc2[nH]1)O[13CH3] 34a_100000073708_200025704644 [0,2,0,1,0,0|1,0,0]=4 23237 B13R2.2121 Cc1cc2cc(ccc2[nH]1)O[13CH3] 7a_100000073708_200025704644 [0,2,0,1,0,0|1,0,0]=4 23238 B13R2.2121 Cc1cc2cc(ccc2[nH]1)S[13CH3] 62a_200025704644_100011214893 [0,2,0,1,0,0|1,0,0]=4 23239 B13R2.2121 Cc1cc2cc(ccc2s1)S[13CH3] 62a_100000695401_200025704644 [0,2,0,1,0,0|1,0,0]=4 23240 B13R2.2121 Cc1cc2cc(ccc2s1)S[13CH3] 62a_200025704644_100000695401 [0,2,0,1,0,0|1,0,0]=4 23241 B13R2.2121 Cc1cc2ccc(cc2[nH]1)O[13CH3] 34a_100000058111_200025704644 [0,2,0,1,0,0|1,0,0]=4 23242 B13R2.2121 Cc1cc2ccc(cc2[nH]1)S[13CH3] 62a_200025704644_100010196937 [0,2,0,1,0,0|1,0,0]=4 23243 B13R2.2121 Cc1cc2ccc(cc2o1)O[13CH3] 34a_100000095638_200025704644 [0,2,0,1,0,0|1,0,0]=4 23244 B13R2.2121 Cc1cc2ccc(cc2o1)O[13CH3] 7a_100000095638_200025704644 [0,2,0,1,0,0|1,0,0]=4 23245 B13R2.2121 [13CH3]Sc1ccc2c(c1)CC(=O)C2 62a_100010185598_200025704644 [0,2,0,1,0,0|1,0,0]=4 23246 B13R2.13083 Cc1cc2cc(c(cc2[nH]1)F)O 271570a_203496583355_200010763346 [0,2,0,1,0,0|1,0,0]=4 23247 B13R2.5190 CC1Cc2cc(ccc2C1=O)O 271570a_203496583355_100010169280 [0,2,0,1,0,0|0,0,1]=4 23248 B13R2.5190 CN1C(=O)Cc2c1ccc(c2)O 271570a_203496583355_100000183948 [0,2,0,1,0,0|1,0,0]=4 23249 B13R2.5190 CN1Cc2cc(ccc2C1=O)O 271570a_203496583355_100010161043 [0,2,0,1,0,0|1,0,0]=4 23250 B13R2.43 CCc1cc2cc(ccc2o1)O 271570a_203496583355_200010233821 [0,2,0,1,0,0|1,0,0]=4 23251 B13R2.43 CSc1cc2cc(ccc2[nH]1)Br 62a_100011012855_200000210301 [0,2,0,1,0,0|1,0,0]=4 23252 B13R2.43 CSc1cc2cc(ccc2[nH]1)Br 62a_200000210301_100011012855 [0,2,0,1,0,0|1,0,0]=4 23253 B13R2.43 CSc1cc2cc(ccc2s1)Br 62a_200000210301_200010198765 [0,2,0,1,0,0|1,0,0]=4 23254 B13R2.43 CSc1cc2cc(ccc2s1)Br 62a_200010198765_200000210301 [0,2,0,1,0,0|1,0,0]=4 23255 B13R2.43 OCc1cc2cc(ccc2o1)O 271570a_203496583355_100011934623 [0,2,0,1,0,0|1,0,0]=4 23256 B13R2.43 OCc1cc2cc(ccc2s1)O 271570a_203496583355_100010255381 [0,2,0,1,0,0|1,0,0]=4 23257 B13R2.43 OCc1cc2ccc(cc2[nH]1)O 271570a_203496583355_100000735881 [0,2,0,1,0,0|1,0,0]=4 23258 B13R2.43 OCc1cc2ccc(cc2s1)O 271570a_203496583355_100010244134 [0,2,0,1,0,0|1,0,0]=4 23259 B13R2.43 [13CH3]Sc1cc2cc(ccc2[nH]1)Br 62a_100011012855_200025704644 [0,2,0,1,0,0|1,0,0]=4 23260 B13R2.43 [13CH3]Sc1cc2cc(ccc2[nH]1)Br 62a_200025704644_100011012855 [0,2,0,1,0,0|1,0,0]=4 23261 B13R2.43 [13CH3]Sc1cc2cc(ccc2s1)Br 62a_200010198765_200025704644 [0,2,0,1,0,0|1,0,0]=4 23262 B13R2.43 [13CH3]Sc1cc2cc(ccc2s1)Br 62a_200025704644_200010198765 [0,2,0,1,0,0|1,0,0]=4 23263 B13R2.3028 CC1Cc2ccc(cc2C1=O)O 271570a_203496583355_100000694082 [0,2,0,1,0,0|0,0,1]=4 23264 B13R2.3028 CN1C(=O)Cc2c1cc(cc2)O 271570a_203496583355_100010285470 [0,2,0,1,0,0|1,0,0]=4 23265 B13R2.3028 CN1Cc2ccc(cc2C1=O)O 271570a_203496583355_100010125600 [0,2,0,1,0,0|1,0,0]=4 23266 B13R2.3028 Cc1[nH]c2ccc(cc2c1C)O 271570a_203496583355_100012262263 [0,2,0,1,0,0|1,0,0]=4 23267 B13R2.15 Cc1[nH]cnc1c2ccccc2 271570a_100011218836_100009816806 [0,2,0,1,0,0|0,0,1]=4 23268 B13R2.15 Cc1c[nH]nc1c2ccccc2 271570a_100011218836_100009871783 [0,2,0,1,0,0|0,0,1]=4 23269 B13R2.15 Cc1c[nH]nc1c2ccccc2 271570a_100102527747_100000210277 [0,2,0,1,0,0|0,0,1]=4 23270 B13R2.15 Cc1ccsc1c2ccccc2 271570a_100000734444_100000210277 [0,2,0,1,0,0|0,0,1]=4 23271 B13R2.15 Cc1ccsc1c2ccccc2 271570a_100011218836_100000742657 [0,2,0,1,0,0|0,0,1]=4 23272 B13R2.15 Cc1cscc1c2ccccc2 271570a_100000069996_100000210277 [0,2,0,1,0,0|0,0,1]=4 23273 B13R2.15 Cc1cscc1c2ccccc2 271570a_100011218836_100000759966 [0,2,0,1,0,0|0,0,1]=4 23274 B13R2.15 Cc1n[nH]cc1c2ccccc2 271570a_100000069033_100000210277 [0,2,0,1,0,0|0,0,1]=4 23275 B13R2.15 Cc1n[nH]cc1c2ccccc2 271570a_100011218836_100011912673 [0,2,0,1,0,0|0,0,1]=4 23276 B13R2.15 Cc1ncsc1c2ccccc2 271570a_100010115231_100000210277 [0,2,0,1,0,0|0,0,1]=4 23277 B13R2.15 Cc1ncsc1c2ccccc2 271570a_100011218836_100009817116 [0,2,0,1,0,0|0,0,1]=4 23278 B13R2.15 Cc1occc1c2ccccc2 271570a_100000070625_100000210277 [0,2,0,1,0,0|0,0,1]=4 23279 B13R2.15 Cc1oncc1c2ccccc2 271570a_100000723675_100000210277 [0,2,0,1,0,0|0,0,1]=4 23280 B13R2.15 Cc1oncc1c2ccccc2 271570a_100011218836_100009872056 [0,2,0,1,0,0|0,0,1]=4 23281 B13R2.15 Cc1sccc1c2ccccc2 271570a_100011218836_100000684487 [0,2,0,1,0,0|0,0,1]=4 23282 B13R2.15 Cc1sccc1c2ccccc2 271570a_100012356473_100000210277 [0,2,0,1,0,0|0,0,1]=4 23283 B13R2.15 Cc1scnc1c2ccccc2 271570a_100011218836_100000732656 [0,2,0,1,0,0|0,0,1]=4 23284 B13R2.45 C=Cc1nc2ccccc2n1C 271570a_100011290941_200000239431 [0,2,0,1,0,0|1,0,0]=4 23285 B13R2.45 C=Cc1sc2ccccc2c1C 271570a_100011290941_200010198769 [0,2,0,1,0,0|1,0,0]=4 23286 B13R2.45 COc1cc2ccccc2n1C 34a_100000066695_200000210301 [0,2,0,1,0,0|1,0,0]=4 23287 B13R2.45 CSC1Cc2ccccc2C1=O 62a_100011218503_200000210301 [0,2,0,1,0,0|0,0,1]=4 23288 B13R2.45 CSC1Cc2ccccc2C1=O 62a_200000210301_100011218503 [0,2,0,1,0,0|0,0,1]=4 23289 B13R2.45 CSc1sc2ccccc2c1Br 62a_100015504031_200000210301 [0,2,0,1,0,0|1,0,0]=4 23290 B13R2.45 CSc1sc2ccccc2c1Br 62a_200000210301_100015504031 [0,2,0,1,0,0|1,0,0]=4 23291 B13R2.45 CSc1sc2ccccc2c1C 62a_200000210301_200010198769 [0,2,0,1,0,0|1,0,0]=4 23292 B13R2.45 Cc1c(sc2c1cccc2)S[13CH3] 62a_200025704644_200010198769 [0,2,0,1,0,0|1,0,0]=4 23293 B13R2.45 Cn1c(cc2c1cccc2)O[13CH3] 34a_100000066695_200025704644 [0,2,0,1,0,0|1,0,0]=4 23294 B13R2.45 [13CH3]SC1Cc2ccccc2C1=O 62a_100011218503_200025704644 [0,2,0,1,0,0|0,0,1]=4 23295 B13R2.45 [13CH3]SC1Cc2ccccc2C1=O 62a_200025704644_100011218503 [0,2,0,1,0,0|0,0,1]=4 23296 B13R2.45 [13CH3]Sc1sc2ccccc2c1Br 62a_100015504031_200025704644 [0,2,0,1,0,0|1,0,0]=4 23297 B13R2.45 [13CH3]Sc1sc2ccccc2c1Br 62a_200025704644_100015504031 [0,2,0,1,0,0|1,0,0]=4 23298 B13R2.4856 CN1C(=O)Cc2c1c(ccc2)O 271570a_203496583355_100010870571 [0,2,0,1,0,0|1,0,0]=4 23299 B13R2.4825 CC1Cc2c(cccc2C1=O)O 271570a_203496583355_200012356775 [0,2,0,1,0,0|0,0,1]=4 23300 B13R2.4825 CN1Cc2c(cccc2C1=O)O 271570a_203496583355_100009817108 [0,2,0,1,0,0|1,0,0]=4 23301 B13R2.439 CC(=O)C1(CC1)c2ccccc2 1458a_100000211650_200000210301 [0,2,0,1,0,0|1,0,0]=4 23302 B13R2.439 [13CH3]C(=O)C1(CC1)c2ccccc2 1458a_100000211650_200025704644 [0,2,0,1,0,0|1,0,0]=4 23303 B13R2.135 C=Cc1c(oc2c1cccc2)C 271570a_100011290941_200010236113 [0,2,0,1,0,0|1,0,0]=4 23304 B13R2.135 C=Cc1c(sc2c1cccc2)C 271570a_100011290941_100010002616 [0,2,0,1,0,0|1,0,0]=4 23305 B13R2.135 CSc1c(oc2c1cccc2)C 62a_200000210301_200010236113 [0,2,0,1,0,0|1,0,0]=4 23306 B13R2.135 CSc1c(sc2c1cccc2)C 62a_100010002616_200000210301 [0,2,0,1,0,0|1,0,0]=4 23307 B13R2.135 CSc1c(sc2c1cccc2)C 62a_200000210301_100010002616 [0,2,0,1,0,0|1,0,0]=4 23308 B13R2.135 Cc1oc2ccccc2c1S[13CH3] 62a_200025704644_200010236113 [0,2,0,1,0,0|1,0,0]=4 23309 B13R2.135 Cc1sc2ccccc2c1S[13CH3] 62a_100010002616_200025704644 [0,2,0,1,0,0|1,0,0]=4 23310 B13R2.135 Cc1sc2ccccc2c1S[13CH3] 62a_200025704644_100010002616 [0,2,0,1,0,0|1,0,0]=4 23311 B13R2.26 C=CCN1Cc2ccccc2C1 2230a_100000752595_100000210623 [0,2,0,1,0,0|1,0,0]=4 23312 B13R2.26 C=CCN1Cc2ccccc2C1 269982a_100000752595_100000210623 [0,2,0,1,0,0|1,0,0]=4 23313 B13R2.26 C=CCN1Cc2ccccc2C1 34a_100000752595_100015514636 [0,2,0,1,0,0|1,0,0]=4 23314 B13R2.26 CC=Cc1cc2ccccc2[nH]1 271570a_100016259895_100010232065 [0,2,0,1,0,0|1,0,0]=4 23315 B13R2.26 CC=Cc1cc2ccccc2o1 271570a_100016259895_100010159458 [0,2,0,1,0,0|1,0,0]=4 23316 B13R2.26 CC=Cc1cc2ccccc2s1 271570a_100016259895_100009816949 [0,2,0,1,0,0|1,0,0]=4 23317 B13R2.26 CCSc1cc2ccccc2[nH]1 62a_100000210202_100010232065 [0,2,0,1,0,0|1,0,0]=4 23318 B13R2.26 CCSc1cc2ccccc2o1 62a_100000210202_100010159458 [0,2,0,1,0,0|1,0,0]=4 23319 B13R2.26 CCSc1cc2ccccc2s1 62a_100000210202_100009816949 [0,2,0,1,0,0|1,0,0]=4 23320 B13R2.26 CNCc1cc2ccccc2[nH]1 270004a_106832991635_100000051030 [0,2,0,1,0,0|1,0,0]=4 23321 B13R2.26 CNCc1cc2ccccc2o1 207a_100102657272_100000229944 [0,2,0,1,0,0|1,0,0]=4 23322 B13R2.26 CNCc1cc2ccccc2o1 270004a_106832991635_100000229944 [0,2,0,1,0,0|1,0,0]=4 23323 B13R2.26 CNCc1cc2ccccc2s1 207a_100102657272_100000686906 [0,2,0,1,0,0|1,0,0]=4 23324 B13R2.26 CNCc1cc2ccccc2s1 2230a_100015187092_200000210301 [0,2,0,1,0,0|1,0,0]=4 23325 B13R2.26 CNCc1cc2ccccc2s1 270004a_106832991635_100000686906 [0,2,0,1,0,0|1,0,0]=4 23326 B13R2.26 COCc1cc2ccccc2o1 34a_100000233474_200000210301 [0,2,0,1,0,0|1,0,0]=4 23327 B13R2.26 COCc1cc2ccccc2o1 7a_100000233474_200000210301 [0,2,0,1,0,0|1,0,0]=4 23328 B13R2.26 FCSc1cc2ccccc2[nH]1 62a_100015361967_100010232065 [0,2,0,1,0,0|1,0,0]=4 23329 B13R2.26 FCSc1cc2ccccc2o1 62a_100015361967_100010159458 [0,2,0,1,0,0|1,0,0]=4 23330 B13R2.26 FCSc1cc2ccccc2s1 62a_100015361967_100009816949 [0,2,0,1,0,0|1,0,0]=4 23331 B13R2.26 O=CCN1Cc2ccccc2C1 2230a_100000752595_200015260668 [0,2,0,1,0,0|1,0,0]=4 23332 B13R2.26 O=CCN1Cc2ccccc2C1 269982a_100000752595_200015260668 [0,2,0,1,0,0|1,0,0]=4 23333 B13R2.26 O=CCN1Cc2ccccc2C1 34a_100000752595_200009817547 [0,2,0,1,0,0|1,0,0]=4 23334 B13R2.26 [13CH3]NCc1cc2ccccc2s1 2230a_100015187092_200025704644 [0,2,0,1,0,0|1,0,0]=4 23335 B13R2.26 [13CH3]OCc1cc2ccccc2o1 34a_100000233474_200025704644 [0,2,0,1,0,0|1,0,0]=4 23336 B13R2.26 [13CH3]OCc1cc2ccccc2o1 7a_100000233474_200025704644 [0,2,0,1,0,0|1,0,0]=4 23337 B13R2.64 C1=CCN(C1)Cc2ccccc2 269982a_100015195280_100000211182 [0,2,0,1,0,0|1,0,0]=4 23338 B13R2.54 CSc1cc2cccc(c2[nH]1)Br 62a_100135389745_200000210301 [0,2,0,1,0,0|1,0,0]=4 23339 B13R2.54 CSc1cc2cccc(c2[nH]1)Br 62a_200000210301_100135389745 [0,2,0,1,0,0|1,0,0]=4 23340 B13R2.54 OCc1cc2cccc(c2s1)O 271570a_203496583355_100010255382 [0,2,0,1,0,0|1,0,0]=4 23341 B13R2.54 [13CH3]Sc1cc2cccc(c2[nH]1)Br 62a_100135389745_200025704644 [0,2,0,1,0,0|1,0,0]=4 23342 B13R2.54 [13CH3]Sc1cc2cccc(c2[nH]1)Br 62a_200025704644_100135389745 [0,2,0,1,0,0|1,0,0]=4 23343 B13R2.581 C=Cc1cccc2c1CC(=C2)C 271570a_100011290941_100010271545 [0,2,0,1,0,0|0,0,0]=3 23344 B13R2.581 C=Cc1cccc2c1CC(=O)C2 271570a_100011290941_100010205903 [0,2,0,1,0,0|1,0,0]=4 23345 B13R2.581 C=Cc1cccc2c1cc([nH]2)C 271570a_100011290941_100010143266 [0,2,0,1,0,0|1,0,0]=4 23346 B13R2.581 CC1=Cc2cccc(c2C1)S[13CH3] 62a_100010271545_200025704644 [0,2,0,1,0,0|0,0,0]=3 23347 B13R2.581 CNc1cccc2c1oc(c2)C 34a_200015185323_200000210301 [0,2,0,1,0,0|1,0,0]=4 23348 B13R2.581 COc1cccc2c1cc([nH]2)C 34a_200000059750_200000210301 [0,2,0,1,0,0|1,0,0]=4 23349 B13R2.581 CSc1cccc2c1CC(=C2)C 62a_100010271545_200000210301 [0,2,0,1,0,0|0,0,0]=3 23350 B13R2.581 CSc1cccc2c1CC(=O)C2 62a_100010205903_200000210301 [0,2,0,1,0,0|1,0,0]=4 23351 B13R2.581 CSc1cccc2c1cc([nH]2)C 62a_200000210301_100010143266 [0,2,0,1,0,0|1,0,0]=4 23352 B13R2.581 Cc1cc2c(cccc2[nH]1)O[13CH3] 34a_200000059750_200025704644 [0,2,0,1,0,0|1,0,0]=4 23353 B13R2.581 Cc1cc2c(cccc2[nH]1)S[13CH3] 62a_200025704644_100010143266 [0,2,0,1,0,0|1,0,0]=4 23354 B13R2.581 Cc1cc2cccc(c2o1)N[13CH3] 34a_200015185323_200025704644 [0,2,0,1,0,0|1,0,0]=4 23355 B13R2.581 [13CH3]Sc1cccc2c1CC(=O)C2 62a_100010205903_200025704644 [0,2,0,1,0,0|1,0,0]=4 23356 B7R1.1 C=Cc1ccco1 271570a_100011290941_100009814098 [2,0,0,0,1,0|1,0,0]=4 23357 B7R1.1 C=Cc1cccs1 271570a_100011290941_100011215356 [2,0,0,0,1,0|1,0,0]=4 23358 B7R1.1 C=Cc1ccoc1 271570a_100011290941_100011215275 [2,0,0,0,1,0|1,0,0]=4 23359 B7R1.1 C=Cc1ccsc1 271570a_100011290941_100000738268 [2,0,0,0,1,0|1,0,0]=4 23360 B9R0.43 C=CC(C=C)OCC(=C)C 34a_100000033096_100000748629 [1,0,1,0,0,1|0,0,1]=4 23361 B13R1.337 C=C(Br)CCOCc1ccccc1 34a_100009813270_100015291786 [0,0,0,0,0,3|1,0,0]=4 23362 B13R1.337 C=C(C)C=NNCc1ccccc1 4a_100000007032_100000210575 [0,0,0,0,0,3|0,0,0]=3 23363 B13R1.337 C=C(C)C=NNCc1ccccn1 4a_100000736832_100000210575 [0,0,0,0,0,3|1,0,0]=4 23364 B13R1.337 C=C(C)C=NNCc1cccnc1 4a_100000738295_100000210575 [0,0,0,0,0,3|1,0,0]=4 23365 B13R1.337 C=C(C)C=NNCc1ccncc1 4a_100000736929_100000210575 [0,0,0,0,0,3|1,0,0]=4 23366 B13R1.337 C=C(C)CCNCc1ccccc1 2230a_100015324214_100000730704 [0,0,0,0,0,3|0,0,0]=3 23367 B13R1.337 C=C(C)CCNCc1ccccc1 34a_100015324214_100000730704 [0,0,0,0,0,3|0,0,0]=3 23368 B13R1.337 C=C(C)CCOCc1ccccc1 34a_100000210790_100000730704 [0,0,0,0,0,3|0,0,0]=3 23369 B13R1.337 C=C(C)CCOCc1ccccc1 34a_100000764851_100015291786 [0,0,0,0,0,3|0,0,0]=3 23370 B13R1.337 C=C(C)CCOCc1ccccc1 7a_100000210790_100000730704 [0,0,0,0,0,3|0,0,0]=3 23371 B13R1.337 C=C(C)CCOCc1ccccn1 34a_100000764851_100000721315 [0,0,0,0,0,3|1,0,0]=4 23372 B13R1.337 C=C(C)CCOCc1cccnc1 34a_100000764851_100000733263 [0,0,0,0,0,3|1,0,0]=4 23373 B13R1.337 C=C(C)CCSCc1ccccc1 62a_100000211182_100000730704 [0,0,0,0,0,3|0,0,0]=3 23374 B13R1.337 C=C(C)CCSCc1ccccc1 62a_100000730704_100015291786 [0,0,0,0,0,3|0,0,0]=3 23375 B13R1.337 C=C(C)CCSCc1ccccn1 62a_100000721315_100000730704 [0,0,0,0,0,3|1,0,0]=4 23376 B13R1.337 C=C(C)CCSCc1ccccn1 62a_100000730704_100000721315 [0,0,0,0,0,3|1,0,0]=4 23377 B13R1.337 C=C(C)CCSCc1cccnc1 62a_100000730704_100000741622 [0,0,0,0,0,3|1,0,0]=4 23378 B13R1.337 C=C(C)CCSCc1cccnc1 62a_100000741622_100000730704 [0,0,0,0,0,3|1,0,0]=4 23379 B13R1.337 C=C(C)CCSCc1ccncc1 62a_100000730704_100015193705 [0,0,0,0,0,3|1,0,0]=4 23380 B13R1.337 C=C(C)CCSCc1ccncc1 62a_100015193705_100000730704 [0,0,0,0,0,3|1,0,0]=4 23381 B13R1.337 C=C(C)CNCCc1ccccc1 2230a_100000106460_100000748629 [0,0,0,0,0,3|0,0,0]=3 23382 B13R1.337 C=C(C)CNCCc1ccccc1 34a_100000106460_100000748629 [0,0,0,0,0,3|0,0,0]=3 23383 B13R1.337 C=C(C)CNCCc1cccnc1 2230a_100000736294_100000748629 [0,0,0,0,0,3|1,0,0]=4 23384 B13R1.337 C=C(C)COCCc1ccccc1 34a_100000210245_100000765856 [0,0,0,0,0,3|0,0,0]=3 23385 B13R1.337 C=C(C)COCCc1ccccc1 34a_100000210268_100000748629 [0,0,0,0,0,3|0,0,0]=3 23386 B13R1.337 C=C(C)COCCc1ccccc1 7a_100000210268_100000748629 [0,0,0,0,0,3|0,0,0]=3 23387 B13R1.337 C=C(C)COCCc1ccccn1 34a_100000210271_100000748629 [0,0,0,0,0,3|1,0,0]=4 23388 B13R1.337 C=C(C)COCCc1cccnc1 34a_100011217484_100000748629 [0,0,0,0,0,3|1,0,0]=4 23389 B13R1.337 C=C(C)COCCc1ccncc1 34a_100011216225_100000748629 [0,0,0,0,0,3|1,0,0]=4 23390 B13R1.337 C=C(C)CSCCc1ccccc1 62a_100000748629_100011218657 [0,0,0,0,0,3|0,0,0]=3 23391 B13R1.337 C=C(C)CSCCc1ccccc1 62a_100000765856_100000211660 [0,0,0,0,0,3|0,0,0]=3 23392 B13R1.337 C=C(C)CSCCc1ccccn1 62a_100000748629_100015183660 [0,0,0,0,0,3|1,0,0]=4 23393 B13R1.337 C=C(C)CSCCc1ccccn1 62a_100015183660_100000211660 [0,0,0,0,0,3|1,0,0]=4 23394 B13R1.337 C=C(C)CSCCc1cccnc1 62a_100000748629_200011713674 [0,0,0,0,0,3|1,0,0]=4 23395 B13R1.337 C=C(C)CSCCc1cccnc1 62a_200011713674_100000211660 [0,0,0,0,0,3|1,0,0]=4 23396 B13R1.337 C=C(C)CSCCc1ccncc1 62a_100000723409_100000211660 [0,0,0,0,0,3|1,0,0]=4 23397 B13R1.337 C=C(C)CSCCc1ccncc1 62a_100000748629_100000723409 [0,0,0,0,0,3|1,0,0]=4 23398 B13R1.337 C=C(C)CSCSc1ccccc1 62a_100000748629_100011218342 [0,0,0,0,0,3|0,0,0]=3 23399 B13R1.337 C=C(C)CSCSc1ccccc1 62a_100011218342_100000211660 [0,0,0,0,0,3|0,0,0]=3 23400 B13R1.337 C=C(F)CNCCc1ccccc1 2230a_100000106460_100009893438 [0,0,0,0,0,3|1,0,0]=4 23401 B13R1.337 C=C(F)CNCCc1ccccc1 34a_100000106460_100009893438 [0,0,0,0,0,3|1,0,0]=4 23402 B13R1.337 C=C(F)COCCc1ccccc1 34a_100000210268_100009893438 [0,0,0,0,0,3|1,0,0]=4 23403 B13R1.337 C=C(F)COCCc1ccccc1 34a_200010262243_100000765856 [0,0,0,0,0,3|1,0,0]=4 23404 B13R1.337 C=C(F)COCCc1ccccc1 7a_100000210268_100000042424 [0,0,0,0,0,3|1,0,0]=4 23405 B13R1.337 C=C(F)CSCCc1ccccc1 62a_100000042424_100011218657 [0,0,0,0,0,3|1,0,0]=4 23406 B13R1.337 C=C(F)CSCCc1ccccc1 62a_100000765856_100000042424 [0,0,0,0,0,3|1,0,0]=4 23407 B13R1.337 C=C(F)CSCSc1ccccc1 62a_100000042424_100011218342 [0,0,0,0,0,3|1,0,0]=4 23408 B13R1.337 C=C(F)CSCSc1ccccc1 62a_100011218342_100000042424 [0,0,0,0,0,3|1,0,0]=4 23409 B13R1.337 CC(=CCCNc1ccccc1)C 34a_100000106764_100011217483 [0,0,0,0,0,3|0,0,1]=4 23410 B13R1.337 CC(=CCCOc1ccccc1)C 34a_100000210340_100011217483 [0,0,0,0,0,3|0,0,1]=4 23411 B13R1.337 CC(=CCCOc1ccccc1)C 7a_100000210340_100011217483 [0,0,0,0,0,3|0,0,1]=4 23412 B13R1.337 CC(=CCCSc1ccccc1)C 62a_100000719477_100011217483 [0,0,0,0,0,3|0,0,1]=4 23413 B13R1.337 CC(=CCCSc1ccccc1)C 62a_100011217483_100000041952 [0,0,0,0,0,3|0,0,1]=4 23414 B13R1.337 CC(=CCNCc1ccccc1)C 2230a_100015324214_100000761012 [0,0,0,0,0,3|0,0,1]=4 23415 B13R1.337 CC(=CCNCc1ccccc1)C 270004a_100000718196_100015611070 [0,0,0,0,0,3|0,0,1]=4 23416 B13R1.337 CC(=CCNCc1ccccc1)C 34a_100000718196_100015291786 [0,0,0,0,0,3|0,0,1]=4 23417 B13R1.337 CC(=CCNCc1ccccc1)C 34a_100015324214_100000761012 [0,0,0,0,0,3|0,0,1]=4 23418 B13R1.337 CC(=CCOCc1ccccc1)C 34a_100000210790_100000761012 [0,0,0,0,0,3|0,0,1]=4 23419 B13R1.337 CC(=CCOCc1ccccc1)C 34a_100000753907_100015291786 [0,0,0,0,0,3|0,0,1]=4 23420 B13R1.337 CC(=CCOCc1ccccc1)C 7a_100000210790_100000761012 [0,0,0,0,0,3|0,0,1]=4 23421 B13R1.337 CC(=CCSCc1ccccc1)C 62a_100000211182_100000761012 [0,0,0,0,0,3|0,0,1]=4 23422 B13R1.337 CC(=CCSCc1ccccc1)C 62a_100000761012_100015291786 [0,0,0,0,0,3|0,0,1]=4 23423 B13R1.337 CC(=O)C=CCCc1ccccc1 1458a_100016484021_200000210301 [0,0,0,0,0,3|1,0,0]=4 23424 B13R1.337 CC(=O)CCCCc1ccccc1 1458a_100000070787_100000701786 [0,0,0,0,0,3|1,0,0]=4 23425 B13R1.337 CC(=O)CCCCc1ccccc1 1458a_100011215911_200000210301 [0,0,0,0,0,3|1,0,0]=4 23426 B13R1.337 CC(=O)CCCNc1ccccc1 34a_100000106764_100000685027 [0,0,0,0,0,3|1,0,0]=4 23427 B13R1.337 CC(=O)CCCOc1ccccc1 1458a_100000070787_100000199009 [0,0,0,0,0,3|1,0,0]=4 23428 B13R1.337 CC(=O)CCCOc1ccccc1 1458a_100000212059_200000210301 [0,0,0,0,0,3|1,0,0]=4 23429 B13R1.337 CC(=O)CCCOc1ccccc1 34a_100000210340_100000685027 [0,0,0,0,0,3|1,0,0]=4 23430 B13R1.337 CC(=O)CCCOc1ccccc1 7a_100000210340_100011215641 [0,0,0,0,0,3|1,0,0]=4 23431 B13R1.337 CC(=O)CCCSc1ccccc1 1458a_100000070787_200011203293 [0,0,0,0,0,3|1,0,0]=4 23432 B13R1.337 CC(=O)CCCSc1ccccc1 1458a_100000182835_200000210301 [0,0,0,0,0,3|1,0,0]=4 23433 B13R1.337 CC(=O)CCCSc1ccccc1 62a_100000719477_100011215641 [0,0,0,0,0,3|1,0,0]=4 23434 B13R1.337 CC(=O)CCCSc1ccccc1 62a_100011215641_100000041952 [0,0,0,0,0,3|1,0,0]=4 23435 B13R1.337 CC(=O)CCOCc1ccccc1 1458a_100000070787_100000234347 [0,0,0,0,0,3|1,0,0]=4 23436 B13R1.337 CC(=O)CCOCc1ccccc1 1458a_100000743319_200000210301 [0,0,0,0,0,3|1,0,0]=4 23437 B13R1.337 CC(=O)CCOCc1ccccc1 34a_100000759926_100015291786 [0,0,0,0,0,3|1,0,0]=4 23438 B13R1.337 CC(=O)CCOCc1ccccc1 7a_100000210790_100000053229 [0,0,0,0,0,3|1,0,0]=4 23439 B13R1.337 CC(=O)CCOCc1ccccc1 7a_100000759926_100000211182 [0,0,0,0,0,3|1,0,0]=4 23440 B13R1.337 CC(=O)CCSCc1ccccc1 1458a_100000070787_200011297719 [0,0,0,0,0,3|1,0,0]=4 23441 B13R1.337 CC(=O)CCSCc1ccccc1 1458a_100000173759_200000210301 [0,0,0,0,0,3|1,0,0]=4 23442 B13R1.337 CC(=O)CCSCc1ccccc1 62a_100000053229_100015291786 [0,0,0,0,0,3|1,0,0]=4 23443 B13R1.337 CC(=O)CCSCc1ccccc1 62a_100000211182_100000053229 [0,0,0,0,0,3|1,0,0]=4 23444 B13R1.337 CC(=O)COCCc1ccccc1 34a_100000211253_100000765856 [0,0,0,0,0,3|1,0,0]=4 23445 B13R1.337 CC(=O)NC/C=C/c1ccccc1 11a_100020603302_100015343762 [0,0,0,0,0,3|1,0,0]=4 23446 B13R1.337 CC(=O)NC/C=C/c1ccccc1 1626a_100020603302_100015343762 [0,0,0,0,0,3|1,0,0]=4 23447 B13R1.337 CC(=O)NC/C=C/c1ccccc1 240690a_100020603302_100015343762 [0,0,0,0,0,3|1,0,0]=4 23448 B13R1.337 CC(=O)NC/C=C/c1ccccc1 527a_100020603302_100103153847 [0,0,0,0,0,3|1,0,0]=4 23449 B13R1.337 CC(=O)NCC#Cc1ccccc1 11a_100000735379_100015343762 [0,0,0,0,0,3|1,0,0]=4 23450 B13R1.337 CC(=O)NCC#Cc1ccccc1 1626a_100000735379_100015343762 [0,0,0,0,0,3|1,0,0]=4 23451 B13R1.337 CC(=O)NCC#Cc1ccccc1 240690a_100000735379_100015343762 [0,0,0,0,0,3|1,0,0]=4 23452 B13R1.337 CC(=O)NCC#Cc1ccccc1 527a_100000735379_100103153847 [0,0,0,0,0,3|1,0,0]=4 23453 B13R1.337 CC(=O)NCCCc1ccccc1 11a_100000211184_100015343762 [0,0,0,0,0,3|1,0,0]=4 23454 B13R1.337 CC(=O)NCCCc1ccccc1 1626a_100000211184_100015343762 [0,0,0,0,0,3|1,0,0]=4 23455 B13R1.337 CC(=O)NCCCc1ccccc1 240690a_100000211184_100015343762 [0,0,0,0,0,3|1,0,0]=4 23456 B13R1.337 CC(=O)NCCCc1ccccc1 527a_100000211184_100103153847 [0,0,0,0,0,3|1,0,0]=4 23457 B13R1.337 CC(=O)NCCOc1ccccc1 11a_100000174943_100015343762 [0,0,0,0,0,3|1,0,0]=4 23458 B13R1.337 CC(=O)NCCOc1ccccc1 1626a_100000174943_100015343762 [0,0,0,0,0,3|1,0,0]=4 23459 B13R1.337 CC(=O)NCCOc1ccccc1 240690a_100000174943_100015343762 [0,0,0,0,0,3|1,0,0]=4 23460 B13R1.337 CC(=O)NCCOc1ccccc1 527a_100000174943_100103153847 [0,0,0,0,0,3|1,0,0]=4 23461 B13R1.337 CC(=O)NCCOc1ccccc1 7a_100000210340_100000189650 [0,0,0,0,0,3|1,0,0]=4 23462 B13R1.337 CC(=O)NCCSc1ccccc1 240690a_100000189519_100015343762 [0,0,0,0,0,3|1,0,0]=4 23463 B13R1.337 CC(=O)NCCSc1ccccc1 527a_100000189519_100103153847 [0,0,0,0,0,3|1,0,0]=4 23464 B13R1.337 CC(=O)NCCSc1ccccc1 62a_100000189650_100000041952 [0,0,0,0,0,3|1,0,0]=4 23465 B13R1.337 CC(=O)NCCSc1ccccc1 62a_100000719477_100000189650 [0,0,0,0,0,3|1,0,0]=4 23466 B13R1.337 CC(=O)NN=CCc1ccccc1 4a_100000189765_100000209964 [0,0,0,0,0,3|1,0,0]=4 23467 B13R1.337 CC(=O)NNCCc1ccccc1 22a_100000740470_100000070787 [0,0,0,0,0,3|1,0,0]=4 23468 B13R1.337 CC(=O)OCC=Cc1ccccc1 271570a_200000047263_100000210277 [0,0,0,0,0,3|1,0,0]=4 23469 B13R1.337 CC(=O)OCCNc1ccccc1 34a_100000106764_100009814007 [0,0,0,0,0,3|1,0,0]=4 23470 B13R1.337 CC(=O)OCCOc1ccccc1 34a_100000210340_100009814007 [0,0,0,0,0,3|1,0,0]=4 23471 B13R1.337 CC(=O)OCCOc1ccccc1 7a_100000210340_100009814007 [0,0,0,0,0,3|1,0,0]=4 23472 B13R1.337 CC(=O)OCCSc1ccccc1 62a_100000719477_100009814007 [0,0,0,0,0,3|1,0,0]=4 23473 B13R1.337 CC(=O)OCCSc1ccccc1 62a_100009814007_100000041952 [0,0,0,0,0,3|1,0,0]=4 23474 B13R1.337 CC(=O)OCNCc1ccccc1 34a_100015324214_100009813279 [0,0,0,0,0,3|1,0,0]=4 23475 B13R1.337 CC(=O)OCOCc1ccccc1 34a_100000210790_100009813279 [0,0,0,0,0,3|1,0,0]=4 23476 B13R1.337 CC(=O)OCSCc1ccccc1 62a_100000076356_100015291786 [0,0,0,0,0,3|1,0,0]=4 23477 B13R1.337 CC(=O)OCSCc1ccccc1 62a_100000211182_100000076356 [0,0,0,0,0,3|1,0,0]=4 23478 B13R1.337 [13CH3]C(=O)C=CCCc1ccccc1 1458a_100016484021_200025704644 [0,0,0,0,0,3|1,0,0]=4 23479 B13R1.337 [13CH3]C(=O)CCCCc1ccccc1 1458a_100011215911_200025704644 [0,0,0,0,0,3|1,0,0]=4 23480 B13R1.337 [13CH3]C(=O)CCCOc1ccccc1 1458a_100000212059_200025704644 [0,0,0,0,0,3|1,0,0]=4 23481 B13R1.337 [13CH3]C(=O)CCCSc1ccccc1 1458a_100000182835_200025704644 [0,0,0,0,0,3|1,0,0]=4 23482 B13R1.337 [13CH3]C(=O)CCOCc1ccccc1 1458a_100000743319_200025704644 [0,0,0,0,0,3|1,0,0]=4 23483 B13R1.337 [13CH3]C(=O)CCSCc1ccccc1 1458a_100000173759_200025704644 [0,0,0,0,0,3|1,0,0]=4