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