0 B15R1.1035 CCCCCC(=Cc1cncnc1)C#N 6a_100000749868_100011218096 [0,0,0,0,0,0|3,0,1]=4 1 B15R1.1035 CCCCCN(CC)Cc1ccccc1 2230a_100000186914_100000210326 [0,0,0,0,0,0|2,0,2]=4 2 B15R1.1035 CCCCCN(CC)Cc1ccccc1 269982a_100000186914_100000210215 [0,0,0,0,0,0|2,0,2]=4 3 B14R1.158 C#CCCCC(=O)Cc1ccccc1 1458a_100000690238_100015291786 [1,0,0,0,0,0|0,0,3]=4 4 B14R1.158 C#CCCCC(=O)Nc1ccccc1 11a_100000106764_100000690238 [1,0,0,0,0,0|1,0,2]=4 5 B14R1.158 C#CCCCC(=O)Nc1ccccc1 1626a_100000106764_100000690238 [1,0,0,0,0,0|1,0,2]=4 6 B14R1.158 C#CCCCC(=O)Nc1ccccc1 22a_100000106764_100000690238 [1,0,0,0,0,0|1,0,2]=4 7 B14R1.158 C#CCCCC(=O)Nc1ccccc1 527a_100000106764_100000690238 [1,0,0,0,0,0|1,0,2]=4 8 B14R1.158 C/C(=C\c1ccccc1)/COCCF 34a_200025717232_100011217306 [1,0,0,0,0,0|2,0,1]=4 9 B14R1.158 C/C(=C\c1ccccc1)/COCCF 7a_200025717232_100011217306 [1,0,0,0,0,0|2,0,1]=4 10 B14R1.158 C/C(=C\c1ccccc1)/COCCO 34a_200025717232_100000211926 [1,0,0,0,0,0|2,0,1]=4 11 B14R1.158 C/C(=C\c1ccccc1)/COCCO 7a_200025717232_100000211926 [1,0,0,0,0,0|2,0,1]=4 12 B14R1.158 C=CCCCC(=O)Cc1ccccc1 1458a_100000766728_100015291786 [1,0,0,0,0,0|0,0,3]=4 13 B14R1.158 C=CCCCC(=O)Nc1ccccc1 11a_100000106764_100000766728 [1,0,0,0,0,0|1,0,2]=4 14 B14R1.158 C=CCCCC(=O)Nc1ccccc1 1626a_100000106764_100000766728 [1,0,0,0,0,0|1,0,2]=4 15 B14R1.158 C=CCCCC(=O)Nc1ccccc1 22a_100000106764_100000766728 [1,0,0,0,0,0|1,0,2]=4 16 B14R1.158 C=CCCCC(=O)Nc1ccccc1 527a_100000106764_100000766728 [1,0,0,0,0,0|1,0,2]=4 17 B14R1.158 CC/C=C/CC(=O)Cc1ccccc1 1458a_100016274230_100015291786 [1,0,0,0,0,0|0,0,3]=4 18 B14R1.158 CC/C=C/CC(=O)Nc1ccccc1 11a_100000106764_100016274230 [1,0,0,0,0,0|1,0,2]=4 19 B14R1.158 CC/C=C/CC(=O)Nc1ccccc1 1626a_100000106764_100016274230 [1,0,0,0,0,0|1,0,2]=4 20 B14R1.158 CC/C=C/CC(=O)Nc1ccccc1 22a_100000106764_100016274230 [1,0,0,0,0,0|1,0,2]=4 21 B14R1.158 CC/C=C/CC(=O)Nc1ccccc1 527a_100000106764_100016274230 [1,0,0,0,0,0|1,0,2]=4 22 B14R1.158 CCCC#CC(=O)Cc1ccccc1 1458a_200011218047_100015291786 [1,0,0,0,0,0|0,0,3]=4 23 B14R1.158 CCCC#CC(=O)Nc1ccccc1 22a_100000106764_200011218047 [1,0,0,0,0,0|1,0,2]=4 24 B14R1.158 CCCC=CC(=O)Cc1ccccc1 1458a_100000212230_100015291786 [1,0,0,0,0,0|0,0,3]=4 25 B14R1.158 CCCC=CC(=O)Nc1ccccc1 11a_100000106764_100000212230 [1,0,0,0,0,0|1,0,2]=4 26 B14R1.158 CCCC=CC(=O)Nc1ccccc1 1626a_100000106764_100000212230 [1,0,0,0,0,0|1,0,2]=4 27 B14R1.158 CCCC=CC(=O)Nc1ccccc1 22a_100000106764_100000212230 [1,0,0,0,0,0|1,0,2]=4 28 B14R1.158 CCCCCC(=O)C[n+]1ccccc1 1458a_200000086051_100000210326 [1,0,0,0,0,0|1,0,1]=3 29 B14R1.158 CCCCCC(=O)Cc1ccccc1 1458a_100000212188_100015291786 [1,0,0,0,0,0|0,0,1]=2 30 B14R1.158 CCCCCC(=O)Cc1ccccn1 1458a_100000212188_100000721315 [1,0,0,0,0,0|1,0,1]=3 31 B14R1.158 CCCCCC(=O)Cc1ccccn1 1458a_100000233486_100000210326 [1,0,0,0,0,0|1,0,1]=3 32 B14R1.158 CCCCCC(=O)Cc1cccnc1 1458a_100000212188_100000733263 [1,0,0,0,0,0|1,0,1]=3 33 B14R1.158 CCCCCC(=O)Cc1cccnc1 1458a_100000737805_100000210326 [1,0,0,0,0,0|1,0,1]=3 34 B14R1.158 CCCCCC(=O)Cc1cccnn1 1458a_100000212188_100016990269 [1,0,0,0,0,0|2,0,1]=4 35 B14R1.158 CCCCCC(=O)Cc1ccncc1 1458a_100000212188_100000705612 [1,0,0,0,0,0|1,0,1]=3 36 B14R1.158 CCCCCC(=O)Cc1cnccn1 1458a_100000212188_100016995436 [1,0,0,0,0,0|2,0,1]=4 37 B14R1.158 CCCCCC(=O)Cc1cncnc1 1458a_100000212188_100015196519 [1,0,0,0,0,0|2,0,1]=4 38 B14R1.158 CCCCCC(=O)Cc1cncnc1 1458a_100000721575_100000210326 [1,0,0,0,0,0|2,0,1]=4 39 B14R1.158 CCCCCC(=O)Cc1ncccn1 1458a_100000212188_100000703007 [1,0,0,0,0,0|2,0,1]=4 40 B14R1.158 CCCCCC(=O)Nc1ccccc1 11a_100000106764_100000212188 [1,0,0,0,0,0|1,0,0]=2 41 B14R1.158 CCCCCC(=O)Nc1ccccc1 1626a_100000106764_100000212188 [1,0,0,0,0,0|1,0,0]=2 42 B14R1.158 CCCCCC(=O)Nc1ccccc1 22a_100000106764_100000212188 [1,0,0,0,0,0|1,0,0]=2 43 B14R1.158 CCCCCC(=O)Nc1ccccc1 527a_100000106764_100000212188 [1,0,0,0,0,0|1,0,0]=2 44 B14R1.158 CCCCCC(C)Nc1ccccc1 34a_100000106764_200011218191 [1,0,0,0,0,0|1,0,2]=4 45 B14R1.158 CCCCCC(C)Oc1ccccc1 34a_100000210340_200011218191 [1,0,0,0,0,0|1,0,2]=4 46 B14R1.158 CCCCCC(C)Oc1ccccc1 7a_100000210340_200011218191 [1,0,0,0,0,0|1,0,2]=4 47 B14R1.158 CCCCCC(C)Sc1ccccc1 62a_100000719477_200011218191 [1,0,0,0,0,0|1,0,2]=4 48 B14R1.158 CCCCCC(C)Sc1ccccc1 62a_200011218191_100000041952 [1,0,0,0,0,0|1,0,2]=4 49 B14R1.158 CCCCCN(C)Cc1ccccc1 2230a_100000186898_100000210326 [1,0,0,0,0,0|1,0,2]=4 50 B14R1.158 CCCCCN(C)Cc1ccccc1 2230a_100000223495_100015291786 [1,0,0,0,0,0|1,0,2]=4 51 B14R1.158 CCCCCN(C)Cc1ccccc1 269982a_100000186898_100000210215 [1,0,0,0,0,0|1,0,2]=4 52 B14R1.158 CCCCCN(C)Cc1ccccc1 269982a_100000223495_100000211182 [1,0,0,0,0,0|1,0,2]=4 53 B14R1.158 CCCCCN(C)Cc1ccccc1 270004a_100000223495_100015611070 [1,0,0,0,0,0|1,0,2]=4 54 B14R1.158 CCCCNC(=O)C[n+]1ccccc1 11a_100000102301_200000086051 [1,0,0,0,0,0|2,0,1]=4 55 B14R1.158 CCCCNC(=O)C[n+]1ccccc1 240690a_100000102301_200000086051 [1,0,0,0,0,0|2,0,1]=4 56 B14R1.158 CCCCNC(=O)C[n+]1ccccc1 527a_100000102301_200000086051 [1,0,0,0,0,0|2,0,1]=4 57 B14R1.158 CCCCNC(=O)Cc1ccccn1 11a_100000102301_100000233486 [1,0,0,0,0,0|2,0,1]=4 58 B14R1.158 CCCCNC(=O)Cc1cccnc1 11a_100000102301_100000737805 [1,0,0,0,0,0|2,0,1]=4 59 B14R1.158 CCCCNC(=O)Cc1cccnc1 240690a_100000102301_100000737805 [1,0,0,0,0,0|2,0,1]=4 60 B14R1.158 CCCCNC(=O)Cc1cccnc1 527a_100000102301_100000737805 [1,0,0,0,0,0|2,0,1]=4 61 B14R1.158 CCCCNC(=O)Cc1ccncc1 11a_100000102301_100011201483 [1,0,0,0,0,0|2,0,1]=4 62 B14R1.158 CCCCNC(=O)Cc1ccncc1 240690a_100000102301_100011201483 [1,0,0,0,0,0|2,0,1]=4 63 B14R1.158 CCCCNC(=O)Nc1ccccc1 2430a_100000106764_100000102301 [1,0,0,0,0,0|2,0,0]=3 64 B14R1.158 CCCOC/C(=C/c1ccccc1)/C 34a_200025717232_100000210303 [1,0,0,0,0,0|1,0,1]=3 65 B14R1.158 CCCOC/C(=C/c1ccccc1)/C 7a_200025717232_100000210303 [1,0,0,0,0,0|1,0,1]=3 66 B14R1.158 CCCOCC(=O)Cc1ccccc1 1458a_100000745993_100015291786 [1,0,0,0,0,0|1,0,1]=3 67 B14R1.158 CCCOCC(=O)Cc1ccccn1 1458a_100000745993_100000721315 [1,0,0,0,0,0|2,0,1]=4 68 B14R1.158 CCCOCC(=O)Cc1cccnc1 1458a_100000745993_100000733263 [1,0,0,0,0,0|2,0,1]=4 69 B14R1.158 CCCOCC(=O)Cc1ccncc1 1458a_100000745993_100000705612 [1,0,0,0,0,0|2,0,1]=4 70 B14R1.158 CCCOCC(=O)Nc1ccccc1 11a_100000106764_100000745993 [1,0,0,0,0,0|2,0,0]=3 71 B14R1.158 CCCOCC(=O)Nc1ccccc1 1626a_100000106764_100000745993 [1,0,0,0,0,0|2,0,0]=3 72 B14R1.158 CCCOCC(=O)Nc1ccccc1 22a_100000106764_100000745993 [1,0,0,0,0,0|2,0,0]=3 73 B14R1.158 CCCOCC(=O)Nc1ccccc1 34a_100000210258_100000182850 [1,0,0,0,0,0|2,0,0]=3 74 B14R1.158 CCCOCC(=O)Nc1ccccc1 34a_100000246334_100000210303 [1,0,0,0,0,0|2,0,0]=3 75 B14R1.158 CCCOCC(=O)Nc1ccccc1 527a_100000106764_100000745993 [1,0,0,0,0,0|2,0,0]=3 76 B14R1.158 CCCOCC(=O)Oc1ccccc1 34a_100000210258_100009813826 [1,0,0,0,0,0|2,0,0]=3 77 B14R1.158 CCCSCC(=O)Cc1ccccc1 1458a_100000217233_100015291786 [1,0,0,0,0,0|1,0,1]=3 78 B14R1.158 CCCSCC(=O)Cc1ccccc1 62a_100000210303_100000233483 [1,0,0,0,0,0|1,0,1]=3 79 B14R1.158 CCCSCC(=O)Cc1ccccc1 62a_100000233483_100000210303 [1,0,0,0,0,0|1,0,1]=3 80 B14R1.158 CCCSCC(=O)Cc1ccccn1 1458a_100000217233_100000721315 [1,0,0,0,0,0|2,0,1]=4 81 B14R1.158 CCCSCC(=O)Cc1cccnc1 1458a_100000217233_100000733263 [1,0,0,0,0,0|2,0,1]=4 82 B14R1.158 CCCSCC(=O)Cc1ccncc1 1458a_100000217233_100000705612 [1,0,0,0,0,0|2,0,1]=4 83 B14R1.158 CCCSCC(=O)Nc1ccccc1 11a_100000106764_100000217233 [1,0,0,0,0,0|2,0,0]=3 84 B14R1.158 CCCSCC(=O)Nc1ccccc1 1626a_100000106764_100000217233 [1,0,0,0,0,0|2,0,0]=3 85 B14R1.158 CCCSCC(=O)Nc1ccccc1 22a_100000106764_100000217233 [1,0,0,0,0,0|2,0,0]=3 86 B14R1.158 CCCSCC(=O)Nc1ccccc1 527a_100000106764_100000217233 [1,0,0,0,0,0|2,0,0]=3 87 B14R1.158 CCCSCC(=O)Nc1ccccc1 62a_100000210303_100000182850 [1,0,0,0,0,0|2,0,0]=3 88 B14R1.158 CCCSCC(=O)Nc1ccccc1 62a_100012148978_100000210303 [1,0,0,0,0,0|2,0,0]=3 89 B14R1.158 CCCSCC(=O)Nc1ccccn1 62a_100000210303_100020662008 [1,0,0,0,0,0|3,0,0]=4 90 B14R1.158 CCCSCC(=O)Nc1ccccn1 62a_100020662008_100000210303 [1,0,0,0,0,0|3,0,0]=4 91 B14R1.158 CCCSCC(=O)Nc1ccncc1 62a_100000210303_100000754145 [1,0,0,0,0,0|3,0,0]=4 92 B14R1.158 CCCSCC(=O)Oc1ccccc1 62a_100000210303_100009813826 [1,0,0,0,0,0|2,0,0]=3 93 B14R1.158 CCCSCC(=O)Oc1ccccc1 62a_100009813826_100000210303 [1,0,0,0,0,0|2,0,0]=3 94 B14R1.158 CCNCCC(=O)Nc1ccccc1 2230a_100015525214_100000242058 [1,0,0,0,0,0|2,0,0]=3 95 B14R1.158 CCNCCC(=O)Nc1cccnc1 2230a_100015525214_200015187043 [1,0,0,0,0,0|3,0,0]=4 96 B14R1.158 CCNCCC(=O)Nc1cccnc1 34a_100000748795_100000210202 [1,0,0,0,0,0|3,0,0]=4 97 B14R1.158 CCNCCC(=O)Oc1ccccc1 2230a_100015525214_200000035796 [1,0,0,0,0,0|2,0,0]=3 98 B14R1.158 CCOCCC(=O)C[n+]1ccccc1 1458a_200000086051_100011215890 [1,0,0,0,0,0|2,0,1]=4 99 B14R1.158 CCOCCC(=O)Cc1ccccc1 1458a_100000749530_100015291786 [1,0,0,0,0,0|1,0,1]=3 100 B14R1.158 CCOCCC(=O)Cc1ccccn1 1458a_100000233486_100011215890 [1,0,0,0,0,0|2,0,1]=4 101 B14R1.158 CCOCCC(=O)Cc1ccccn1 1458a_100000749530_100000721315 [1,0,0,0,0,0|2,0,1]=4 102 B14R1.158 CCOCCC(=O)Cc1cccnc1 1458a_100000737805_100011215890 [1,0,0,0,0,0|2,0,1]=4 103 B14R1.158 CCOCCC(=O)Cc1cccnc1 1458a_100000749530_100000733263 [1,0,0,0,0,0|2,0,1]=4 104 B14R1.158 CCOCCC(=O)Cc1ccncc1 1458a_100000749530_100000705612 [1,0,0,0,0,0|2,0,1]=4 105 B14R1.158 CCOCCC(=O)Nc1ccccc1 11a_100000106764_100000749530 [1,0,0,0,0,0|2,0,0]=3 106 B14R1.158 CCOCCC(=O)Nc1ccccc1 1626a_100000106764_100000749530 [1,0,0,0,0,0|2,0,0]=3 107 B14R1.158 CCOCCC(=O)Nc1ccccc1 22a_100000106764_100000749530 [1,0,0,0,0,0|2,0,0]=3 108 B14R1.158 CCOCCC(=O)Nc1ccccc1 34a_100121572206_100000242058 [1,0,0,0,0,0|2,0,0]=3 109 B14R1.158 CCOCCC(=O)Nc1ccccc1 527a_100000106764_100000749530 [1,0,0,0,0,0|2,0,0]=3 110 B14R1.158 CCSCCC(=O)C[n+]1ccccc1 1458a_200000086051_100000757381 [1,0,0,0,0,0|2,0,1]=4 111 B14R1.158 CCSCCC(=O)Cc1ccccc1 1458a_100000230768_100015291786 [1,0,0,0,0,0|1,0,1]=3 112 B14R1.158 CCSCCC(=O)Cc1ccccn1 1458a_100000230768_100000721315 [1,0,0,0,0,0|2,0,1]=4 113 B14R1.158 CCSCCC(=O)Cc1ccccn1 1458a_100000233486_100000757381 [1,0,0,0,0,0|2,0,1]=4 114 B14R1.158 CCSCCC(=O)Cc1cccnc1 1458a_100000230768_100000733263 [1,0,0,0,0,0|2,0,1]=4 115 B14R1.158 CCSCCC(=O)Cc1cccnc1 1458a_100000737805_100000757381 [1,0,0,0,0,0|2,0,1]=4 116 B14R1.158 CCSCCC(=O)Cc1ccncc1 1458a_100000230768_100000705612 [1,0,0,0,0,0|2,0,1]=4 117 B14R1.158 CCSCCC(=O)Nc1ccccc1 11a_100000106764_100000230768 [1,0,0,0,0,0|2,0,0]=3 118 B14R1.158 CCSCCC(=O)Nc1ccccc1 1626a_100000106764_100000230768 [1,0,0,0,0,0|2,0,0]=3 119 B14R1.158 CCSCCC(=O)Nc1ccccc1 22a_100000106764_100000230768 [1,0,0,0,0,0|2,0,0]=3 120 B14R1.158 CCSCCC(=O)Nc1ccccc1 527a_100000106764_100000230768 [1,0,0,0,0,0|2,0,0]=3 121 B14R1.158 CCSCCC(=O)Nc1ccccc1 62a_100000210202_100000242058 [1,0,0,0,0,0|2,0,0]=3 122 B14R1.158 CCSCCC(=O)Nc1cccnc1 62a_100000210202_200015187043 [1,0,0,0,0,0|3,0,0]=4 123 B14R1.158 CCSCCC(=O)Oc1ccccc1 62a_100000210202_200000035796 [1,0,0,0,0,0|2,0,0]=3 124 B14R1.158 CNCCCC(=O)Nc1ccccc1 2230a_106832991635_100011194425 [1,0,0,0,0,0|2,0,0]=3 125 B14R1.158 CNCCCC(=O)Nc1ccccc1 34a_100000750157_200000210301 [1,0,0,0,0,0|2,0,0]=3 126 B14R1.158 CNCCCC(=O)Nc1ccccc1 34a_100102657272_100011194425 [1,0,0,0,0,0|2,0,0]=3 127 B14R1.158 CNCCCC(=O)Nc1ccccc1 7a_106832991635_100011194425 [1,0,0,0,0,0|2,0,0]=3 128 B14R1.158 COCCCC(=O)C[n+]1ccccc1 1458a_200000086051_100000740836 [1,0,0,0,0,0|2,0,1]=4 129 B14R1.158 COCCCC(=O)Cc1ccccc1 1458a_100000741012_100015291786 [1,0,0,0,0,0|1,0,1]=3 130 B14R1.158 COCCCC(=O)Cc1ccccn1 1458a_100000233486_100000740836 [1,0,0,0,0,0|2,0,1]=4 131 B14R1.158 COCCCC(=O)Cc1ccccn1 1458a_100000741012_100000721315 [1,0,0,0,0,0|2,0,1]=4 132 B14R1.158 COCCCC(=O)Cc1cccnc1 1458a_100000737805_100000740836 [1,0,0,0,0,0|2,0,1]=4 133 B14R1.158 COCCCC(=O)Cc1cccnc1 1458a_100000741012_100000733263 [1,0,0,0,0,0|2,0,1]=4 134 B14R1.158 COCCCC(=O)Cc1ccncc1 1458a_100000741012_100000705612 [1,0,0,0,0,0|2,0,1]=4 135 B14R1.158 COCCCC(=O)Nc1ccccc1 11a_100000106764_100000741012 [1,0,0,0,0,0|2,0,0]=3 136 B14R1.158 COCCCC(=O)Nc1ccccc1 1626a_100000106764_100000741012 [1,0,0,0,0,0|2,0,0]=3 137 B14R1.158 COCCCC(=O)Nc1ccccc1 22a_100000106764_100000741012 [1,0,0,0,0,0|2,0,0]=3 138 B14R1.158 COCCCC(=O)Nc1ccccc1 34a_100138415774_100011194425 [1,0,0,0,0,0|2,0,0]=3 139 B14R1.158 COCCCC(=O)Nc1ccccc1 527a_100000106764_100000741012 [1,0,0,0,0,0|2,0,0]=3 140 B14R1.158 COCCNC(=O)Nc1ccccc1 2430a_100000106764_100000209980 [1,0,0,0,0,0|3,0,0]=4 141 B14R1.158 COCSCC(=O)Cc1ccccc1 62a_100000233483_100000766300 [1,0,0,0,0,0|2,0,1]=4 142 B14R1.158 COCSCC(=O)Cc1ccccc1 62a_100000766300_100000233483 [1,0,0,0,0,0|2,0,1]=4 143 B14R1.158 COCSCC(=O)Nc1ccccc1 62a_100000766300_100000182850 [1,0,0,0,0,0|3,0,0]=4 144 B14R1.158 COCSCC(=O)Nc1ccccc1 62a_100012148978_100000766300 [1,0,0,0,0,0|3,0,0]=4 145 B14R1.158 COCSCC(=O)Oc1ccccc1 62a_100000766300_100009813826 [1,0,0,0,0,0|3,0,0]=4 146 B14R1.158 COCSCC(=O)Oc1ccccc1 62a_100009813826_100000766300 [1,0,0,0,0,0|3,0,0]=4 147 B14R1.158 CSCCCC(=O)Cc1ccccc1 1458a_100000173376_100015291786 [1,0,0,0,0,0|1,0,1]=3 148 B14R1.158 CSCCCC(=O)Cc1ccccn1 1458a_100000173376_100000721315 [1,0,0,0,0,0|2,0,1]=4 149 B14R1.158 CSCCCC(=O)Cc1cccnc1 1458a_100000173376_100000733263 [1,0,0,0,0,0|2,0,1]=4 150 B14R1.158 CSCCCC(=O)Cc1ccncc1 1458a_100000173376_100000705612 [1,0,0,0,0,0|2,0,1]=4 151 B14R1.158 CSCCCC(=O)Nc1ccccc1 11a_100000106764_100000173376 [1,0,0,0,0,0|2,0,0]=3 152 B14R1.158 CSCCCC(=O)Nc1ccccc1 1626a_100000106764_100000173376 [1,0,0,0,0,0|2,0,0]=3 153 B14R1.158 CSCCCC(=O)Nc1ccccc1 22a_100000106764_100000173376 [1,0,0,0,0,0|2,0,0]=3 154 B14R1.158 CSCCCC(=O)Nc1ccccc1 527a_100000106764_100000173376 [1,0,0,0,0,0|2,0,0]=3 155 B14R1.158 CSCCCC(=O)Nc1ccccc1 62a_200000210301_100011194425 [1,0,0,0,0,0|2,0,0]=3 156 B14R1.158 CSCCNC(=O)Nc1ccccc1 2430a_100000106764_100020590264 [1,0,0,0,0,0|3,0,0]=4 157 B14R1.158 CSCOC/C(=C/c1ccccc1)/C 34a_200025717232_100011218213 [1,0,0,0,0,0|2,0,1]=4 158 B14R1.158 CSCOCC(=O)Nc1ccccc1 34a_100000246334_100011218213 [1,0,0,0,0,0|3,0,0]=4 159 B14R1.158 CSCSCC(=O)Cc1ccccc1 62a_100000233483_100011218213 [1,0,0,0,0,0|2,0,1]=4 160 B14R1.158 CSCSCC(=O)Cc1ccccc1 62a_100011218213_100000233483 [1,0,0,0,0,0|2,0,1]=4 161 B14R1.158 CSCSCC(=O)Nc1ccccc1 62a_100011218213_100000182850 [1,0,0,0,0,0|3,0,0]=4 162 B14R1.158 CSCSCC(=O)Nc1ccccc1 62a_100012148978_100011218213 [1,0,0,0,0,0|3,0,0]=4 163 B14R1.158 CSCSCC(=O)Oc1ccccc1 62a_100009813826_100011218213 [1,0,0,0,0,0|3,0,0]=4 164 B14R1.158 CSCSCC(=O)Oc1ccccc1 62a_100011218213_100009813826 [1,0,0,0,0,0|3,0,0]=4 165 B14R1.158 N#CCCCC(=O)Cc1ccccc1 1458a_100000075515_100015291786 [1,0,0,0,0,0|1,0,2]=4 166 B14R1.158 N#CCCCC(=O)Nc1ccccc1 11a_100000106764_100000075515 [1,0,0,0,0,0|2,0,1]=4 167 B14R1.158 N#CCCCC(=O)Nc1ccccc1 1626a_100000106764_100000075515 [1,0,0,0,0,0|2,0,1]=4 168 B14R1.158 N#CCCCC(=O)Nc1ccccc1 22a_100000106764_100000075515 [1,0,0,0,0,0|2,0,1]=4 169 B14R1.158 N#CCCCC(=O)Nc1ccccc1 527a_100000106764_100000075515 [1,0,0,0,0,0|2,0,1]=4 170 B14R1.158 NCCOCC(=O)Nc1ccccc1 34a_100000210304_100000182850 [1,0,0,0,0,0|3,0,0]=4 171 B14R1.158 NCCOCC(=O)Oc1ccccc1 34a_100000210304_100009813826 [1,0,0,0,0,0|3,0,0]=4 172 B14R1.158 O=C(CCCCF)C[n+]1ccccc1 1458a_200000086051_100000729493 [1,0,0,0,0,0|2,0,1]=4 173 B14R1.158 O=C(CCCCF)Cc1ccccn1 1458a_100000233486_100000729493 [1,0,0,0,0,0|2,0,1]=4 174 B14R1.158 O=C(CCCCF)Cc1cccnc1 1458a_100000737805_100000729493 [1,0,0,0,0,0|2,0,1]=4 175 B14R1.158 O=C(CCCCO)C[n+]1ccccc1 1458a_200000086051_100000210776 [1,0,0,0,0,0|2,0,1]=4 176 B14R1.158 O=C(CCCCO)Cc1ccccc1 1458a_100000695505_100015291786 [1,0,0,0,0,0|1,0,1]=3 177 B14R1.158 O=C(CCCCO)Cc1ccccn1 1458a_100000233486_100000210776 [1,0,0,0,0,0|2,0,1]=4 178 B14R1.158 O=C(CCCCO)Cc1ccccn1 1458a_100000695505_100000721315 [1,0,0,0,0,0|2,0,1]=4 179 B14R1.158 O=C(CCCCO)Cc1cccnc1 1458a_100000695505_100000733263 [1,0,0,0,0,0|2,0,1]=4 180 B14R1.158 O=C(CCCCO)Cc1cccnc1 1458a_100000737805_100000210776 [1,0,0,0,0,0|2,0,1]=4 181 B14R1.158 O=C(CCCCO)Cc1ccncc1 1458a_100000695505_100000705612 [1,0,0,0,0,0|2,0,1]=4 182 B14R1.158 O=C(CCCCO)Nc1ccccc1 1626a_100000106764_100000695505 [1,0,0,0,0,0|2,0,0]=3 183 B14R1.158 O=C(CCSCF)Nc1ccccc1 62a_100015361967_100000242058 [1,0,0,0,0,0|3,0,0]=4 184 B14R1.158 O=C(CCSCF)Oc1ccccc1 62a_100015361967_200000035796 [1,0,0,0,0,0|3,0,0]=4 185 B14R1.158 O=C(CNCCF)Nc1ccccc1 34a_100000724931_100000182850 [1,0,0,0,0,0|3,0,0]=4 186 B14R1.158 O=C(CNCCF)Oc1ccccc1 34a_100000724931_100009813826 [1,0,0,0,0,0|3,0,0]=4 187 B14R1.158 O=C(CNCCO)Cc1ccccc1 2230a_100016997473_100000233483 [1,0,0,0,0,0|2,0,1]=4 188 B14R1.158 O=C(CNCCO)Nc1ccccc1 2230a_100016997473_100000182850 [1,0,0,0,0,0|3,0,0]=4 189 B14R1.158 O=C(CNCCO)Nc1ccccc1 34a_100016990907_100000182850 [1,0,0,0,0,0|3,0,0]=4 190 B14R1.158 O=C(CNCCO)Oc1ccccc1 2230a_100016997473_100009813826 [1,0,0,0,0,0|3,0,0]=4 191 B14R1.158 O=C(CNCCO)Oc1ccccc1 34a_100016990907_100009813826 [1,0,0,0,0,0|3,0,0]=4 192 B14R1.158 O=C(COCCBr)Nc1ccccc1 34a_100000211926_100000182850 [1,0,0,0,0,0|3,0,0]=4 193 B14R1.158 O=C(COCCBr)Oc1ccccc1 34a_100000211926_100009813826 [1,0,0,0,0,0|3,0,0]=4 194 B14R1.158 O=C(COCCF)Nc1ccccc1 34a_100000246334_100011217306 [1,0,0,0,0,0|3,0,0]=4 195 B14R1.158 O=C(COCCO)Cc1ccccc1 1458a_100000708028_100015291786 [1,0,0,0,0,0|2,0,1]=4 196 B14R1.158 O=C(COCCO)Nc1ccccc1 1626a_100000106764_100000708028 [1,0,0,0,0,0|3,0,0]=4 197 B14R1.158 O=C(COCCO)Nc1ccccc1 34a_100000246334_100000211926 [1,0,0,0,0,0|3,0,0]=4 198 B14R1.158 O=C(CSCCF)Cc1ccccc1 62a_100000233483_100011217306 [1,0,0,0,0,0|2,0,1]=4 199 B14R1.158 O=C(CSCCF)Cc1ccccc1 62a_100011217306_100000233483 [1,0,0,0,0,0|2,0,1]=4 200 B14R1.158 O=C(CSCCF)Nc1ccccc1 62a_100011217306_100000182850 [1,0,0,0,0,0|3,0,0]=4 201 B14R1.158 O=C(CSCCF)Nc1ccccc1 62a_100012148978_100011217306 [1,0,0,0,0,0|3,0,0]=4 202 B14R1.158 O=C(CSCCF)Oc1ccccc1 62a_100009813826_100011217306 [1,0,0,0,0,0|3,0,0]=4 203 B14R1.158 O=C(CSCCF)Oc1ccccc1 62a_100011217306_100009813826 [1,0,0,0,0,0|3,0,0]=4 204 B14R1.158 O=C(CSCCO)Cc1ccccc1 62a_100000211926_100000233483 [1,0,0,0,0,0|2,0,1]=4 205 B14R1.158 O=C(CSCCO)Cc1ccccc1 62a_100000233483_100000211926 [1,0,0,0,0,0|2,0,1]=4 206 B14R1.158 O=C(CSCCO)Nc1ccccc1 62a_100000211926_100000182850 [1,0,0,0,0,0|3,0,0]=4 207 B14R1.158 O=C(CSCCO)Nc1ccccc1 62a_100012148978_100000211926 [1,0,0,0,0,0|3,0,0]=4 208 B14R1.158 O=C(CSCCO)Oc1ccccc1 62a_100000211926_100009813826 [1,0,0,0,0,0|3,0,0]=4 209 B14R1.158 O=C(CSCCO)Oc1ccccc1 62a_100009813826_100000211926 [1,0,0,0,0,0|3,0,0]=4 210 B14R1.158 O=C(NCCCF)Nc1ccccc1 2430a_100000106764_100015189416 [1,0,0,0,0,0|3,0,0]=4 211 B14R1.158 O=C(NCCCO)Nc1ccccc1 2430a_100000106764_100000182051 [1,0,0,0,0,0|3,0,0]=4 212 B14R1.158 [13CH3]NCCCC(=O)Nc1ccccc1 34a_100000750157_200025704644 [1,0,0,0,0,0|2,0,0]=3 213 B14R1.158 [13CH3]SCCCC(=O)Nc1ccccc1 62a_200025704644_100011194425 [1,0,0,0,0,0|2,0,0]=3 214 B16R1.126 CCCCC(=O)C(=Cc1ccccc1)C#N 1458a_100000162679_100000210211 [0,1,0,0,0,0|1,0,2]=4 215 B16R1.1230 CCCCCC(=Cc1ccc(cc1)Br)C#N 6a_100000186029_100011218096 [0,1,0,0,0,0|1,0,1]=3 216 B16R1.1230 CCCCCC(=Cc1ccc(cc1)F)C#N 6a_100000210084_100011218096 [0,1,0,0,0,0|1,0,1]=3 217 B16R1.1230 CCCCCC(=Cc1ccc(cc1)I)C#N 6a_100000188517_100011218096 [0,1,0,0,0,0|1,0,1]=3 218 B16R1.1230 CCCCCC(=Cc1ccc(cn1)Br)C#N 6a_100000754260_100011218096 [0,1,0,0,0,0|2,0,1]=4 219 B16R1.1230 CCCCCC(=Cc1ccc(cn1)F)C#N 6a_100011934744_100011218096 [0,1,0,0,0,0|2,0,1]=4 220 B16R1.1230 COCCCC(=Cc1ccc(cc1)Br)C#N 6a_100000186029_100000747464 [0,1,0,0,0,0|2,0,1]=4 221 B16R1.1230 COCCCC(=Cc1ccc(cc1)F)C#N 6a_100000210084_100000747464 [0,1,0,0,0,0|2,0,1]=4 222 B16R1.1230 COCCCC(=Cc1ccc(cc1)I)C#N 6a_100000188517_100000747464 [0,1,0,0,0,0|2,0,1]=4 223 B16R1.1230 N#CC(=Cc1ccc(cc1)Br)CCCCBr 6a_100000186029_100009813376 [0,1,0,0,0,0|2,0,1]=4 224 B16R1.1230 N#CC(=Cc1ccc(cc1)F)CCCCBr 6a_100000210084_100009813376 [0,1,0,0,0,0|2,0,1]=4 225 B16R1.1230 N#CC(=Cc1ccc(cc1)I)CCCCBr 6a_100000188517_100009813376 [0,1,0,0,0,0|2,0,1]=4 226 B16R1.1231 CCCCCC(=Cc1cccc(c1)Br)C#N 6a_100000210085_100011218096 [0,1,0,0,0,0|1,0,1]=3 227 B16R1.1231 CCCCCC(=Cc1cccc(c1)F)C#N 6a_100000210812_100011218096 [0,1,0,0,0,0|1,0,1]=3 228 B16R1.1231 CCCCCC(=Cc1cccc(c1)I)C#N 6a_100000014684_100011218096 [0,1,0,0,0,0|1,0,1]=3 229 B16R1.1231 CCCCCC(=Cc1cncc(c1)Br)C#N 6a_100000687066_100011218096 [0,1,0,0,0,0|2,0,1]=4 230 B16R1.1231 CCCCCC(=Cc1cncc(c1)C)C#N 6a_100011998712_100011218096 [0,1,0,0,0,0|2,0,1]=4 231 B16R1.1231 CCCCCC(=Cc1cncc(c1)Cl)C#N 6a_100000088910_100011218096 [0,1,0,0,0,0|2,0,1]=4 232 B16R1.1231 CCCCCC(=Cc1cncc(c1)F)C#N 6a_100011361476_100011218096 [0,1,0,0,0,0|2,0,1]=4 233 B16R1.1231 COCCCC(=Cc1cccc(c1)Br)C#N 6a_100000210085_100000747464 [0,1,0,0,0,0|2,0,1]=4 234 B16R1.1231 COCCCC(=Cc1cccc(c1)F)C#N 6a_100000210812_100000747464 [0,1,0,0,0,0|2,0,1]=4 235 B16R1.1231 COCCCC(=Cc1cccc(c1)I)C#N 6a_100000014684_100000747464 [0,1,0,0,0,0|2,0,1]=4 236 B16R1.1231 N#CC(=Cc1cccc(c1)Br)CCCCBr 6a_100000210085_100009813376 [0,1,0,0,0,0|2,0,1]=4 237 B16R1.1231 N#CC(=Cc1cccc(c1)F)CCCCBr 6a_100000210812_100009813376 [0,1,0,0,0,0|2,0,1]=4 238 B16R1.1231 N#CC(=Cc1cccc(c1)I)CCCCBr 6a_100000014684_100009813376 [0,1,0,0,0,0|2,0,1]=4 239 B16R1.1438 C=CCN(CCCCC)Cc1ccccc1 2230a_100000196212_100000210326 [0,1,0,0,0,0|2,0,1]=4 240 B16R1.1438 C=CCN(CCCCC)Cc1ccccc1 269982a_100000196212_100000210215 [0,1,0,0,0,0|2,0,1]=4 241 B16R1.1438 CCCCC/C(=C\c1ccccc1)/COC 34a_200020681711_200000210301 [0,1,0,0,0,0|0,0,2]=3 242 B16R1.1438 CCCCC/C(=C\c1ccccc1)/COC 7a_200020681711_200000210301 [0,1,0,0,0,0|0,0,2]=3 243 B16R1.1438 CCCCC/C(=C\c1ccccc1)/CO[13CH3] 34a_200020681711_200025704644 [0,1,0,0,0,0|0,0,2]=3 244 B16R1.1438 CCCCC/C(=C\c1ccccc1)/CO[13CH3] 7a_200020681711_200025704644 [0,1,0,0,0,0|0,0,2]=3 245 B16R1.1438 COCCCN(CC=O)Cc1ccccc1 2230a_100000707625_200015260668 [0,1,0,0,0,0|2,0,1]=4 246 B16R1.1438 COCCCN(CC=O)Cc1ccccc1 269982a_100000707625_200015260668 [0,1,0,0,0,0|2,0,1]=4 247 B16R1.1438 O=CCN(CCCCO)Cc1ccccc1 2230a_100000186360_200015260668 [0,1,0,0,0,0|2,0,1]=4 248 B16R1.1438 O=CCN(CCCCO)Cc1ccccc1 269982a_100000186360_200015260668 [0,1,0,0,0,0|2,0,1]=4 249 B16R1.1759 CC(=O)N(CCCCO)Cc1ccccc1 240690a_100000186360_100015343762 [0,1,0,0,0,0|2,0,1]=4 250 B16R1.1759 CC(=O)N(CCCCO)Cc1ccccc1 527a_100000186360_100103153847 [0,1,0,0,0,0|2,0,1]=4 251 B16R1.1759 CCCCNC(Cc1ccccc1)C(=O)N 2230a_100000745710_100000210211 [0,1,0,0,0,0|1,0,2]=4 252 B16R1.1759 CCCCNC(Cc1ccccc1)C(=O)N 34a_100000745710_100000210210 [0,1,0,0,0,0|1,0,2]=4 253 B16R1.1759 COCCCN(Cc1ccccc1)C(=O)C 11a_100000707625_100015343762 [0,1,0,0,0,0|2,0,1]=4 254 B16R1.1759 COCCCN(Cc1ccccc1)C(=O)C 1626a_100000707625_100015343762 [0,1,0,0,0,0|2,0,1]=4 255 B16R1.1759 COCCCN(Cc1ccccc1)C(=O)C 240690a_100000707625_100015343762 [0,1,0,0,0,0|2,0,1]=4 256 B16R1.1759 COCCCN(Cc1ccccc1)C(=O)C 527a_100000707625_100103153847 [0,1,0,0,0,0|2,0,1]=4 257 B16R2.69 O=C1CCCCCC1Oc2ccccc2 7a_100000210340_100000243696 [0,0,0,1,0,0|1,0,1]=3 258 B16R2.69 O=C1CCCCCC1Oc2cccnc2 7a_100000210849_100000243696 [0,0,0,1,0,0|2,0,1]=4 259 B16R2.69 O=C1CCCCCC1Sc2ccccc2 62a_100000243696_100000041952 [0,0,0,1,0,0|1,0,1]=3 260 B16R2.69 O=C1CCCCCC1Sc2ccccc2 62a_100000719477_100000243696 [0,0,0,1,0,0|1,0,1]=3 261 B16R2.69 O=C1CCCCCC1Sc2ccccn2 62a_100000243696_100011216584 [0,0,0,1,0,0|2,0,1]=4 262 B16R2.69 O=C1CCCCCC1Sc2ccccn2 62a_100011216584_100000243696 [0,0,0,1,0,0|2,0,1]=4 263 B16R2.69 O=C1CCCCCC1Sc2cccnc2 62a_100000210063_100000243696 [0,0,0,1,0,0|2,0,1]=4 264 B16R2.69 O=C1CCCCCC1Sc2cccnc2 62a_100000243696_100000210063 [0,0,0,1,0,0|2,0,1]=4 265 B16R2.69 O=C1CCCCCC1Sc2ccncc2 62a_100000243696_100000728582 [0,0,0,1,0,0|2,0,1]=4 266 B16R2.69 O=C1CCCCCC1Sc2ccncc2 62a_100000728582_100000243696 [0,0,0,1,0,0|2,0,1]=4 267 B16R2.69 O=C1NCCCCC1Oc2ccccc2 7a_100000210340_100000735217 [0,0,0,1,0,0|2,0,1]=4 268 B16R2.69 O=C1NCCCCC1Sc2ccccc2 62a_100000719477_100000735217 [0,0,0,1,0,0|2,0,1]=4 269 B16R2.69 O=C1NCCCCC1Sc2ccccc2 62a_100000735217_100000041952 [0,0,0,1,0,0|2,0,1]=4 270 B16R2.112 CCCCc1c(sc2c1cccc2)C=O 271570a_100020621405_100009816528 [0,0,0,1,0,0|1,0,1]=3 271 B16R2.2272 CCCCOc1cc2ccccc2n1C 34a_100000066695_100000210210 [0,0,0,1,0,0|3,0,0]=4 272 B16R2.2272 CCCCSC1Cc2ccccc2C1=O 62a_100000210211_100011218503 [0,0,0,1,0,0|1,0,2]=4 273 B16R2.2272 CCCCSC1Cc2ccccc2C1=O 62a_100011218503_100000210210 [0,0,0,1,0,0|1,0,2]=4 274 B16R2.2272 CCCNCc1[nH]c2ccccc2c1C 270004a_100020643023_100000066550 [0,0,0,1,0,0|3,0,0]=4 275 B16R2.2272 CCCNCc1[nH]c2ccccc2c1Cl 270004a_100020643023_100000050720 [0,0,0,1,0,0|3,0,0]=4 276 B16R2.2272 CCCNCc1cc2ccccc2n1C 270004a_100020643023_100000033373 [0,0,0,1,0,0|3,0,0]=4 277 B16R2.2272 CCCNCc1oc2ccccc2c1C 207a_100020643023_100000077534 [0,0,0,1,0,0|3,0,0]=4 278 B16R2.2272 CCCNCc1oc2ccccc2c1C 2230a_100153394726_100000210303 [0,0,0,1,0,0|3,0,0]=4 279 B16R2.2272 CCCNCc1oc2ccccc2c1C 270004a_100020643023_100000077534 [0,0,0,1,0,0|3,0,0]=4 280 B16R2.2272 CCCNCc1oc2ccccc2c1C 34a_100153394726_100000210303 [0,0,0,1,0,0|3,0,0]=4 281 B16R2.2272 CCCNCc1sc2ccccc2c1Br 207a_100020643023_100009816528 [0,0,0,1,0,0|3,0,0]=4 282 B16R2.2272 CCCNCc1sc2ccccc2c1C 207a_100020643023_100000038699 [0,0,0,1,0,0|3,0,0]=4 283 B16R2.2272 CCCNCc1sc2ccccc2c1C 270004a_100020643023_100000038699 [0,0,0,1,0,0|3,0,0]=4 284 B16R2.2272 CCCNCc1sc2ccccc2c1Cl 207a_100020643023_100000017830 [0,0,0,1,0,0|3,0,0]=4 285 B16R2.2272 CCCNCc1sc2ccccc2c1Cl 2230a_200015185765_100000210303 [0,0,0,1,0,0|3,0,0]=4 286 B16R2.2272 CCCNCc1sc2ccccc2c1Cl 270004a_100020643023_100000017830 [0,0,0,1,0,0|3,0,0]=4 287 B16R2.2272 CCCOCc1cc2ccccc2n1C 34a_100000081300_100000210303 [0,0,0,1,0,0|3,0,0]=4 288 B16R2.2272 CCCOCc1sc2ccccc2c1Cl 34a_100000210258_100000021718 [0,0,0,1,0,0|3,0,0]=4 289 B16R2.2441 BrCCOCc1ccc2ccccc2c1 34a_100000211926_100011216711 [0,0,0,1,0,0|3,0,0]=4 290 B16R2.2441 CCCC=Cc1ccc2ccccc2c1 271570a_100016258520_100000233703 [0,0,0,1,0,0|1,0,2]=4 291 B16R2.2441 CCCC=Cc1cnc2ccccc2c1 271570a_100016258520_100000737414 [0,0,0,1,0,0|1,0,2]=4 292 B16R2.2441 CCCCNc1ccc2ccccc2c1 34a_100000211940_100000210210 [0,0,0,1,0,0|2,0,0]=3 293 B16R2.2441 CCCCNc1ccc2ccccc2c1 7a_100000211940_100000210211 [0,0,0,1,0,0|2,0,0]=3 294 B16R2.2441 CCCCNc1ccc2ccccc2n1 27a_100000102301_100011291633 [0,0,0,1,0,0|3,0,0]=4 295 B16R2.2441 CCCCNc1ccc2cccnc2c1 34a_100102887122_100000210210 [0,0,0,1,0,0|3,0,0]=4 296 B16R2.2441 CCCCNc1ccc2cnccc2c1 34a_100000039641_100000210210 [0,0,0,1,0,0|3,0,0]=4 297 B16R2.2441 CCCCNc1ccc2ncccc2c1 34a_100011198106_100000210210 [0,0,0,1,0,0|3,0,0]=4 298 B16R2.2441 CCCCNc1cnc2ccccc2n1 27a_100000102301_100000756483 [0,0,0,1,0,0|3,0,0]=4 299 B16R2.2441 CCCCOc1ccc2ccccc2c1 34a_100000185828_100000210210 [0,0,0,1,0,0|2,0,0]=3 300 B16R2.2441 CCCCOc1ccc2ccccc2c1 7a_100000185828_100000210211 [0,0,0,1,0,0|2,0,0]=3 301 B16R2.2441 CCCCOc1ccc2cccnc2c1 34a_100011216045_100000210210 [0,0,0,1,0,0|3,0,0]=4 302 B16R2.2441 CCCCOc1ccc2ccncc2c1 7a_100000752006_100000210211 [0,0,0,1,0,0|3,0,0]=4 303 B16R2.2441 CCCCOc1ccc2cnccc2c1 34a_100000046372_100000210210 [0,0,0,1,0,0|3,0,0]=4 304 B16R2.2441 CCCCOc1ccc2cnccc2c1 7a_100000046372_100000210211 [0,0,0,1,0,0|3,0,0]=4 305 B16R2.2441 CCCCOc1ccc2ncccc2c1 34a_100011215586_100000210210 [0,0,0,1,0,0|3,0,0]=4 306 B16R2.2441 CCCCOc1ccc2ncccc2c1 7a_100011215586_100000210211 [0,0,0,1,0,0|3,0,0]=4 307 B16R2.2441 CCCCOc1cnc2ccccc2c1 34a_100011934006_100000210210 [0,0,0,1,0,0|2,0,0]=3 308 B16R2.2441 CCCCOc1cnc2ccccc2c1 7a_100011934006_100000210211 [0,0,0,1,0,0|2,0,0]=3 309 B16R2.2441 CCCCSc1cc2ccccc2cn1 62a_100000210211_100000047361 [0,0,0,1,0,0|3,0,0]=4 310 B16R2.2441 CCCCSc1cc2ccccc2cn1 62a_100009816522_100000210210 [0,0,0,1,0,0|3,0,0]=4 311 B16R2.2441 CCCCSc1ccc2ccccc2c1 62a_100000210211_100000233703 [0,0,0,1,0,0|2,0,0]=3 312 B16R2.2441 CCCCSc1ccc2ccccc2n1 62a_100000210211_100011291633 [0,0,0,1,0,0|3,0,0]=4 313 B16R2.2441 CCCCSc1ccc2ccccc2n1 62a_100011291633_100000210210 [0,0,0,1,0,0|3,0,0]=4 314 B16R2.2441 CCCCSc1ccc2cccnc2c1 62a_100000210211_100009816655 [0,0,0,1,0,0|3,0,0]=4 315 B16R2.2441 CCCCSc1ccc2ccncc2c1 62a_100000210211_100000686496 [0,0,0,1,0,0|3,0,0]=4 316 B16R2.2441 CCCCSc1ccc2ccncc2c1 62a_100000686496_100000210210 [0,0,0,1,0,0|3,0,0]=4 317 B16R2.2441 CCCCSc1ccc2cnccc2c1 62a_100000210211_100009816743 [0,0,0,1,0,0|3,0,0]=4 318 B16R2.2441 CCCCSc1ccc2cnccc2c1 62a_100009816743_100000210210 [0,0,0,1,0,0|3,0,0]=4 319 B16R2.2441 CCCCSc1ccc2ncccc2c1 62a_100000210211_100011215947 [0,0,0,1,0,0|3,0,0]=4 320 B16R2.2441 CCCCSc1ccc2ncccc2c1 62a_100011215947_100000210210 [0,0,0,1,0,0|3,0,0]=4 321 B16R2.2441 CCCCSc1cnc2ccccc2c1 62a_100000210211_100000737414 [0,0,0,1,0,0|2,0,0]=3 322 B16R2.2441 CCCCSc1cnc2ccccc2n1 62a_100000210211_100000756483 [0,0,0,1,0,0|3,0,0]=4 323 B16R2.2441 CCCCSc1cnc2ccccc2n1 62a_100000756483_100000210210 [0,0,0,1,0,0|3,0,0]=4 324 B16R2.2441 CCCCSc1cnc2cccnc2c1 62a_100000210211_100010246316 [0,0,0,1,0,0|3,0,0]=4 325 B16R2.2441 CCCCSc1cnc2cccnc2c1 62a_100010246316_100000210210 [0,0,0,1,0,0|3,0,0]=4 326 B16R2.2441 CCCNCC1=Cc2ccccc2OC1 270004a_100020643023_100000013085 [0,0,0,1,0,0|1,0,2]=4 327 B16R2.2441 CCCNCc1cc2ccccc2cn1 207a_100020643023_100000059776 [0,0,0,1,0,0|3,0,0]=4 328 B16R2.2441 CCCNCc1cc2ccccc2cn1 270004a_100020643023_100000059776 [0,0,0,1,0,0|3,0,0]=4 329 B16R2.2441 CCCNCc1ccc2ccccc2c1 207a_100020643023_100000211584 [0,0,0,1,0,0|2,0,0]=3 330 B16R2.2441 CCCNCc1ccc2ccccc2c1 2230a_100000739491_100000210303 [0,0,0,1,0,0|2,0,0]=3 331 B16R2.2441 CCCNCc1ccc2ccccc2c1 270004a_100020643023_100000211584 [0,0,0,1,0,0|2,0,0]=3 332 B16R2.2441 CCCNCc1ccc2ccccc2c1 34a_100000739491_100000210303 [0,0,0,1,0,0|2,0,0]=3 333 B16R2.2441 CCCNCc1ccc2ccccc2n1 207a_100020643023_100000759686 [0,0,0,1,0,0|3,0,0]=4 334 B16R2.2441 CCCNCc1ccc2ccccc2n1 270004a_100020643023_100000759686 [0,0,0,1,0,0|3,0,0]=4 335 B16R2.2441 CCCNCc1ccc2cccnc2c1 207a_100020643023_100011784159 [0,0,0,1,0,0|3,0,0]=4 336 B16R2.2441 CCCNCc1ccc2cccnc2c1 270004a_100020643023_100011784159 [0,0,0,1,0,0|3,0,0]=4 337 B16R2.2441 CCCNCc1ccc2cnccc2c1 207a_100020643023_100000068276 [0,0,0,1,0,0|3,0,0]=4 338 B16R2.2441 CCCNCc1ccc2cnccc2c1 270004a_100020643023_100000068276 [0,0,0,1,0,0|3,0,0]=4 339 B16R2.2441 CCCNCc1ccc2ncccc2c1 207a_100020643023_100000211315 [0,0,0,1,0,0|3,0,0]=4 340 B16R2.2441 CCCNCc1ccc2ncccc2c1 270004a_100020643023_100000211315 [0,0,0,1,0,0|3,0,0]=4 341 B16R2.2441 CCCNCc1ccc2ncccc2c1 34a_100000238500_100000210303 [0,0,0,1,0,0|3,0,0]=4 342 B16R2.2441 CCCNCc1cnc2ccccc2c1 207a_100020643023_100000750898 [0,0,0,1,0,0|2,0,0]=3 343 B16R2.2441 CCCNCc1cnc2ccccc2c1 270004a_100020643023_100000750898 [0,0,0,1,0,0|2,0,0]=3 344 B16R2.2441 CCCNCc1cnc2ccccc2c1 34a_100000742225_100000210303 [0,0,0,1,0,0|2,0,0]=3 345 B16R2.2441 CCCNCc1cnc2ccccc2n1 270004a_100020643023_100000204677 [0,0,0,1,0,0|3,0,0]=4 346 B16R2.2441 CCCOCc1cc2ccccc2cn1 34a_100000210258_100009869231 [0,0,0,1,0,0|3,0,0]=4 347 B16R2.2441 CCCOCc1ccc2ccccc2c1 34a_100000210258_100011216711 [0,0,0,1,0,0|2,0,0]=3 348 B16R2.2441 CCCOCc1ccc2ccccc2c1 34a_100011215330_100000210303 [0,0,0,1,0,0|2,0,0]=3 349 B16R2.2441 CCCOCc1ccc2ccccc2c1 7a_100011215330_100000210303 [0,0,0,1,0,0|2,0,0]=3 350 B16R2.2441 CCCOCc1ccc2ccccc2n1 34a_100000210258_100000737579 [0,0,0,1,0,0|3,0,0]=4 351 B16R2.2441 CCCOCc1ccc2cnccc2c1 34a_100000210258_100020605334 [0,0,0,1,0,0|3,0,0]=4 352 B16R2.2441 CCCOCc1ccc2ncccc2c1 34a_100000210258_100000703657 [0,0,0,1,0,0|3,0,0]=4 353 B16R2.2441 CCCOCc1ccc2ncccc2c1 34a_100011315636_100000210303 [0,0,0,1,0,0|3,0,0]=4 354 B16R2.2441 CCCOCc1cnc2ccccc2c1 34a_100011258773_100000210303 [0,0,0,1,0,0|2,0,0]=3 355 B16R2.2441 CCCSCc1cc2ccccc2cn1 62a_100000210303_100009869231 [0,0,0,1,0,0|3,0,0]=4 356 B16R2.2441 CCCSCc1cc2ccccc2cn1 62a_100009869231_100000210303 [0,0,0,1,0,0|3,0,0]=4 357 B16R2.2441 CCCSCc1ccc2ccccc2c1 62a_100000210303_100011216711 [0,0,0,1,0,0|2,0,0]=3 358 B16R2.2441 CCCSCc1ccc2ccccc2c1 62a_100011216711_100000210303 [0,0,0,1,0,0|2,0,0]=3 359 B16R2.2441 CCCSCc1ccc2ccccc2n1 62a_100000210303_100000737579 [0,0,0,1,0,0|3,0,0]=4 360 B16R2.2441 CCCSCc1ccc2ccccc2n1 62a_100000737579_100000210303 [0,0,0,1,0,0|3,0,0]=4 361 B16R2.2441 CCCSCc1ccc2cnccc2c1 62a_100000210303_100020605334 [0,0,0,1,0,0|3,0,0]=4 362 B16R2.2441 CCCSCc1ccc2cnccc2c1 62a_100020605334_100000210303 [0,0,0,1,0,0|3,0,0]=4 363 B16R2.2441 CCCSCc1ccc2ncccc2c1 62a_100000210303_100000703657 [0,0,0,1,0,0|3,0,0]=4 364 B16R2.2441 CCCSCc1ccc2ncccc2c1 62a_100000703657_100000210303 [0,0,0,1,0,0|3,0,0]=4 365 B16R2.2441 CCCSCc1cnc2ccccc2n1 62a_100000210303_200000751123 [0,0,0,1,0,0|3,0,0]=4 366 B16R2.2441 CCCSCc1cnc2ccccc2n1 62a_200000751123_100000210303 [0,0,0,1,0,0|3,0,0]=4 367 B16R2.2441 CCNCCc1ccc2ccccc2c1 2230a_100000746582_100000210202 [0,0,0,1,0,0|2,0,0]=3 368 B16R2.2441 CCNCCc1ccc2ccccc2c1 34a_100000746582_100000210202 [0,0,0,1,0,0|2,0,0]=3 369 B16R2.2441 CCOCCc1ccc2ccccc2c1 34a_100000755654_100000210202 [0,0,0,1,0,0|2,0,0]=3 370 B16R2.2441 CCOCCc1ccc2ccccc2c1 7a_100000755654_100000210202 [0,0,0,1,0,0|2,0,0]=3 371 B16R2.2441 CCOCCc1ccc2ccccc2n1 34a_100011996444_100000210202 [0,0,0,1,0,0|3,0,0]=4 372 B16R2.2441 CCOCSc1ccc2ccccc2c1 62a_100000739092_100000233703 [0,0,0,1,0,0|3,0,0]=4 373 B16R2.2441 CCOCSc1cnc2ccccc2c1 62a_100000739092_100000737414 [0,0,0,1,0,0|3,0,0]=4 374 B16R2.2441 COCCNc1ccc2ccccc2c1 34a_100000211940_100011201679 [0,0,0,1,0,0|3,0,0]=4 375 B16R2.2441 COCCNc1ccc2ccccc2c1 7a_100000211940_100000233755 [0,0,0,1,0,0|3,0,0]=4 376 B16R2.2441 COCCOc1ccc2ccccc2c1 34a_100000185828_100011201679 [0,0,0,1,0,0|3,0,0]=4 377 B16R2.2441 COCCOc1ccc2ccccc2c1 34a_200011219602_200000210301 [0,0,0,1,0,0|3,0,0]=4 378 B16R2.2441 COCCOc1ccc2ccccc2c1 7a_100000185828_100000233755 [0,0,0,1,0,0|3,0,0]=4 379 B16R2.2441 COCCOc1ccc2ccccc2c1 7a_200011219602_200000210301 [0,0,0,1,0,0|3,0,0]=4 380 B16R2.2441 COCCOc1cnc2ccccc2c1 34a_100011934006_100011201679 [0,0,0,1,0,0|3,0,0]=4 381 B16R2.2441 COCCOc1cnc2ccccc2c1 7a_100011934006_100000233755 [0,0,0,1,0,0|3,0,0]=4 382 B16R2.2441 COCCSc1ccc2ccccc2c1 62a_100000233755_100000233703 [0,0,0,1,0,0|3,0,0]=4 383 B16R2.2441 COCCSc1cnc2ccccc2c1 62a_100000233755_100000737414 [0,0,0,1,0,0|3,0,0]=4 384 B16R2.2441 COCNCc1ccc2ccccc2c1 2230a_100000739491_100000766300 [0,0,0,1,0,0|3,0,0]=4 385 B16R2.2441 COCSCc1ccc2ccccc2c1 62a_100000766300_100011216711 [0,0,0,1,0,0|3,0,0]=4 386 B16R2.2441 COCSCc1ccc2ccccc2c1 62a_100011216711_100000766300 [0,0,0,1,0,0|3,0,0]=4 387 B16R2.2441 CSCCNc1ccc2ccccc2c1 34a_100000211940_100000212216 [0,0,0,1,0,0|3,0,0]=4 388 B16R2.2441 CSCCNc1ccc2ccccc2c1 7a_100000211940_100000212216 [0,0,0,1,0,0|3,0,0]=4 389 B16R2.2441 CSCCOc1ccc2ccccc2c1 34a_100000185828_100000212216 [0,0,0,1,0,0|3,0,0]=4 390 B16R2.2441 CSCCOc1ccc2ccccc2c1 7a_100000185828_100000212216 [0,0,0,1,0,0|3,0,0]=4 391 B16R2.2441 CSCCOc1cnc2ccccc2c1 34a_100011934006_100000212216 [0,0,0,1,0,0|3,0,0]=4 392 B16R2.2441 CSCCOc1cnc2ccccc2c1 7a_100011934006_100000212216 [0,0,0,1,0,0|3,0,0]=4 393 B16R2.2441 CSCCSc1ccc2ccccc2c1 62a_100000212216_100000233703 [0,0,0,1,0,0|3,0,0]=4 394 B16R2.2441 CSCCSc1cnc2ccccc2c1 62a_100000212216_100000737414 [0,0,0,1,0,0|3,0,0]=4 395 B16R2.2441 CSCNCc1ccc2ccccc2c1 2230a_100000739491_100011218213 [0,0,0,1,0,0|3,0,0]=4 396 B16R2.2441 CSCNCc1ccc2ccccc2c1 34a_100000739491_100011218213 [0,0,0,1,0,0|3,0,0]=4 397 B16R2.2441 CSCNCc1cnc2ccccc2c1 34a_100000742225_100011218213 [0,0,0,1,0,0|3,0,0]=4 398 B16R2.2441 CSCOCc1ccc2ccccc2c1 34a_100011215330_100011218213 [0,0,0,1,0,0|3,0,0]=4 399 B16R2.2441 CSCOCc1cnc2ccccc2c1 34a_100011258773_100011218213 [0,0,0,1,0,0|3,0,0]=4 400 B16R2.2441 CSCSCc1ccc2ccccc2c1 62a_100011216711_100011218213 [0,0,0,1,0,0|3,0,0]=4 401 B16R2.2441 CSCSCc1ccc2ccccc2c1 62a_100011218213_100011216711 [0,0,0,1,0,0|3,0,0]=4 402 B16R2.2441 FCCCNc1ccc2ccccc2c1 34a_100000211940_100011934791 [0,0,0,1,0,0|3,0,0]=4 403 B16R2.2441 FCCCNc1ccc2ccccc2c1 7a_100000211940_100011934791 [0,0,0,1,0,0|3,0,0]=4 404 B16R2.2441 FCCCOc1ccc2ccccc2c1 34a_100000185828_100011934791 [0,0,0,1,0,0|3,0,0]=4 405 B16R2.2441 FCCCOc1ccc2ccccc2c1 7a_100000185828_100011934791 [0,0,0,1,0,0|3,0,0]=4 406 B16R2.2441 FCCCOc1cnc2ccccc2c1 34a_100011934006_100011934791 [0,0,0,1,0,0|3,0,0]=4 407 B16R2.2441 FCCCOc1cnc2ccccc2c1 7a_100011934006_100011934791 [0,0,0,1,0,0|3,0,0]=4 408 B16R2.2441 FCCCSc1ccc2ccccc2c1 62a_100011934791_100000233703 [0,0,0,1,0,0|3,0,0]=4 409 B16R2.2441 FCCCSc1cnc2ccccc2c1 62a_100011934791_100000737414 [0,0,0,1,0,0|3,0,0]=4 410 B16R2.2441 FCCNCc1ccc2ccccc2c1 2230a_100000739491_100011217306 [0,0,0,1,0,0|3,0,0]=4 411 B16R2.2441 FCCNCc1ccc2ccccc2c1 34a_100000724931_100011216711 [0,0,0,1,0,0|3,0,0]=4 412 B16R2.2441 FCCNCc1ccc2ccccc2c1 34a_100000739491_100011217306 [0,0,0,1,0,0|3,0,0]=4 413 B16R2.2441 FCCNCc1cnc2ccccc2c1 34a_100000742225_100011217306 [0,0,0,1,0,0|3,0,0]=4 414 B16R2.2441 FCCOCc1ccc2ccccc2c1 34a_100011215330_100011217306 [0,0,0,1,0,0|3,0,0]=4 415 B16R2.2441 FCCOCc1ccc2ccccc2c1 7a_100011215330_100011217306 [0,0,0,1,0,0|3,0,0]=4 416 B16R2.2441 FCCOCc1cnc2ccccc2c1 34a_100011258773_100011217306 [0,0,0,1,0,0|3,0,0]=4 417 B16R2.2441 FCCSCc1ccc2ccccc2c1 62a_100011216711_100011217306 [0,0,0,1,0,0|3,0,0]=4 418 B16R2.2441 FCCSCc1ccc2ccccc2c1 62a_100011217306_100011216711 [0,0,0,1,0,0|3,0,0]=4 419 B16R2.2441 FCNCCc1ccc2ccccc2c1 34a_100000746582_100015361967 [0,0,0,1,0,0|3,0,0]=4 420 B16R2.2441 FCOCCc1ccc2ccccc2c1 34a_100000755654_100015361967 [0,0,0,1,0,0|3,0,0]=4 421 B16R2.2441 FCOCCc1ccc2ccccc2c1 7a_100000755654_100015361967 [0,0,0,1,0,0|3,0,0]=4 422 B16R2.2441 NCCOCc1ccc2ccccc2c1 34a_100000210304_100011216711 [0,0,0,1,0,0|3,0,0]=4 423 B16R2.2441 OCCCNc1ccc2ccccc2c1 34a_100000211940_100000230001 [0,0,0,1,0,0|3,0,0]=4 424 B16R2.2441 OCCCNc1ccc2ccccc2c1 7a_100000211940_100011215043 [0,0,0,1,0,0|3,0,0]=4 425 B16R2.2441 OCCCOc1ccc2ccccc2c1 34a_100000185828_100000230001 [0,0,0,1,0,0|3,0,0]=4 426 B16R2.2441 OCCCOc1ccc2ccccc2c1 7a_100000185828_100011215043 [0,0,0,1,0,0|3,0,0]=4 427 B16R2.2441 OCCCOc1cnc2ccccc2c1 34a_100011934006_100000230001 [0,0,0,1,0,0|3,0,0]=4 428 B16R2.2441 OCCCOc1cnc2ccccc2c1 7a_100011934006_100011215043 [0,0,0,1,0,0|3,0,0]=4 429 B16R2.2441 OCCCSc1ccc2ccccc2c1 62a_100011215043_100000233703 [0,0,0,1,0,0|3,0,0]=4 430 B16R2.2441 OCCCSc1cnc2ccccc2c1 62a_100011215043_100000737414 [0,0,0,1,0,0|3,0,0]=4 431 B16R2.2441 OCCNCc1ccc2ccccc2c1 207a_100000210304_100000211584 [0,0,0,1,0,0|3,0,0]=4 432 B16R2.2441 OCCNCc1ccc2ccccc2c1 2230a_100000739491_100000211926 [0,0,0,1,0,0|3,0,0]=4 433 B16R2.2441 OCCNCc1ccc2ccccc2c1 2230a_100016997473_100011216711 [0,0,0,1,0,0|3,0,0]=4 434 B16R2.2441 OCCNCc1ccc2ccccc2c1 270004a_100000210304_100000211584 [0,0,0,1,0,0|3,0,0]=4 435 B16R2.2441 OCCNCc1ccc2ccccc2c1 34a_100000739491_100000211926 [0,0,0,1,0,0|3,0,0]=4 436 B16R2.2441 OCCNCc1ccc2ccccc2c1 34a_100016990907_100011216711 [0,0,0,1,0,0|3,0,0]=4 437 B16R2.2441 OCCNCc1cnc2ccccc2c1 207a_100000210304_100000750898 [0,0,0,1,0,0|3,0,0]=4 438 B16R2.2441 OCCNCc1cnc2ccccc2c1 270004a_100000210304_100000750898 [0,0,0,1,0,0|3,0,0]=4 439 B16R2.2441 OCCNCc1cnc2ccccc2c1 34a_100000742225_100000211926 [0,0,0,1,0,0|3,0,0]=4 440 B16R2.2441 OCCOCc1ccc2ccccc2c1 34a_100011215330_100000211926 [0,0,0,1,0,0|3,0,0]=4 441 B16R2.2441 OCCOCc1ccc2ccccc2c1 7a_100011215330_100000211926 [0,0,0,1,0,0|3,0,0]=4 442 B16R2.2441 OCCOCc1cnc2ccccc2c1 34a_100011258773_100000211926 [0,0,0,1,0,0|3,0,0]=4 443 B16R2.2441 OCCSCc1ccc2ccccc2c1 62a_100000211926_100011216711 [0,0,0,1,0,0|3,0,0]=4 444 B16R2.2441 OCCSCc1ccc2ccccc2c1 62a_100011216711_100000211926 [0,0,0,1,0,0|3,0,0]=4 445 B16R2.2441 [13CH3]OCCOc1ccc2ccccc2c1 34a_200011219602_200025704644 [0,0,0,1,0,0|3,0,0]=4 446 B16R2.2441 [13CH3]OCCOc1ccc2ccccc2c1 7a_200011219602_200025704644 [0,0,0,1,0,0|3,0,0]=4 447 B16R2.11144 CNC1CCN(C1=O)Cc2ccccc2 2230a_106832991635_100011875758 [0,0,0,1,0,0|2,0,1]=4 448 B16R2.11144 CNC1CCN(C1=O)Cc2ccccc2 34a_100102657272_100011875758 [0,0,0,1,0,0|2,0,1]=4 449 B16R2.11144 CNC1CCN(C1=O)Cc2ccccc2 7a_106832991635_100011875758 [0,0,0,1,0,0|2,0,1]=4 450 B16R2.11144 COC1CCN(C1=O)Cc2ccccc2 34a_100138415774_100011875758 [0,0,0,1,0,0|2,0,1]=4 451 B16R2.11144 CSC1CCN(C1=O)Cc2ccccc2 62a_100011875758_200000210301 [0,0,0,1,0,0|2,0,1]=4 452 B16R2.11144 CSC1CCN(C1=O)Cc2ccccc2 62a_200000210301_100011875758 [0,0,0,1,0,0|2,0,1]=4 453 B16R2.11144 [13CH3]SC1CCN(C1=O)Cc2ccccc2 62a_100011875758_200025704644 [0,0,0,1,0,0|2,0,1]=4 454 B16R2.11144 [13CH3]SC1CCN(C1=O)Cc2ccccc2 62a_200025704644_100011875758 [0,0,0,1,0,0|2,0,1]=4 455 B14R1.121 C=CC(=NNCCC)c1ccccc1 4a_100000740057_200000750708 [0,0,0,0,1,0|3,0,0]=4 456 B14R1.121 C=CC(NCCCC)c1ccccc1 2230a_100000102301_200000085779 [0,0,0,0,1,0|2,0,1]=4 457 B14R1.121 C=CC(OCCCC)c1ccccc1 34a_100011215659_100000210210 [0,0,0,0,1,0|2,0,1]=4 458 B14R1.121 C=CC(OCCCC)c1ccccc1 7a_100011215659_100000210211 [0,0,0,0,1,0|2,0,1]=4 459 B14R1.121 C=CC(SCCCC)c1ccccc1 62a_100000210211_200000085779 [0,0,0,0,1,0|2,0,1]=4 460 B14R1.121 C=CC(SCCCC)c1ccccc1 62a_200000085779_100000210210 [0,0,0,0,1,0|2,0,1]=4 461 B14R1.121 CCCCCC(NC)c1ccccc1 269862a_106832991636_100000211787 [0,0,0,0,1,0|2,0,1]=4 462 B14R1.121 CCCCCC(OC)c1ccccc1 34a_100000748122_200000210301 [0,0,0,0,1,0|2,0,1]=4 463 B14R1.121 CCCCCC(OC)c1ccccc1 7a_100000748122_200000210301 [0,0,0,0,1,0|2,0,1]=4 464 B14R1.121 CCCCCC(O[13CH3])c1ccccc1 34a_100000748122_200025704644 [0,0,0,0,1,0|2,0,1]=4 465 B14R1.121 CCCCCC(O[13CH3])c1ccccc1 7a_100000748122_200025704644 [0,0,0,0,1,0|2,0,1]=4 466 B14R1.121 CCCCCN(CC)c1ccccc1 2230a_100000210013_100000210326 [0,0,0,0,1,0|2,0,1]=4 467 B14R1.121 CCCCCN(CC)c1ccccc1 2230a_200000219563_100000210202 [0,0,0,0,1,0|2,0,1]=4 468 B14R1.121 CCCCCN(CC)c1ccccc1 269982a_100000210013_100000210215 [0,0,0,0,1,0|2,0,1]=4 469 B14R1.121 CCCCCN(CC)c1ccccc1 269982a_200000219563_100000204670 [0,0,0,0,1,0|2,0,1]=4 470 B14R1.121 CCCCCN(CC)c1ccccc1 34a_100000210013_100000718602 [0,0,0,0,1,0|2,0,1]=4 471 B14R1.121 CCCCCN(CC)c1ccccc1 34a_200000219563_100000210202 [0,0,0,0,1,0|2,0,1]=4 472 B14R1.121 CCCCCN(CC)c1ccccc1 7a_200000219563_100000210202 [0,0,0,0,1,0|2,0,1]=4 473 B14R1.121 CCCCCN(CF)c1ccccc1 269982a_200000219563_100015361967 [0,0,0,0,1,0|2,0,1]=4 474 B14R1.121 CCCCCN(CF)c1ccccc1 34a_200000219563_100015361967 [0,0,0,0,1,0|2,0,1]=4 475 B14R1.121 CCCCCN(CF)c1ccccc1 7a_200000219563_100015361967 [0,0,0,0,1,0|2,0,1]=4 476 B16R1.1758 C=CC(=NNc1ccccc1)CCCCC 4a_100015195140_100011217817 [0,0,0,0,0,1|2,0,0]=3 477 B16R1.1758 C=CC(=NNc1ccccn1)CCCCC 4a_100000183288_100011217817 [0,0,0,0,0,1|3,0,0]=4 478 B16R1.1758 C=CC(=NNc1cccnc1)CCCCC 4a_100000728903_100011217817 [0,0,0,0,0,1|3,0,0]=4 479 B16R1.1758 C=CC(=NNc1ccncc1)CCCCC 4a_100000698918_100011217817 [0,0,0,0,0,1|3,0,0]=4 480 B16R1.1758 C=CC(CCCCC)OCc1ccccc1 34a_100011216863_100015291786 [0,0,0,0,0,1|1,0,2]=4 481 B16R1.1758 C=CC(CCCCC)OCc1ccccc1 7a_100011216863_100000211182 [0,0,0,0,0,1|1,0,2]=4 482 B16R1.1758 CCCCCC(=NNc1ccccc1)CC 4a_100015195140_100011215316 [0,0,0,0,0,1|2,0,1]=4 483 B13R0.195 C=CC=CC(=O)CC(=O)CCCCC 1458a_100016291481_200012276598 [1,0,1,0,0,0|1,0,1]=4 484 B13R1.28 BrCCOC/C=C/c1ccccc1 34a_100000211926_100016265936 [2,0,0,0,0,0|2,0,0]=4 485 B13R1.28 CCCCCC=Cc1ccccc1 271570a_100000062253_100000210277 [2,0,0,0,0,0|0,0,0]=2 486 B13R1.28 CCCCCC=Cc1ccccn1 271570a_100000062253_100011216584 [2,0,0,0,0,0|1,0,0]=3 487 B13R1.28 CCCCCC=Cc1cccnc1 271570a_100000062253_100000752921 [2,0,0,0,0,0|1,0,0]=3 488 B13R1.28 CCCCCC=Cc1cccnn1 271570a_100000062253_100016991348 [2,0,0,0,0,0|2,0,0]=4 489 B13R1.28 CCCCCC=Cc1ccncc1 271570a_100000062253_100000035832 [2,0,0,0,0,0|1,0,0]=3 490 B13R1.28 CCCCCC=Cc1ccncn1 271570a_100000062253_100000703185 [2,0,0,0,0,0|2,0,0]=4 491 B13R1.28 CCCCCC=Cc1ccnnc1 271570a_100000062253_100000732662 [2,0,0,0,0,0|2,0,0]=4 492 B13R1.28 CCCCCC=Cc1cnccn1 271570a_100000062253_100000758340 [2,0,0,0,0,0|2,0,0]=4 493 B13R1.28 CCCCCC=Cc1cncnc1 271570a_100000062253_100011206942 [2,0,0,0,0,0|2,0,0]=4 494 B13R1.28 CCCCCC=Cc1ncccn1 271570a_100000062253_100000211032 [2,0,0,0,0,0|2,0,0]=4 495 B13R1.28 CCCCCCNc1ccccc1 34a_100000106764_100000210314 [2,0,0,0,0,0|1,0,1]=4 496 B13R1.28 CCCCCCOc1ccccc1 34a_100000210340_100000210314 [2,0,0,0,0,0|1,0,1]=4 497 B13R1.28 CCCCCCOc1ccccc1 7a_100000210340_100000210314 [2,0,0,0,0,0|1,0,1]=4 498 B13R1.28 CCCCCCSc1ccccc1 62a_100000210314_100000041952 [2,0,0,0,0,0|1,0,1]=4 499 B13R1.28 CCCCCCSc1ccccc1 62a_100000719477_100000210757 [2,0,0,0,0,0|1,0,1]=4 500 B13R1.28 CCCCCNCc1ccccc1 207a_100000209983_100015611070 [2,0,0,0,0,0|1,0,1]=4 501 B13R1.28 CCCCCNCc1ccccc1 2230a_100000209983_100015291786 [2,0,0,0,0,0|1,0,1]=4 502 B13R1.28 CCCCCNCc1ccccc1 2230a_100015324214_100000210326 [2,0,0,0,0,0|1,0,1]=4 503 B13R1.28 CCCCCNCc1ccccc1 270004a_100000209983_100015611070 [2,0,0,0,0,0|1,0,1]=4 504 B13R1.28 CCCCCNCc1ccccc1 34a_100015324214_100000718602 [2,0,0,0,0,0|1,0,1]=4 505 B13R1.28 CCCCCOCc1ccccc1 34a_100000210253_100015291786 [2,0,0,0,0,0|1,0,1]=4 506 B13R1.28 CCCCCOCc1ccccc1 34a_100000210790_100000718602 [2,0,0,0,0,0|1,0,1]=4 507 B13R1.28 CCCCCOCc1ccccc1 7a_100000210253_100000211182 [2,0,0,0,0,0|1,0,1]=4 508 B13R1.28 CCCCCOCc1ccccc1 7a_100000210790_100000210326 [2,0,0,0,0,0|1,0,1]=4 509 B13R1.28 CCCCCSCc1ccccc1 62a_100000210326_100015291786 [2,0,0,0,0,0|1,0,1]=4 510 B13R1.28 CCCCCSCc1ccccc1 62a_100000211182_100000210326 [2,0,0,0,0,0|1,0,1]=4 511 B13R1.28 CCCCNN=Cc1ccccc1 4a_100025702795_100015611070 [2,0,0,0,0,0|2,0,0]=4 512 B13R1.28 CCCNC/C=C/c1ccccc1 2230a_100020603302_100000210303 [2,0,0,0,0,0|1,0,0]=3 513 B13R1.28 CCCNC/C=C/c1ccccc1 34a_100020603302_100000210303 [2,0,0,0,0,0|1,0,0]=3 514 B13R1.28 CCCNCC=Cc1ccccc1 270004a_100020643023_100000210105 [2,0,0,0,0,0|1,0,0]=3 515 B13R1.28 CCCOC/C=C/c1ccccc1 34a_100000210256_100000210303 [2,0,0,0,0,0|1,0,0]=3 516 B13R1.28 CCCOC/C=C/c1ccccc1 34a_100000210258_100016265936 [2,0,0,0,0,0|1,0,0]=3 517 B13R1.28 CCCOC/C=C/c1cccnc1 34a_200102594124_100000210303 [2,0,0,0,0,0|2,0,0]=4 518 B13R1.28 CCCSC/C=C/c1ccccc1 62a_100000210303_100016265936 [2,0,0,0,0,0|1,0,0]=3 519 B13R1.28 CCCSC/C=C/c1ccccc1 62a_100016265936_100000210303 [2,0,0,0,0,0|1,0,0]=3 520 B13R1.28 COCNC/C=C/c1ccccc1 2230a_100020603302_100000766300 [2,0,0,0,0,0|2,0,0]=4 521 B13R1.28 COCSC/C=C/c1ccccc1 62a_100000766300_100016265936 [2,0,0,0,0,0|2,0,0]=4 522 B13R1.28 COCSC/C=C/c1ccccc1 62a_100016265936_100000766300 [2,0,0,0,0,0|2,0,0]=4 523 B13R1.28 CSCNC/C=C/c1ccccc1 2230a_100020603302_100011218213 [2,0,0,0,0,0|2,0,0]=4 524 B13R1.28 CSCNC/C=C/c1ccccc1 34a_100020603302_100011218213 [2,0,0,0,0,0|2,0,0]=4 525 B13R1.28 CSCOC/C=C/c1ccccc1 34a_100000210256_100011218213 [2,0,0,0,0,0|2,0,0]=4 526 B13R1.28 CSCSC/C=C/c1ccccc1 62a_100011218213_100016265936 [2,0,0,0,0,0|2,0,0]=4 527 B13R1.28 CSCSC/C=C/c1ccccc1 62a_100016265936_100011218213 [2,0,0,0,0,0|2,0,0]=4 528 B13R1.28 FCCNC/C=C/c1ccccc1 2230a_100020603302_100011217306 [2,0,0,0,0,0|2,0,0]=4 529 B13R1.28 FCCNC/C=C/c1ccccc1 34a_100000724931_100016265936 [2,0,0,0,0,0|2,0,0]=4 530 B13R1.28 FCCNC/C=C/c1ccccc1 34a_100020603302_100011217306 [2,0,0,0,0,0|2,0,0]=4 531 B13R1.28 FCCOC/C=C/c1ccccc1 34a_100000210256_100011217306 [2,0,0,0,0,0|2,0,0]=4 532 B13R1.28 FCCSC/C=C/c1ccccc1 62a_100011217306_100016265936 [2,0,0,0,0,0|2,0,0]=4 533 B13R1.28 FCCSC/C=C/c1ccccc1 62a_100016265936_100011217306 [2,0,0,0,0,0|2,0,0]=4 534 B13R1.28 NCCOC/C=C/c1ccccc1 34a_100000210304_100016265936 [2,0,0,0,0,0|2,0,0]=4 535 B13R1.28 OCCNC/C=C/c1ccccc1 2230a_100016997473_100016265936 [2,0,0,0,0,0|2,0,0]=4 536 B13R1.28 OCCNC/C=C/c1ccccc1 2230a_100020603302_100000211926 [2,0,0,0,0,0|2,0,0]=4 537 B13R1.28 OCCNC/C=C/c1ccccc1 34a_100016990907_100016265936 [2,0,0,0,0,0|2,0,0]=4 538 B13R1.28 OCCNC/C=C/c1ccccc1 34a_100020603302_100000211926 [2,0,0,0,0,0|2,0,0]=4 539 B13R1.28 OCCNCC=Cc1ccccc1 270004a_100000210304_100000210105 [2,0,0,0,0,0|2,0,0]=4 540 B13R1.28 OCCOC/C=C/c1ccccc1 34a_100000210256_100000211926 [2,0,0,0,0,0|2,0,0]=4 541 B13R1.28 OCCSC/C=C/c1ccccc1 62a_100000211926_100016265936 [2,0,0,0,0,0|2,0,0]=4 542 B13R1.28 OCCSC/C=C/c1ccccc1 62a_100016265936_100000211926 [2,0,0,0,0,0|2,0,0]=4 543 B13R1.44 CCCCC(=Cc1ccccc1)Br 271570a_206741709834_100000210277 [2,0,0,0,0,0|1,0,0]=3 544 B13R1.44 CCCCC(=Cc1ccccn1)Br 271570a_206741709834_100011216584 [2,0,0,0,0,0|2,0,0]=4 545 B13R1.44 CCCCC(=Cc1cccnc1)Br 271570a_206741709834_100000752921 [2,0,0,0,0,0|2,0,0]=4 546 B13R1.44 CCCCC(=Cc1ccncc1)Br 271570a_206741709834_100000035832 [2,0,0,0,0,0|2,0,0]=4 547 B13R1.44 CCCCC(=O)C[n+]1ccccc1 1458a_200000086051_100000210211 [2,0,0,0,0,0|1,0,1]=4 548 B13R1.44 CCCCC(=O)Cc1ccccc1 1458a_100000210183_100015291786 [2,0,0,0,0,0|0,0,1]=3 549 B13R1.44 CCCCC(=O)Cc1ccccn1 1458a_100000210183_100000721315 [2,0,0,0,0,0|1,0,1]=4 550 B13R1.44 CCCCC(=O)Cc1ccccn1 1458a_100000233486_100000210211 [2,0,0,0,0,0|1,0,1]=4 551 B13R1.44 CCCCC(=O)Cc1cccnc1 1458a_100000210183_100000733263 [2,0,0,0,0,0|1,0,1]=4 552 B13R1.44 CCCCC(=O)Cc1cccnc1 1458a_100000737805_100000210211 [2,0,0,0,0,0|1,0,1]=4 553 B13R1.44 CCCCC(=O)Cc1ccncc1 1458a_100000210183_100000705612 [2,0,0,0,0,0|1,0,1]=4 554 B13R1.44 CCCCC(=O)Nc1ccccc1 11a_100000106764_100000210183 [2,0,0,0,0,0|1,0,0]=3 555 B13R1.44 CCCCC(=O)Nc1ccccc1 1626a_100000106764_100000210183 [2,0,0,0,0,0|1,0,0]=3 556 B13R1.44 CCCCC(=O)Nc1ccccc1 22a_100000106764_100000210183 [2,0,0,0,0,0|1,0,0]=3 557 B13R1.44 CCCCC(=O)Nc1ccccc1 527a_100000106764_100000210183 [2,0,0,0,0,0|1,0,0]=3 558 B13R1.44 CCCNC(=O)Nc1ccccc1 2430a_100000106764_100020643023 [2,0,0,0,0,0|2,0,0]=4 559 B13R1.44 CCNCC(=O)Cc1ccccc1 2230a_100015525214_100000233483 [2,0,0,0,0,0|1,0,1]=4 560 B13R1.44 CCNCC(=O)Nc1ccccc1 2230a_100015525214_100000182850 [2,0,0,0,0,0|2,0,0]=4 561 B13R1.44 CCNCC(=O)Oc1ccccc1 2230a_100015525214_100009813826 [2,0,0,0,0,0|2,0,0]=4 562 B13R1.44 CCOC/C(=C/c1ccccc1)/C 34a_200025717232_100000210202 [2,0,0,0,0,0|1,0,1]=4 563 B13R1.44 CCOC/C(=C/c1ccccc1)/C 7a_200025717232_100000210202 [2,0,0,0,0,0|1,0,1]=4 564 B13R1.44 CCOCC(=O)Cc1ccccc1 1458a_100000211967_100015291786 [2,0,0,0,0,0|1,0,1]=4 565 B13R1.44 CCOCC(=O)Nc1ccccc1 11a_100000106764_100000211967 [2,0,0,0,0,0|2,0,0]=4 566 B13R1.44 CCOCC(=O)Nc1ccccc1 1626a_100000106764_100000211967 [2,0,0,0,0,0|2,0,0]=4 567 B13R1.44 CCOCC(=O)Nc1ccccc1 22a_100000106764_100000211967 [2,0,0,0,0,0|2,0,0]=4 568 B13R1.44 CCOCC(=O)Nc1ccccc1 34a_100000246334_100000210202 [2,0,0,0,0,0|2,0,0]=4 569 B13R1.44 CCOCC(=O)Nc1ccccc1 34a_100121572206_100000182850 [2,0,0,0,0,0|2,0,0]=4 570 B13R1.44 CCOCC(=O)Nc1ccccc1 527a_100000106764_100000211967 [2,0,0,0,0,0|2,0,0]=4 571 B13R1.44 CCOCC(=O)Oc1ccccc1 34a_100121572206_100009813826 [2,0,0,0,0,0|2,0,0]=4 572 B13R1.44 CCSCC(=O)Cc1ccccc1 1458a_100000230394_100015291786 [2,0,0,0,0,0|1,0,1]=4 573 B13R1.44 CCSCC(=O)Cc1ccccc1 62a_100000210202_100000233483 [2,0,0,0,0,0|1,0,1]=4 574 B13R1.44 CCSCC(=O)Cc1ccccc1 62a_100000233483_100000210202 [2,0,0,0,0,0|1,0,1]=4 575 B13R1.44 CCSCC(=O)Nc1ccccc1 11a_100000106764_100000230394 [2,0,0,0,0,0|2,0,0]=4 576 B13R1.44 CCSCC(=O)Nc1ccccc1 1626a_100000106764_100000230394 [2,0,0,0,0,0|2,0,0]=4 577 B13R1.44 CCSCC(=O)Nc1ccccc1 22a_100000106764_100000230394 [2,0,0,0,0,0|2,0,0]=4 578 B13R1.44 CCSCC(=O)Nc1ccccc1 527a_100000106764_100000230394 [2,0,0,0,0,0|2,0,0]=4 579 B13R1.44 CCSCC(=O)Nc1ccccc1 62a_100000210202_100000182850 [2,0,0,0,0,0|2,0,0]=4 580 B13R1.44 CCSCC(=O)Nc1ccccc1 62a_100012148978_100000210202 [2,0,0,0,0,0|2,0,0]=4 581 B13R1.44 CCSCC(=O)Oc1ccccc1 62a_100000210202_100009813826 [2,0,0,0,0,0|2,0,0]=4 582 B13R1.44 CCSCC(=O)Oc1ccccc1 62a_100009813826_100000210202 [2,0,0,0,0,0|2,0,0]=4 583 B13R1.44 CNCCC(=O)Nc1ccccc1 2230a_106832991635_100000242058 [2,0,0,0,0,0|2,0,0]=4 584 B13R1.44 CNCCC(=O)Nc1ccccc1 34a_100102657272_100000242058 [2,0,0,0,0,0|2,0,0]=4 585 B13R1.44 CNCCC(=O)Nc1ccccc1 7a_106832991635_100000242058 [2,0,0,0,0,0|2,0,0]=4 586 B13R1.44 CNCCC(=O)Oc1ccccc1 2230a_106832991635_200000035796 [2,0,0,0,0,0|2,0,0]=4 587 B13R1.44 CNCCC(=O)Oc1ccccc1 7a_106832991635_200000035796 [2,0,0,0,0,0|2,0,0]=4 588 B13R1.44 COCCC(=O)Cc1ccccc1 1458a_100000749529_100015291786 [2,0,0,0,0,0|1,0,1]=4 589 B13R1.44 COCCC(=O)Nc1ccccc1 11a_100000106764_100000749529 [2,0,0,0,0,0|2,0,0]=4 590 B13R1.44 COCCC(=O)Nc1ccccc1 1626a_100000106764_100000749529 [2,0,0,0,0,0|2,0,0]=4 591 B13R1.44 COCCC(=O)Nc1ccccc1 22a_100000106764_100000749529 [2,0,0,0,0,0|2,0,0]=4 592 B13R1.44 COCCC(=O)Nc1ccccc1 34a_100138415774_100000242058 [2,0,0,0,0,0|2,0,0]=4 593 B13R1.44 COCCC(=O)Nc1ccccc1 527a_100000106764_100000749529 [2,0,0,0,0,0|2,0,0]=4 594 B13R1.44 CSCCC(=O)Cc1ccccc1 1458a_100000174002_100015291786 [2,0,0,0,0,0|1,0,1]=4 595 B13R1.44 CSCCC(=O)Nc1ccccc1 11a_100000106764_100000174002 [2,0,0,0,0,0|2,0,0]=4 596 B13R1.44 CSCCC(=O)Nc1ccccc1 1626a_100000106764_100000174002 [2,0,0,0,0,0|2,0,0]=4 597 B13R1.44 CSCCC(=O)Nc1ccccc1 22a_100000106764_100000174002 [2,0,0,0,0,0|2,0,0]=4 598 B13R1.44 CSCCC(=O)Nc1ccccc1 527a_100000106764_100000174002 [2,0,0,0,0,0|2,0,0]=4 599 B13R1.44 CSCCC(=O)Nc1ccccc1 62a_200000210301_100000242058 [2,0,0,0,0,0|2,0,0]=4 600 B13R1.44 CSCCC(=O)Oc1ccccc1 62a_200000210301_200000035796 [2,0,0,0,0,0|2,0,0]=4 601 B13R1.44 [13CH3]SCCC(=O)Nc1ccccc1 62a_200025704644_100000242058 [2,0,0,0,0,0|2,0,0]=4 602 B13R1.44 [13CH3]SCCC(=O)Oc1ccccc1 62a_200025704644_200000035796 [2,0,0,0,0,0|2,0,0]=4 603 B15R1.83 C#CCCCCC(=O)Cc1ccccc1 1458a_100000696528_100015291786 [1,1,0,0,0,0|0,0,2]=4 604 B15R1.83 C#CCCCCC(=O)Nc1ccccc1 11a_100000106764_100000696528 [1,1,0,0,0,0|1,0,1]=4 605 B15R1.83 C#CCCCCC(=O)Nc1ccccc1 1626a_100000106764_100000696528 [1,1,0,0,0,0|1,0,1]=4 606 B15R1.83 C#CCCCCC(=O)Nc1ccccc1 22a_100000106764_100000696528 [1,1,0,0,0,0|1,0,1]=4 607 B15R1.83 C#CCCCCC(=O)Nc1ccccc1 527a_100000106764_100000696528 [1,1,0,0,0,0|1,0,1]=4 608 B15R1.83 C/C(=C\c1ccccc1)/COCCCF 34a_200025717232_100011934791 [1,1,0,0,0,0|1,0,1]=4 609 B15R1.83 C/C(=C\c1ccccc1)/COCCCF 7a_200025717232_100011934791 [1,1,0,0,0,0|1,0,1]=4 610 B15R1.83 C/C(=C\c1ccccc1)/COCCCO 34a_200025717232_100000230001 [1,1,0,0,0,0|1,0,1]=4 611 B15R1.83 C/C(=C\c1ccccc1)/COCCCO 7a_200025717232_100011215043 [1,1,0,0,0,0|1,0,1]=4 612 B15R1.83 C=CCCCCC(=O)Cc1ccccc1 1458a_100011215552_100015291786 [1,1,0,0,0,0|0,0,2]=4 613 B15R1.83 C=CCCCCC(=O)Nc1ccccc1 11a_100000106764_100011215552 [1,1,0,0,0,0|1,0,1]=4 614 B15R1.83 C=CCCCCC(=O)Nc1ccccc1 1626a_100000106764_100011215552 [1,1,0,0,0,0|1,0,1]=4 615 B15R1.83 C=CCCCCC(=O)Nc1ccccc1 22a_100000106764_100011215552 [1,1,0,0,0,0|1,0,1]=4 616 B15R1.83 C=CCCCCC(=O)Nc1ccccc1 527a_100000106764_100011215552 [1,1,0,0,0,0|1,0,1]=4 617 B15R1.83 CCC/C=C/CC(=O)Cc1ccccc1 1458a_200016266809_100015291786 [1,1,0,0,0,0|0,0,2]=4 618 B15R1.83 CCC/C=C/CC(=O)Nc1ccccc1 11a_100000106764_200016266809 [1,1,0,0,0,0|1,0,1]=4 619 B15R1.83 CCC/C=C/CC(=O)Nc1ccccc1 1626a_100000106764_200016266809 [1,1,0,0,0,0|1,0,1]=4 620 B15R1.83 CCC/C=C/CC(=O)Nc1ccccc1 22a_100000106764_200016266809 [1,1,0,0,0,0|1,0,1]=4 621 B15R1.83 CCC/C=C/CC(=O)Nc1ccccc1 527a_100000106764_200016266809 [1,1,0,0,0,0|1,0,1]=4 622 B15R1.83 CCCCC=CC(=O)Cc1ccccc1 1458a_100016266645_100015291786 [1,1,0,0,0,0|0,0,2]=4 623 B15R1.83 CCCCC=CC(=O)Nc1ccccc1 11a_100000106764_100016266645 [1,1,0,0,0,0|1,0,1]=4 624 B15R1.83 CCCCC=CC(=O)Nc1ccccc1 1626a_100000106764_100016266645 [1,1,0,0,0,0|1,0,1]=4 625 B15R1.83 CCCCC=CC(=O)Nc1ccccc1 22a_100000106764_100016266645 [1,1,0,0,0,0|1,0,1]=4 626 B15R1.83 CCCCCCC(=O)C[n+]1ccccc1 1458a_200000086051_100000210757 [1,1,0,0,0,0|1,0,1]=4 627 B15R1.83 CCCCCCC(=O)Cc1ccccc1 1458a_100102632555_100015291786 [1,1,0,0,0,0|0,0,1]=3 628 B15R1.83 CCCCCCC(=O)Cc1ccccn1 1458a_100000233486_100000210757 [1,1,0,0,0,0|1,0,1]=4 629 B15R1.83 CCCCCCC(=O)Cc1ccccn1 1458a_100102632555_100000721315 [1,1,0,0,0,0|1,0,1]=4 630 B15R1.83 CCCCCCC(=O)Cc1cccnc1 1458a_100000737805_100000210757 [1,1,0,0,0,0|1,0,1]=4 631 B15R1.83 CCCCCCC(=O)Cc1cccnc1 1458a_100102632555_100000733263 [1,1,0,0,0,0|1,0,1]=4 632 B15R1.83 CCCCCCC(=O)Cc1ccncc1 1458a_100102632555_100000705612 [1,1,0,0,0,0|1,0,1]=4 633 B15R1.83 CCCCCCC(=O)Nc1ccccc1 11a_100000106764_100102632555 [1,1,0,0,0,0|1,0,0]=3 634 B15R1.83 CCCCCCC(=O)Nc1ccccc1 1626a_100000106764_100102632555 [1,1,0,0,0,0|1,0,0]=3 635 B15R1.83 CCCCCCC(=O)Nc1ccccc1 22a_100000106764_100102632555 [1,1,0,0,0,0|1,0,0]=3 636 B15R1.83 CCCCCCC(=O)Nc1ccccc1 527a_100000106764_100102632555 [1,1,0,0,0,0|1,0,0]=3 637 B15R1.83 CCCCCNC(=O)C[n+]1ccccc1 11a_100000209983_200000086051 [1,1,0,0,0,0|1,0,1]=4 638 B15R1.83 CCCCCNC(=O)C[n+]1ccccc1 240690a_100000209983_200000086051 [1,1,0,0,0,0|1,0,1]=4 639 B15R1.83 CCCCCNC(=O)C[n+]1ccccc1 527a_100000209983_200000086051 [1,1,0,0,0,0|1,0,1]=4 640 B15R1.83 CCCCCNC(=O)Cc1ccccn1 11a_100000209983_100000233486 [1,1,0,0,0,0|1,0,1]=4 641 B15R1.83 CCCCCNC(=O)Cc1cccnc1 11a_100000209983_100000737805 [1,1,0,0,0,0|1,0,1]=4 642 B15R1.83 CCCCCNC(=O)Cc1cccnc1 240690a_100000209983_100000737805 [1,1,0,0,0,0|1,0,1]=4 643 B15R1.83 CCCCCNC(=O)Cc1cccnc1 527a_100000209983_100000737805 [1,1,0,0,0,0|1,0,1]=4 644 B15R1.83 CCCCCNC(=O)Cc1ccncc1 11a_100000209983_100011201483 [1,1,0,0,0,0|1,0,1]=4 645 B15R1.83 CCCCCNC(=O)Cc1ccncc1 240690a_100000209983_100011201483 [1,1,0,0,0,0|1,0,1]=4 646 B15R1.83 CCCCCNC(=O)Nc1ccccc1 2430a_100000106764_100000209983 [1,1,0,0,0,0|1,0,0]=3 647 B15R1.83 CCCCNCC(=O)Cc1ccccc1 2230a_100000102301_100000233483 [1,1,0,0,0,0|0,0,1]=3 648 B15R1.83 CCCCNCC(=O)Cc1ccccc1 7a_106832991798_100000233483 [1,1,0,0,0,0|0,0,1]=3 649 B15R1.83 CCCCNCC(=O)Nc1ccccc1 2230a_100000102301_100000182850 [1,1,0,0,0,0|1,0,0]=3 650 B15R1.83 CCCCNCC(=O)Nc1ccccc1 7a_106832991798_100000182850 [1,1,0,0,0,0|1,0,0]=3 651 B15R1.83 CCCCNCC(=O)Nc1ccccn1 2230a_100000102301_100020662008 [1,1,0,0,0,0|2,0,0]=4 652 B15R1.83 CCCCNCC(=O)Nc1ccccn1 7a_106832991798_100020662008 [1,1,0,0,0,0|2,0,0]=4 653 B15R1.83 CCCCNCC(=O)Nc1ccncc1 2230a_100000102301_100000754145 [1,1,0,0,0,0|2,0,0]=4 654 B15R1.83 CCCCNCC(=O)Nc1ccncc1 7a_106832991798_100000754145 [1,1,0,0,0,0|2,0,0]=4 655 B15R1.83 CCCCNCC(=O)Oc1ccccc1 2230a_100000102301_100009813826 [1,1,0,0,0,0|1,0,0]=3 656 B15R1.83 CCCCNCC(=O)Oc1ccccc1 7a_106832991798_100009813826 [1,1,0,0,0,0|1,0,0]=3 657 B15R1.83 CCCCOC/C(=C/c1ccccc1)/C 34a_200025717232_100000210210 [1,1,0,0,0,0|0,0,1]=3 658 B15R1.83 CCCCOC/C(=C/c1ccccc1)/C 7a_200025717232_100000210211 [1,1,0,0,0,0|0,0,1]=3 659 B15R1.83 CCCCOCC(=O)C[n+]1ccccc1 1458a_200000086051_100011995733 [1,1,0,0,0,0|1,0,1]=4 660 B15R1.83 CCCCOCC(=O)Cc1ccccc1 1458a_100000757543_100015291786 [1,1,0,0,0,0|0,0,1]=3 661 B15R1.83 CCCCOCC(=O)Cc1ccccc1 7a_100000210227_100000233483 [1,1,0,0,0,0|0,0,1]=3 662 B15R1.83 CCCCOCC(=O)Cc1ccccn1 1458a_100000233486_100011995733 [1,1,0,0,0,0|1,0,1]=4 663 B15R1.83 CCCCOCC(=O)Cc1ccccn1 1458a_100000757543_100000721315 [1,1,0,0,0,0|1,0,1]=4 664 B15R1.83 CCCCOCC(=O)Cc1cccnc1 1458a_100000737805_100011995733 [1,1,0,0,0,0|1,0,1]=4 665 B15R1.83 CCCCOCC(=O)Cc1cccnc1 1458a_100000757543_100000733263 [1,1,0,0,0,0|1,0,1]=4 666 B15R1.83 CCCCOCC(=O)Cc1ccncc1 1458a_100000757543_100000705612 [1,1,0,0,0,0|1,0,1]=4 667 B15R1.83 CCCCOCC(=O)Nc1ccccc1 11a_100000106764_100000757543 [1,1,0,0,0,0|1,0,0]=3 668 B15R1.83 CCCCOCC(=O)Nc1ccccc1 1626a_100000106764_100000757543 [1,1,0,0,0,0|1,0,0]=3 669 B15R1.83 CCCCOCC(=O)Nc1ccccc1 22a_100000106764_100000757543 [1,1,0,0,0,0|1,0,0]=3 670 B15R1.83 CCCCOCC(=O)Nc1ccccc1 34a_100000210227_100000182850 [1,1,0,0,0,0|1,0,0]=3 671 B15R1.83 CCCCOCC(=O)Nc1ccccc1 34a_100000246334_100000210210 [1,1,0,0,0,0|1,0,0]=3 672 B15R1.83 CCCCOCC(=O)Nc1ccccc1 527a_100000106764_100000757543 [1,1,0,0,0,0|1,0,0]=3 673 B15R1.83 CCCCOCC(=O)Nc1ccccc1 7a_100000210227_100000182850 [1,1,0,0,0,0|1,0,0]=3 674 B15R1.83 CCCCOCC(=O)Nc1ccccn1 7a_100000210227_100020662008 [1,1,0,0,0,0|2,0,0]=4 675 B15R1.83 CCCCOCC(=O)Nc1ccncc1 7a_100000210227_100000754145 [1,1,0,0,0,0|2,0,0]=4 676 B15R1.83 CCCCOCC(=O)Oc1ccccc1 34a_100000210227_100009813826 [1,1,0,0,0,0|1,0,0]=3 677 B15R1.83 CCCCOCC(=O)Oc1ccccc1 7a_100000210227_100009813826 [1,1,0,0,0,0|1,0,0]=3 678 B15R1.83 CCCCSCC(=O)Cc1ccccc1 1458a_100000191162_100015291786 [1,1,0,0,0,0|0,0,1]=3 679 B15R1.83 CCCCSCC(=O)Cc1ccccc1 62a_100000210211_100000233483 [1,1,0,0,0,0|0,0,1]=3 680 B15R1.83 CCCCSCC(=O)Cc1ccccc1 62a_100000233483_100000210210 [1,1,0,0,0,0|0,0,1]=3 681 B15R1.83 CCCCSCC(=O)Cc1ccccn1 1458a_100000191162_100000721315 [1,1,0,0,0,0|1,0,1]=4 682 B15R1.83 CCCCSCC(=O)Cc1cccnc1 1458a_100000191162_100000733263 [1,1,0,0,0,0|1,0,1]=4 683 B15R1.83 CCCCSCC(=O)Cc1ccncc1 1458a_100000191162_100000705612 [1,1,0,0,0,0|1,0,1]=4 684 B15R1.83 CCCCSCC(=O)Nc1ccccc1 11a_100000106764_100000191162 [1,1,0,0,0,0|1,0,0]=3 685 B15R1.83 CCCCSCC(=O)Nc1ccccc1 1626a_100000106764_100000191162 [1,1,0,0,0,0|1,0,0]=3 686 B15R1.83 CCCCSCC(=O)Nc1ccccc1 22a_100000106764_100000191162 [1,1,0,0,0,0|1,0,0]=3 687 B15R1.83 CCCCSCC(=O)Nc1ccccc1 527a_100000106764_100000191162 [1,1,0,0,0,0|1,0,0]=3 688 B15R1.83 CCCCSCC(=O)Nc1ccccc1 62a_100000210211_100000182850 [1,1,0,0,0,0|1,0,0]=3 689 B15R1.83 CCCCSCC(=O)Nc1ccccc1 62a_100012148978_100000210210 [1,1,0,0,0,0|1,0,0]=3 690 B15R1.83 CCCCSCC(=O)Nc1ccccn1 62a_100000210211_100020662008 [1,1,0,0,0,0|2,0,0]=4 691 B15R1.83 CCCCSCC(=O)Nc1ccccn1 62a_100020662008_100000210210 [1,1,0,0,0,0|2,0,0]=4 692 B15R1.83 CCCCSCC(=O)Nc1ccncc1 62a_100000210211_100000754145 [1,1,0,0,0,0|2,0,0]=4 693 B15R1.83 CCCCSCC(=O)Oc1ccccc1 62a_100000210211_100009813826 [1,1,0,0,0,0|1,0,0]=3 694 B15R1.83 CCCCSCC(=O)Oc1ccccc1 62a_100009813826_100000210210 [1,1,0,0,0,0|1,0,0]=3 695 B15R1.83 CCCNCCC(=O)Nc1cccnc1 34a_100000748795_100000210303 [1,1,0,0,0,0|2,0,0]=4 696 B15R1.83 CCCOCCC(=O)C[n+]1ccccc1 1458a_200000086051_100011215938 [1,1,0,0,0,0|1,0,1]=4 697 B15R1.83 CCCOCCC(=O)Cc1ccccn1 1458a_100000233486_100011215938 [1,1,0,0,0,0|1,0,1]=4 698 B15R1.83 CCCOCCC(=O)Cc1cccnc1 1458a_100000737805_100011215938 [1,1,0,0,0,0|1,0,1]=4 699 B15R1.83 CCCOCCC(=O)Nc1ccccc1 34a_100000210258_100000242058 [1,1,0,0,0,0|1,0,0]=3 700 B15R1.83 CCCSCCC(=O)Nc1ccccc1 62a_100000210303_100000242058 [1,1,0,0,0,0|1,0,0]=3 701 B15R1.83 CCCSCCC(=O)Nc1cccnc1 62a_100000210303_200015187043 [1,1,0,0,0,0|2,0,0]=4 702 B15R1.83 CCCSCCC(=O)Oc1ccccc1 62a_100000210303_200000035796 [1,1,0,0,0,0|1,0,0]=3 703 B15R1.83 CCNCCCC(=O)Nc1ccccc1 2230a_100015525214_100011194425 [1,1,0,0,0,0|1,0,0]=3 704 B15R1.83 CCNCCCC(=O)Nc1ccccc1 34a_100000750157_100000210202 [1,1,0,0,0,0|1,0,0]=3 705 B15R1.83 CCOCCCC(=O)C[n+]1ccccc1 1458a_200000086051_100012232248 [1,1,0,0,0,0|1,0,1]=4 706 B15R1.83 CCOCCCC(=O)Cc1ccccn1 1458a_100000233486_100012232248 [1,1,0,0,0,0|1,0,1]=4 707 B15R1.83 CCOCCCC(=O)Cc1cccnc1 1458a_100000737805_100012232248 [1,1,0,0,0,0|1,0,1]=4 708 B15R1.83 CCOCCCC(=O)Nc1ccccc1 34a_100121572206_100011194425 [1,1,0,0,0,0|1,0,0]=3 709 B15R1.83 CCOCCNC(=O)Nc1ccccc1 2430a_100000106764_100011200944 [1,1,0,0,0,0|2,0,0]=4 710 B15R1.83 CCOCSCC(=O)Cc1ccccc1 62a_100000233483_100000739092 [1,1,0,0,0,0|1,0,1]=4 711 B15R1.83 CCOCSCC(=O)Cc1ccccc1 62a_100000739092_100000233483 [1,1,0,0,0,0|1,0,1]=4 712 B15R1.83 CCOCSCC(=O)Nc1ccccc1 62a_100000739092_100000182850 [1,1,0,0,0,0|2,0,0]=4 713 B15R1.83 CCOCSCC(=O)Nc1ccccc1 62a_100012148978_100000739092 [1,1,0,0,0,0|2,0,0]=4 714 B15R1.83 CCOCSCC(=O)Oc1ccccc1 62a_100000739092_100009813826 [1,1,0,0,0,0|2,0,0]=4 715 B15R1.83 CCOCSCC(=O)Oc1ccccc1 62a_100009813826_100000739092 [1,1,0,0,0,0|2,0,0]=4 716 B15R1.83 CCSCCCC(=O)Nc1ccccc1 62a_100000210202_100011194425 [1,1,0,0,0,0|1,0,0]=3 717 B15R1.83 CCSCCNC(=O)Nc1ccccc1 2430a_100000106764_100000106463 [1,1,0,0,0,0|2,0,0]=4 718 B15R1.83 COCCCCC(=O)C[n+]1ccccc1 1458a_200000086051_100000755781 [1,1,0,0,0,0|1,0,1]=4 719 B15R1.83 COCCCCC(=O)Cc1ccccn1 1458a_100000233486_100000755781 [1,1,0,0,0,0|1,0,1]=4 720 B15R1.83 COCCCCC(=O)Cc1cccnc1 1458a_100000737805_100000755781 [1,1,0,0,0,0|1,0,1]=4 721 B15R1.83 COCCCNC(=O)Nc1ccccc1 2430a_100000106764_100150723488 [1,1,0,0,0,0|2,0,0]=4 722 B15R1.83 COCCNCC(=O)Cc1ccccc1 2230a_100000209980_100000233483 [1,1,0,0,0,0|1,0,1]=4 723 B15R1.83 COCCNCC(=O)Nc1ccccc1 2230a_100000209980_100000182850 [1,1,0,0,0,0|2,0,0]=4 724 B15R1.83 COCCNCC(=O)Oc1ccccc1 2230a_100000209980_100009813826 [1,1,0,0,0,0|2,0,0]=4 725 B15R1.83 COCCOC/C(=C/c1ccccc1)/C 34a_200025717232_100011201679 [1,1,0,0,0,0|1,0,1]=4 726 B15R1.83 COCCOC/C(=C/c1ccccc1)/C 7a_200025717232_100000233755 [1,1,0,0,0,0|1,0,1]=4 727 B15R1.83 COCCOCC(=O)Cc1ccccc1 1458a_100000211095_100015291786 [1,1,0,0,0,0|1,0,1]=4 728 B15R1.83 COCCOCC(=O)Nc1ccccc1 11a_100000106764_100000211095 [1,1,0,0,0,0|2,0,0]=4 729 B15R1.83 COCCOCC(=O)Nc1ccccc1 1626a_100000106764_100000211095 [1,1,0,0,0,0|2,0,0]=4 730 B15R1.83 COCCOCC(=O)Nc1ccccc1 22a_100000106764_100000211095 [1,1,0,0,0,0|2,0,0]=4 731 B15R1.83 COCCOCC(=O)Nc1ccccc1 34a_100000210237_100000182850 [1,1,0,0,0,0|2,0,0]=4 732 B15R1.83 COCCOCC(=O)Nc1ccccc1 34a_100000246334_100011201679 [1,1,0,0,0,0|2,0,0]=4 733 B15R1.83 COCCOCC(=O)Nc1ccccc1 527a_100000106764_100000211095 [1,1,0,0,0,0|2,0,0]=4 734 B15R1.83 COCCOCC(=O)Oc1ccccc1 34a_100000210237_100009813826 [1,1,0,0,0,0|2,0,0]=4 735 B15R1.83 COCCSCC(=O)Cc1ccccc1 62a_100000233483_100000233755 [1,1,0,0,0,0|1,0,1]=4 736 B15R1.83 COCCSCC(=O)Cc1ccccc1 62a_100000233755_100000233483 [1,1,0,0,0,0|1,0,1]=4 737 B15R1.83 COCCSCC(=O)Nc1ccccc1 62a_100000233755_100000182850 [1,1,0,0,0,0|2,0,0]=4 738 B15R1.83 COCCSCC(=O)Nc1ccccc1 62a_100012148978_100000233755 [1,1,0,0,0,0|2,0,0]=4 739 B15R1.83 COCCSCC(=O)Oc1ccccc1 62a_100000233755_100009813826 [1,1,0,0,0,0|2,0,0]=4 740 B15R1.83 COCCSCC(=O)Oc1ccccc1 62a_100009813826_100000233755 [1,1,0,0,0,0|2,0,0]=4 741 B15R1.83 COCSCCC(=O)Nc1ccccc1 62a_100000766300_100000242058 [1,1,0,0,0,0|2,0,0]=4 742 B15R1.83 COCSCCC(=O)Oc1ccccc1 62a_100000766300_200000035796 [1,1,0,0,0,0|2,0,0]=4 743 B15R1.83 CSCCCNC(=O)Nc1ccccc1 2430a_100000106764_100000749238 [1,1,0,0,0,0|2,0,0]=4 744 B15R1.83 CSCCNCC(=O)Cc1ccccc1 2230a_100020590264_100000233483 [1,1,0,0,0,0|1,0,1]=4 745 B15R1.83 CSCCNCC(=O)Nc1ccccc1 2230a_100020590264_100000182850 [1,1,0,0,0,0|2,0,0]=4 746 B15R1.83 CSCCNCC(=O)Oc1ccccc1 2230a_100020590264_100009813826 [1,1,0,0,0,0|2,0,0]=4 747 B15R1.83 CSCCOC/C(=C/c1ccccc1)/C 34a_200025717232_100000212216 [1,1,0,0,0,0|1,0,1]=4 748 B15R1.83 CSCCOC/C(=C/c1ccccc1)/C 7a_200025717232_100000212216 [1,1,0,0,0,0|1,0,1]=4 749 B15R1.83 CSCCOCC(=O)Cc1ccccc1 7a_100000230434_100000233483 [1,1,0,0,0,0|1,0,1]=4 750 B15R1.83 CSCCOCC(=O)Nc1ccccc1 34a_100000230434_100000182850 [1,1,0,0,0,0|2,0,0]=4 751 B15R1.83 CSCCOCC(=O)Nc1ccccc1 34a_100000246334_100000212216 [1,1,0,0,0,0|2,0,0]=4 752 B15R1.83 CSCCOCC(=O)Nc1ccccc1 7a_100000230434_100000182850 [1,1,0,0,0,0|2,0,0]=4 753 B15R1.83 CSCCOCC(=O)Oc1ccccc1 34a_100000230434_100009813826 [1,1,0,0,0,0|2,0,0]=4 754 B15R1.83 CSCCOCC(=O)Oc1ccccc1 7a_100000230434_100009813826 [1,1,0,0,0,0|2,0,0]=4 755 B15R1.83 CSCCSCC(=O)Cc1ccccc1 62a_100000212216_100000233483 [1,1,0,0,0,0|1,0,1]=4 756 B15R1.83 CSCCSCC(=O)Cc1ccccc1 62a_100000233483_100000751147 [1,1,0,0,0,0|1,0,1]=4 757 B15R1.83 CSCCSCC(=O)Nc1ccccc1 62a_100000212216_100000182850 [1,1,0,0,0,0|2,0,0]=4 758 B15R1.83 CSCCSCC(=O)Nc1ccccc1 62a_100012148978_100000751147 [1,1,0,0,0,0|2,0,0]=4 759 B15R1.83 CSCCSCC(=O)Oc1ccccc1 62a_100000212216_100009813826 [1,1,0,0,0,0|2,0,0]=4 760 B15R1.83 CSCCSCC(=O)Oc1ccccc1 62a_100009813826_100000751147 [1,1,0,0,0,0|2,0,0]=4 761 B15R1.83 CSCSCCC(=O)Nc1ccccc1 62a_100011218213_100000242058 [1,1,0,0,0,0|2,0,0]=4 762 B15R1.83 CSCSCCC(=O)Oc1ccccc1 62a_100011218213_200000035796 [1,1,0,0,0,0|2,0,0]=4 763 B15R1.83 NCCCOCC(=O)Nc1ccccc1 34a_100000182051_100000182850 [1,1,0,0,0,0|2,0,0]=4 764 B15R1.83 NCCCOCC(=O)Oc1ccccc1 34a_100000182051_100009813826 [1,1,0,0,0,0|2,0,0]=4 765 B15R1.83 NCCOCCC(=O)Nc1ccccc1 34a_100000210304_100000242058 [1,1,0,0,0,0|2,0,0]=4 766 B15R1.83 O=C(CCCCCF)C[n+]1ccccc1 1458a_200000086051_100000729378 [1,1,0,0,0,0|1,0,1]=4 767 B15R1.83 O=C(CCCCCF)Cc1ccccn1 1458a_100000233486_100000729378 [1,1,0,0,0,0|1,0,1]=4 768 B15R1.83 O=C(CCCCCF)Cc1cccnc1 1458a_100000737805_100000729378 [1,1,0,0,0,0|1,0,1]=4 769 B15R1.83 O=C(CCCCCO)C[n+]1ccccc1 1458a_200000086051_100000746330 [1,1,0,0,0,0|1,0,1]=4 770 B15R1.83 O=C(CCCCCO)Cc1ccccc1 1458a_100102619762_100015291786 [1,1,0,0,0,0|0,0,1]=3 771 B15R1.83 O=C(CCCCCO)Cc1ccccn1 1458a_100000233486_100000746330 [1,1,0,0,0,0|1,0,1]=4 772 B15R1.83 O=C(CCCCCO)Cc1ccccn1 1458a_100102619762_100000721315 [1,1,0,0,0,0|1,0,1]=4 773 B15R1.83 O=C(CCCCCO)Cc1cccnc1 1458a_100000737805_100000746330 [1,1,0,0,0,0|1,0,1]=4 774 B15R1.83 O=C(CCCCCO)Cc1cccnc1 1458a_100102619762_100000733263 [1,1,0,0,0,0|1,0,1]=4 775 B15R1.83 O=C(CCCCCO)Cc1ccncc1 1458a_100102619762_100000705612 [1,1,0,0,0,0|1,0,1]=4 776 B15R1.83 O=C(CCCCCO)Nc1ccccc1 22a_100000106764_100102619762 [1,1,0,0,0,0|1,0,0]=3 777 B15R1.83 O=C(CCCNCF)Nc1ccccc1 34a_100000750157_100015361967 [1,1,0,0,0,0|2,0,0]=4 778 B15R1.83 O=C(CCCSCF)Nc1ccccc1 62a_100015361967_100011194425 [1,1,0,0,0,0|2,0,0]=4 779 B15R1.83 O=C(CCNCCF)Nc1ccccc1 34a_100000724931_100000242058 [1,1,0,0,0,0|2,0,0]=4 780 B15R1.83 O=C(CCNCCO)Nc1ccccc1 2230a_100016997473_100000242058 [1,1,0,0,0,0|2,0,0]=4 781 B15R1.83 O=C(CCNCCO)Nc1ccccc1 34a_100016990907_100000242058 [1,1,0,0,0,0|2,0,0]=4 782 B15R1.83 O=C(CCNCCO)Oc1ccccc1 2230a_100016997473_200000035796 [1,1,0,0,0,0|2,0,0]=4 783 B15R1.83 O=C(CCOCCBr)Nc1ccccc1 34a_100000211926_100000242058 [1,1,0,0,0,0|2,0,0]=4 784 B15R1.83 O=C(CCOCCO)Cc1ccccc1 1458a_100011229844_100015291786 [1,1,0,0,0,0|1,0,1]=4 785 B15R1.83 O=C(CCOCCO)Nc1ccccc1 1626a_100000106764_100011229844 [1,1,0,0,0,0|2,0,0]=4 786 B15R1.83 O=C(CCOCCO)Nc1ccccc1 22a_100000106764_100011229844 [1,1,0,0,0,0|2,0,0]=4 787 B15R1.83 O=C(CCSCCF)Nc1ccccc1 62a_100011217306_100000242058 [1,1,0,0,0,0|2,0,0]=4 788 B15R1.83 O=C(CCSCCF)Oc1ccccc1 62a_100011217306_200000035796 [1,1,0,0,0,0|2,0,0]=4 789 B15R1.83 O=C(CCSCCO)Nc1ccccc1 62a_100000211926_100000242058 [1,1,0,0,0,0|2,0,0]=4 790 B15R1.83 O=C(CCSCCO)Oc1ccccc1 62a_100000211926_200000035796 [1,1,0,0,0,0|2,0,0]=4 791 B15R1.83 O=C(CNCCCF)Cc1ccccc1 2230a_100015189416_100000233483 [1,1,0,0,0,0|1,0,1]=4 792 B15R1.83 O=C(CNCCCF)Nc1ccccc1 2230a_100015189416_100000182850 [1,1,0,0,0,0|2,0,0]=4 793 B15R1.83 O=C(CNCCCF)Nc1ccccc1 34a_100015189416_100000182850 [1,1,0,0,0,0|2,0,0]=4 794 B15R1.83 O=C(CNCCCF)Oc1ccccc1 2230a_100015189416_100009813826 [1,1,0,0,0,0|2,0,0]=4 795 B15R1.83 O=C(CNCCCF)Oc1ccccc1 34a_100015189416_100009813826 [1,1,0,0,0,0|2,0,0]=4 796 B15R1.83 O=C(COCCCBr)Nc1ccccc1 34a_100011217188_100000182850 [1,1,0,0,0,0|2,0,0]=4 797 B15R1.83 O=C(COCCCBr)Oc1ccccc1 34a_100011217188_100009813826 [1,1,0,0,0,0|2,0,0]=4 798 B15R1.83 O=C(COCCCCl)Nc1ccccc1 34a_100000230001_100000182850 [1,1,0,0,0,0|2,0,0]=4 799 B15R1.83 O=C(COCCCCl)Oc1ccccc1 34a_100000230001_100009813826 [1,1,0,0,0,0|2,0,0]=4 800 B15R1.83 O=C(COCCCF)Nc1ccccc1 34a_100000246334_100011934791 [1,1,0,0,0,0|2,0,0]=4 801 B15R1.83 O=C(COCCCF)Nc1ccccc1 34a_100000759539_100000182850 [1,1,0,0,0,0|2,0,0]=4 802 B15R1.83 O=C(COCCCF)Oc1ccccc1 34a_100000759539_100009813826 [1,1,0,0,0,0|2,0,0]=4 803 B15R1.83 O=C(COCCCO)Nc1ccccc1 34a_100000246334_100000230001 [1,1,0,0,0,0|2,0,0]=4 804 B15R1.83 O=C(CSCCCF)Cc1ccccc1 62a_100000233483_100011934791 [1,1,0,0,0,0|1,0,1]=4 805 B15R1.83 O=C(CSCCCF)Cc1ccccc1 62a_100011934791_100000233483 [1,1,0,0,0,0|1,0,1]=4 806 B15R1.83 O=C(CSCCCF)Nc1ccccc1 62a_100011934791_100000182850 [1,1,0,0,0,0|2,0,0]=4 807 B15R1.83 O=C(CSCCCF)Nc1ccccc1 62a_100012148978_100011934791 [1,1,0,0,0,0|2,0,0]=4 808 B15R1.83 O=C(CSCCCF)Oc1ccccc1 62a_100009813826_100011934791 [1,1,0,0,0,0|2,0,0]=4 809 B15R1.83 O=C(CSCCCF)Oc1ccccc1 62a_100011934791_100009813826 [1,1,0,0,0,0|2,0,0]=4 810 B15R1.83 O=C(CSCCCO)Cc1ccccc1 62a_100000233483_100011215043 [1,1,0,0,0,0|1,0,1]=4 811 B15R1.83 O=C(CSCCCO)Cc1ccccc1 62a_100011215043_100000233483 [1,1,0,0,0,0|1,0,1]=4 812 B15R1.83 O=C(CSCCCO)Nc1ccccc1 62a_100011215043_100000182850 [1,1,0,0,0,0|2,0,0]=4 813 B15R1.83 O=C(CSCCCO)Nc1ccccc1 62a_100012148978_100011215043 [1,1,0,0,0,0|2,0,0]=4 814 B15R1.83 O=C(CSCCCO)Oc1ccccc1 62a_100009813826_100011215043 [1,1,0,0,0,0|2,0,0]=4 815 B15R1.83 O=C(CSCCCO)Oc1ccccc1 62a_100011215043_100009813826 [1,1,0,0,0,0|2,0,0]=4 816 B15R1.83 O=C(NCCCCO)Nc1ccccc1 2430a_100000106764_100000750430 [1,1,0,0,0,0|2,0,0]=4 817 B15R1.93 C#CCCCC(=O)C(=C)c1ccccc1 1458a_100000065200_100000731252 [1,1,0,0,0,0|0,0,2]=4 818 B15R1.93 C=C(C(=O)C/C=C\CC)c1ccccc1 1458a_100000065200_100103147603 [1,1,0,0,0,0|0,0,2]=4 819 B15R1.93 C=C(C(=O)CC#CCC)c1ccccc1 1458a_100000065200_100009813939 [1,1,0,0,0,0|0,0,2]=4 820 B15R1.93 C=C(C(=O)CCCC#N)c1ccccc1 1458a_100000065200_100000211468 [1,1,0,0,0,0|1,0,1]=4 821 B15R1.93 C=C(C(=O)CCCCC)c1ccccc1 1458a_100000065200_100000210326 [1,1,0,0,0,0|0,0,0]=2 822 B15R1.93 C=C(C(=O)CCCCF)c1ccccc1 1458a_100000065200_100000729493 [1,1,0,0,0,0|1,0,0]=3 823 B15R1.93 C=C(C(=O)CCCCO)c1ccccc1 1458a_100000065200_100000210776 [1,1,0,0,0,0|1,0,0]=3 824 B15R1.93 C=C(C(=O)CCCOC)c1ccccc1 1458a_100000065200_100000740836 [1,1,0,0,0,0|1,0,0]=3 825 B15R1.93 C=C(C(=O)CCOCC)c1ccccc1 1458a_100000065200_100011215890 [1,1,0,0,0,0|1,0,0]=3 826 B15R1.93 C=C(C(=O)CCSCC)c1ccccc1 1458a_100000065200_100000757381 [1,1,0,0,0,0|1,0,0]=3 827 B15R1.93 C=C(C(=O)NCCCC)c1ccccc1 1626a_100000102301_100000065200 [1,1,0,0,0,0|1,0,0]=3 828 B15R1.93 C=C(C(=O)NCCCF)c1ccccc1 1626a_100015189416_100000065200 [1,1,0,0,0,0|2,0,0]=4 829 B15R1.93 C=C(C(=O)NCCOC)c1ccccc1 1626a_100000209980_100000065200 [1,1,0,0,0,0|2,0,0]=4 830 B15R1.93 C=C(C(=O)NCCSC)c1ccccc1 1626a_100020590264_100000065200 [1,1,0,0,0,0|2,0,0]=4 831 B15R1.93 C=C(C(=O)NNCCC)c1ccccc1 22a_100000740057_100000065200 [1,1,0,0,0,0|2,0,0]=4 832 B15R1.93 C=CCCCC(=O)C(=C)c1ccccc1 1458a_100000065200_100000757094 [1,1,0,0,0,0|0,0,2]=4 833 B15R1.93 CC(C(=O)CCCCO)c1ccccc1 1458a_100000695505_100000230085 [1,1,0,0,0,0|1,0,1]=4 834 B15R1.93 CCCCCC(=O)C(C)c1ccccc1 1458a_100000212188_100000230085 [1,1,0,0,0,0|0,0,1]=3 835 B15R1.93 CCCCCC(=O)C(C)c1ccccn1 1458a_100000722050_100000210326 [1,1,0,0,0,0|1,0,1]=4 836 B15R1.93 CCCCCC(=O)C(F)c1ccccc1 1458a_100000698975_100000210326 [1,1,0,0,0,0|0,0,1]=3 837 B15R1.93 CCCCCC(=O)N(C)c1ccccc1 11a_100000210012_100000212188 [1,1,0,0,0,0|1,0,0]=3 838 B15R1.93 CCCCCC(=O)N(C)c1ccccc1 1626a_100000210012_100000212188 [1,1,0,0,0,0|1,0,0]=3 839 B15R1.93 CCCCCC(=O)N(C)c1ccccc1 22a_100000210012_100000212188 [1,1,0,0,0,0|1,0,0]=3 840 B15R1.93 CCCCCC(=O)[C@@H](C)c1ccccc1 1458a_100000751047_100000210326 [1,1,0,0,0,0|0,0,1]=3 841 B15R1.93 CCCCCC(=O)[C@H](O)c1ccccc1 1458a_100000684486_100000210326 [1,1,0,0,0,0|0,0,1]=3 842 B15R1.93 CCCCCC(C)C(=O)c1ccccc1 1458a_100000185807_200011218191 [1,1,0,0,0,0|0,0,2]=4 843 B15R1.93 CCCCCN(C)C(=O)c1ccccc1 11a_100000223495_100000185807 [1,1,0,0,0,0|1,0,1]=4 844 B15R1.93 CCCCCN(C)C(=O)c1ccccc1 1626a_100000223495_100000185807 [1,1,0,0,0,0|1,0,1]=4 845 B15R1.93 CCCCCN(C)C(=O)c1ccccc1 240690a_100000223495_100000185807 [1,1,0,0,0,0|1,0,1]=4 846 B15R1.93 CCCCCN(C)C(=O)c1ccccc1 527a_100000223495_100000185807 [1,1,0,0,0,0|1,0,1]=4 847 B15R1.93 CCCCNC(=O)C(F)c1ccccc1 11a_100000102301_100000698975 [1,1,0,0,0,0|1,0,1]=4 848 B15R1.93 CCCCNC(=O)C(F)c1ccccc1 1626a_100000102301_100000698975 [1,1,0,0,0,0|1,0,1]=4 849 B15R1.93 CCCCNC(=O)C(F)c1ccccc1 240690a_100000102301_100000698975 [1,1,0,0,0,0|1,0,1]=4 850 B15R1.93 CCCCNC(=O)C(F)c1ccccc1 527a_100000102301_100000698975 [1,1,0,0,0,0|1,0,1]=4 851 B15R1.93 CCCCNC(=O)N(C)c1ccccc1 512a_100000102301_100000210012 [1,1,0,0,0,0|2,0,0]=4 852 B15R1.93 CCCCNC(=O)[C@@H](C)c1ccccc1 11a_100000102301_100000751047 [1,1,0,0,0,0|1,0,1]=4 853 B15R1.93 CCCCNC(=O)[C@@H](C)c1ccccc1 1626a_100000102301_100000751047 [1,1,0,0,0,0|1,0,1]=4 854 B15R1.93 CCCCNC(=O)[C@@H](C)c1ccccc1 240690a_100000102301_100000751047 [1,1,0,0,0,0|1,0,1]=4 855 B15R1.93 CCCCNC(=O)[C@@H](C)c1ccccc1 527a_100000102301_100000751047 [1,1,0,0,0,0|1,0,1]=4 856 B15R1.93 CCCCNC(=O)[C@H](O)c1ccccc1 240690a_100000102301_100000684486 [1,1,0,0,0,0|1,0,1]=4 857 B15R1.93 CCCNCC(=O)N(C)c1ccccc1 2230a_200000174886_100000210303 [1,1,0,0,0,0|2,0,0]=4 858 B15R1.93 CCCOCC(=O)C(C)c1ccccc1 1458a_100000745993_100000230085 [1,1,0,0,0,0|1,0,1]=4 859 B15R1.93 CCCOCC(=O)N(C)c1ccccc1 11a_100000210012_100000745993 [1,1,0,0,0,0|2,0,0]=4 860 B15R1.93 CCCOCC(=O)N(C)c1ccccc1 1626a_100000210012_100000745993 [1,1,0,0,0,0|2,0,0]=4 861 B15R1.93 CCCOCC(=O)N(C)c1ccccc1 22a_100000210012_100000745993 [1,1,0,0,0,0|2,0,0]=4 862 B15R1.93 CCCOCC(=O)N(C)c1ccccc1 34a_100000210258_100000183487 [1,1,0,0,0,0|2,0,0]=4 863 B15R1.93 CCCSCC(=O)C(C)c1ccccc1 1458a_100000217233_100000230085 [1,1,0,0,0,0|1,0,1]=4 864 B15R1.93 CCCSCC(=O)N(C)c1ccccc1 11a_100000210012_100000217233 [1,1,0,0,0,0|2,0,0]=4 865 B15R1.93 CCCSCC(=O)N(C)c1ccccc1 1626a_100000210012_100000217233 [1,1,0,0,0,0|2,0,0]=4 866 B15R1.93 CCCSCC(=O)N(C)c1ccccc1 22a_100000210012_100000217233 [1,1,0,0,0,0|2,0,0]=4 867 B15R1.93 CCCSCC(=O)N(C)c1ccccc1 62a_100000183487_100000210303 [1,1,0,0,0,0|2,0,0]=4 868 B15R1.93 CCCSCC(=O)N(C)c1ccccc1 62a_100000210303_100000183487 [1,1,0,0,0,0|2,0,0]=4 869 B15R1.93 CCNCCC(=O)N(C)c1ccccc1 2230a_100015525214_100000691765 [1,1,0,0,0,0|2,0,0]=4 870 B15R1.93 CCOCCC(=O)C(C)c1ccccc1 1458a_100000749530_100000230085 [1,1,0,0,0,0|1,0,1]=4 871 B15R1.93 CCOCCC(=O)C(F)c1ccccc1 1458a_100000698975_100011215890 [1,1,0,0,0,0|1,0,1]=4 872 B15R1.93 CCOCCC(=O)N(C)c1ccccc1 11a_100000210012_100000749530 [1,1,0,0,0,0|2,0,0]=4 873 B15R1.93 CCOCCC(=O)N(C)c1ccccc1 1626a_100000210012_100000749530 [1,1,0,0,0,0|2,0,0]=4 874 B15R1.93 CCOCCC(=O)N(C)c1ccccc1 22a_100000210012_100000749530 [1,1,0,0,0,0|2,0,0]=4 875 B15R1.93 CCOCCC(=O)N(C)c1ccccc1 34a_100121572206_100000691765 [1,1,0,0,0,0|2,0,0]=4 876 B15R1.93 CCOCCC(=O)[C@@H](C)c1ccccc1 1458a_100000751047_100011215890 [1,1,0,0,0,0|1,0,1]=4 877 B15R1.93 CCOCCC(=O)[C@H](O)c1ccccc1 1458a_100000684486_100011215890 [1,1,0,0,0,0|1,0,1]=4 878 B15R1.93 CCSCCC(=O)C(C)c1ccccc1 1458a_100000230768_100000230085 [1,1,0,0,0,0|1,0,1]=4 879 B15R1.93 CCSCCC(=O)C(F)c1ccccc1 1458a_100000698975_100000757381 [1,1,0,0,0,0|1,0,1]=4 880 B15R1.93 CCSCCC(=O)N(C)c1ccccc1 11a_100000210012_100000230768 [1,1,0,0,0,0|2,0,0]=4 881 B15R1.93 CCSCCC(=O)N(C)c1ccccc1 1626a_100000210012_100000230768 [1,1,0,0,0,0|2,0,0]=4 882 B15R1.93 CCSCCC(=O)N(C)c1ccccc1 22a_100000210012_100000230768 [1,1,0,0,0,0|2,0,0]=4 883 B15R1.93 CCSCCC(=O)N(C)c1ccccc1 62a_100000210202_100000691765 [1,1,0,0,0,0|2,0,0]=4 884 B15R1.93 CCSCCC(=O)N(C)c1ccccc1 62a_100000691765_100000210202 [1,1,0,0,0,0|2,0,0]=4 885 B15R1.93 CCSCCC(=O)[C@@H](C)c1ccccc1 1458a_100000751047_100000757381 [1,1,0,0,0,0|1,0,1]=4 886 B15R1.93 CCSCCC(=O)[C@H](O)c1ccccc1 1458a_100000684486_100000757381 [1,1,0,0,0,0|1,0,1]=4 887 B15R1.93 CN(C(=O)CCCCO)c1ccccc1 1626a_100000210012_100000695505 [1,1,0,0,0,0|2,0,0]=4 888 B15R1.93 COCCCC(=O)C(C)c1ccccc1 1458a_100000741012_100000230085 [1,1,0,0,0,0|1,0,1]=4 889 B15R1.93 COCCCC(=O)C(F)c1ccccc1 1458a_100000698975_100000740836 [1,1,0,0,0,0|1,0,1]=4 890 B15R1.93 COCCCC(=O)N(C)c1ccccc1 11a_100000210012_100000741012 [1,1,0,0,0,0|2,0,0]=4 891 B15R1.93 COCCCC(=O)N(C)c1ccccc1 1626a_100000210012_100000741012 [1,1,0,0,0,0|2,0,0]=4 892 B15R1.93 COCCCC(=O)N(C)c1ccccc1 22a_100000210012_100000741012 [1,1,0,0,0,0|2,0,0]=4 893 B15R1.93 COCCCC(=O)[C@@H](C)c1ccccc1 1458a_100000751047_100000740836 [1,1,0,0,0,0|1,0,1]=4 894 B15R1.93 COCCCC(=O)[C@H](O)c1ccccc1 1458a_100000684486_100000740836 [1,1,0,0,0,0|1,0,1]=4 895 B15R1.93 CSCCCC(=O)C(C)c1ccccc1 1458a_100000173376_100000230085 [1,1,0,0,0,0|1,0,1]=4 896 B15R1.93 CSCCCC(=O)N(C)c1ccccc1 11a_100000210012_100000173376 [1,1,0,0,0,0|2,0,0]=4 897 B15R1.93 CSCCCC(=O)N(C)c1ccccc1 1626a_100000210012_100000173376 [1,1,0,0,0,0|2,0,0]=4 898 B15R1.93 CSCCCC(=O)N(C)c1ccccc1 22a_100000210012_100000173376 [1,1,0,0,0,0|2,0,0]=4 899 B15R1.93 C[C@H](C(=O)CCCCF)c1ccccc1 1458a_100000751047_100000729493 [1,1,0,0,0,0|1,0,1]=4 900 B15R1.93 C[C@H](C(=O)CCCCO)c1ccccc1 1458a_100000751047_100000210776 [1,1,0,0,0,0|1,0,1]=4 901 B15R1.93 O=C(CCCCF)C(F)c1ccccc1 1458a_100000698975_100000729493 [1,1,0,0,0,0|1,0,1]=4 902 B15R1.93 O=C(CCCCF)[C@H](O)c1ccccc1 1458a_100000684486_100000729493 [1,1,0,0,0,0|1,0,1]=4 903 B15R1.93 O=C(CCCCO)C(F)c1ccccc1 1458a_100000698975_100000210776 [1,1,0,0,0,0|1,0,1]=4 904 B15R1.93 O=C(CCCCO)[C@H](O)c1ccccc1 1458a_100000684486_100000210776 [1,1,0,0,0,0|1,0,1]=4 905 B15R1.128 CCCCCC(=O)Cc1ccc(cc1)Br 1458a_100000198978_100000210326 [1,1,0,0,0,0|0,0,1]=3 906 B15R1.128 CCCCCC(=O)Cc1ccc(cc1)Br 1458a_100000212188_100000189115 [1,1,0,0,0,0|0,0,1]=3 907 B15R1.128 CCCCCC(=O)Cc1ccc(cc1)C 1458a_100000212188_100000210814 [1,1,0,0,0,0|0,0,1]=3 908 B15R1.128 CCCCCC(=O)Cc1ccc(cc1)C 1458a_100000212244_100000210326 [1,1,0,0,0,0|0,0,1]=3 909 B15R1.128 CCCCCC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100000210326 [1,1,0,0,0,0|0,0,1]=3 910 B15R1.128 CCCCCC(=O)Cc1ccc(cc1)Cl 1458a_100000212188_100000694040 [1,1,0,0,0,0|0,0,1]=3 911 B15R1.128 CCCCCC(=O)Cc1ccc(cc1)F 1458a_100000210951_100000210326 [1,1,0,0,0,0|0,0,1]=3 912 B15R1.128 CCCCCC(=O)Cc1ccc(cc1)F 1458a_100000212188_100000198546 [1,1,0,0,0,0|0,0,1]=3 913 B15R1.128 CCCCCC(=O)Cc1ccc(cc1)I 1458a_100000212188_100000189116 [1,1,0,0,0,0|0,0,1]=3 914 B15R1.128 CCCCCC(=O)Cc1ccc(cc1)I 1458a_100000688869_100000210326 [1,1,0,0,0,0|0,0,1]=3 915 B15R1.128 CCCCCC(=O)Cc1ccc(cc1)O 1458a_100000198540_100000210326 [1,1,0,0,0,0|0,0,1]=3 916 B15R1.128 CCCCCC(=O)Cc1ccc(cn1)Br 1458a_100000212188_100000702658 [1,1,0,0,0,0|1,0,1]=4 917 B15R1.128 CCCCCC(=O)Cc1ccc(cn1)Br 1458a_100020629044_100000210326 [1,1,0,0,0,0|1,0,1]=4 918 B15R1.128 CCCCCC(=O)Cc1ccc(cn1)C 1458a_100000212188_100000691093 [1,1,0,0,0,0|1,0,1]=4 919 B15R1.128 CCCCCC(=O)Cc1ccc(cn1)C 1458a_100025705728_100000210326 [1,1,0,0,0,0|1,0,1]=4 920 B15R1.128 CCCCCC(=O)Cc1ccc(cn1)Cl 1458a_100000212188_100012066911 [1,1,0,0,0,0|1,0,1]=4 921 B15R1.128 CCCCCC(=O)Cc1ccc(cn1)Cl 1458a_100000728320_100000210326 [1,1,0,0,0,0|1,0,1]=4 922 B15R1.128 CCCCCC(=O)Cc1ccc(cn1)F 1458a_100000212188_100000703193 [1,1,0,0,0,0|1,0,1]=4 923 B15R1.128 CCCCCC(=O)Cc1ccc(nc1)Br 1458a_100000212188_100009831999 [1,1,0,0,0,0|1,0,1]=4 924 B15R1.128 CCCCCC(=O)Cc1ccc(nc1)Br 1458a_100010067268_100000210326 [1,1,0,0,0,0|1,0,1]=4 925 B15R1.128 CCCCCC(=O)Cc1ccc(nc1)C 1458a_100000212188_100016987292 [1,1,0,0,0,0|1,0,1]=4 926 B15R1.128 CCCCCC(=O)Cc1ccc(nc1)C 1458a_100000740413_100000210326 [1,1,0,0,0,0|1,0,1]=4 927 B15R1.128 CCCCCC(=O)Cc1ccc(nc1)Cl 1458a_100000061944_100000210326 [1,1,0,0,0,0|1,0,1]=4 928 B15R1.128 CCCCCC(=O)Cc1ccc(nc1)Cl 1458a_100000212188_100000735431 [1,1,0,0,0,0|1,0,1]=4 929 B15R1.128 CCCCCC(=O)Cc1ccc(nc1)F 1458a_100000212188_100009820150 [1,1,0,0,0,0|1,0,1]=4 930 B15R1.128 CCCCCC(=O)Cn1ccc(=O)cc1 1458a_200000238563_100000210326 [1,1,0,0,0,0|1,0,1]=4 931 B15R1.128 CCCCCC(=O)Nc1ccc(cc1)Br 11a_100000210018_100000212188 [1,1,0,0,0,0|1,0,0]=3 932 B15R1.128 CCCCCC(=O)Nc1ccc(cc1)Br 1626a_100000210018_100000212188 [1,1,0,0,0,0|1,0,0]=3 933 B15R1.128 CCCCCC(=O)Nc1ccc(cc1)Br 22a_100000210018_100000212188 [1,1,0,0,0,0|1,0,0]=3 934 B15R1.128 CCCCCC(=O)Nc1ccc(cc1)Br 527a_100000210018_100000212188 [1,1,0,0,0,0|1,0,0]=3 935 B15R1.128 CCCCCC(=O)Nc1ccc(cc1)C 11a_100000124888_100000212188 [1,1,0,0,0,0|1,0,0]=3 936 B15R1.128 CCCCCC(=O)Nc1ccc(cc1)C 1626a_100000124888_100000212188 [1,1,0,0,0,0|1,0,0]=3 937 B15R1.128 CCCCCC(=O)Nc1ccc(cc1)C 22a_100000124888_100000212188 [1,1,0,0,0,0|1,0,0]=3 938 B15R1.128 CCCCCC(=O)Nc1ccc(cc1)C 527a_100000124888_100000212188 [1,1,0,0,0,0|1,0,0]=3 939 B15R1.128 CCCCCC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000212188 [1,1,0,0,0,0|1,0,0]=3 940 B15R1.128 CCCCCC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000212188 [1,1,0,0,0,0|1,0,0]=3 941 B15R1.128 CCCCCC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000212188 [1,1,0,0,0,0|1,0,0]=3 942 B15R1.128 CCCCCC(=O)Nc1ccc(cc1)Cl 527a_100000210052_100000212188 [1,1,0,0,0,0|1,0,0]=3 943 B15R1.128 CCCCCC(=O)Nc1ccc(cc1)F 11a_100000185862_100000212188 [1,1,0,0,0,0|1,0,0]=3 944 B15R1.128 CCCCCC(=O)Nc1ccc(cc1)F 1626a_100000185862_100000212188 [1,1,0,0,0,0|1,0,0]=3 945 B15R1.128 CCCCCC(=O)Nc1ccc(cc1)F 22a_100000185862_100000212188 [1,1,0,0,0,0|1,0,0]=3 946 B15R1.128 CCCCCC(=O)Nc1ccc(cc1)F 527a_100000185862_100000212188 [1,1,0,0,0,0|1,0,0]=3 947 B15R1.128 CCCCCC(=O)Nc1ccc(cc1)I 11a_100000185761_100000212188 [1,1,0,0,0,0|1,0,0]=3 948 B15R1.128 CCCCCC(=O)Nc1ccc(cc1)I 1626a_100000185761_100000212188 [1,1,0,0,0,0|1,0,0]=3 949 B15R1.128 CCCCCC(=O)Nc1ccc(cc1)I 22a_100000185761_100000212188 [1,1,0,0,0,0|1,0,0]=3 950 B15R1.128 CCCCCC(=O)Nc1ccc(cc1)I 527a_100000185761_100000212188 [1,1,0,0,0,0|1,0,0]=3 951 B15R1.128 CCCCCC(=O)Nc1ccc(cc1)O 22a_100000185829_100000212188 [1,1,0,0,0,0|1,0,0]=3 952 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)Br 11a_100000102301_100000198978 [1,1,0,0,0,0|1,0,1]=4 953 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)Br 240690a_100000102301_100000198978 [1,1,0,0,0,0|1,0,1]=4 954 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)Br 527a_100000102301_100000198978 [1,1,0,0,0,0|1,0,1]=4 955 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)C 11a_100000102301_100000212244 [1,1,0,0,0,0|1,0,1]=4 956 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)C 240690a_100000102301_100000212244 [1,1,0,0,0,0|1,0,1]=4 957 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)C 527a_100000102301_100000212244 [1,1,0,0,0,0|1,0,1]=4 958 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)Cl 11a_100000102301_100000211027 [1,1,0,0,0,0|1,0,1]=4 959 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)Cl 240690a_100000102301_100000211027 [1,1,0,0,0,0|1,0,1]=4 960 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)Cl 527a_100000102301_100000211027 [1,1,0,0,0,0|1,0,1]=4 961 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)F 11a_100000102301_100000210951 [1,1,0,0,0,0|1,0,1]=4 962 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)F 1626a_100000102301_100000210951 [1,1,0,0,0,0|1,0,1]=4 963 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)F 240690a_100000102301_100000210951 [1,1,0,0,0,0|1,0,1]=4 964 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)F 527a_100000102301_100000210951 [1,1,0,0,0,0|1,0,1]=4 965 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)I 11a_100000102301_100000688869 [1,1,0,0,0,0|1,0,1]=4 966 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)I 1626a_100000102301_100000688869 [1,1,0,0,0,0|1,0,1]=4 967 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)I 240690a_100000102301_100000688869 [1,1,0,0,0,0|1,0,1]=4 968 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)I 527a_100000102301_100000688869 [1,1,0,0,0,0|1,0,1]=4 969 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)O 1626a_100000102301_100000198540 [1,1,0,0,0,0|1,0,1]=4 970 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)O 240690a_100000102301_100000198540 [1,1,0,0,0,0|1,0,1]=4 971 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)O 527a_100000102301_100000198540 [1,1,0,0,0,0|1,0,1]=4 972 B15R1.128 CCCCNC(=O)Nc1ccc(cc1)Br 2430a_100000210018_100000102301 [1,1,0,0,0,0|2,0,0]=4 973 B15R1.128 CCCCNC(=O)Nc1ccc(cc1)C 2430a_100000124888_100000102301 [1,1,0,0,0,0|2,0,0]=4 974 B15R1.128 CCCCNC(=O)Nc1ccc(cc1)Cl 2430a_100000210052_100000102301 [1,1,0,0,0,0|2,0,0]=4 975 B15R1.128 CCCCNC(=O)Nc1ccc(cc1)F 2430a_100000185862_100000102301 [1,1,0,0,0,0|2,0,0]=4 976 B15R1.128 CCCCNC(=O)Nc1ccc(cc1)I 2430a_100000185761_100000102301 [1,1,0,0,0,0|2,0,0]=4 977 B15R1.128 CCCCNC(=O)Nc1ccc(cc1)O 2430a_100000185829_100000102301 [1,1,0,0,0,0|2,0,0]=4 978 B15R1.128 CCCCNC(=O)Nc1ccc(cc1)O 271570a_203496583355_200000163291 [1,1,0,0,0,0|2,0,0]=4 979 B15R1.128 CCCNCC(=O)Nc1ccc(cc1)Br 2230a_100000741985_100000210303 [1,1,0,0,0,0|2,0,0]=4 980 B15R1.128 CCCNCC(=O)Nc1ccc(cc1)F 2230a_100025683178_100000210303 [1,1,0,0,0,0|2,0,0]=4 981 B15R1.128 CCCNCC(=O)Nc1ccc(cc1)F 34a_100025683178_100000210303 [1,1,0,0,0,0|2,0,0]=4 982 B15R1.128 CCCOCC(=O)Cc1ccc(cc1)Br 1458a_100000745993_100000189115 [1,1,0,0,0,0|1,0,1]=4 983 B15R1.128 CCCOCC(=O)Cc1ccc(cc1)C 1458a_100000745993_100000210814 [1,1,0,0,0,0|1,0,1]=4 984 B15R1.128 CCCOCC(=O)Cc1ccc(cc1)Cl 1458a_100000745993_100000694040 [1,1,0,0,0,0|1,0,1]=4 985 B15R1.128 CCCOCC(=O)Cc1ccc(cc1)F 1458a_100000745993_100000198546 [1,1,0,0,0,0|1,0,1]=4 986 B15R1.128 CCCOCC(=O)Cc1ccc(cc1)I 1458a_100000745993_100000189116 [1,1,0,0,0,0|1,0,1]=4 987 B15R1.128 CCCOCC(=O)Nc1ccc(cc1)Br 11a_100000210018_100000745993 [1,1,0,0,0,0|2,0,0]=4 988 B15R1.128 CCCOCC(=O)Nc1ccc(cc1)Br 1626a_100000210018_100000745993 [1,1,0,0,0,0|2,0,0]=4 989 B15R1.128 CCCOCC(=O)Nc1ccc(cc1)Br 22a_100000210018_100000745993 [1,1,0,0,0,0|2,0,0]=4 990 B15R1.128 CCCOCC(=O)Nc1ccc(cc1)Br 34a_100000210258_100000183692 [1,1,0,0,0,0|2,0,0]=4 991 B15R1.128 CCCOCC(=O)Nc1ccc(cc1)Br 527a_100000210018_100000745993 [1,1,0,0,0,0|2,0,0]=4 992 B15R1.128 CCCOCC(=O)Nc1ccc(cc1)C 11a_100000124888_100000745993 [1,1,0,0,0,0|2,0,0]=4 993 B15R1.128 CCCOCC(=O)Nc1ccc(cc1)C 1626a_100000124888_100000745993 [1,1,0,0,0,0|2,0,0]=4 994 B15R1.128 CCCOCC(=O)Nc1ccc(cc1)C 22a_100000124888_100000745993 [1,1,0,0,0,0|2,0,0]=4 995 B15R1.128 CCCOCC(=O)Nc1ccc(cc1)C 34a_100000210258_100000182914 [1,1,0,0,0,0|2,0,0]=4 996 B15R1.128 CCCOCC(=O)Nc1ccc(cc1)C 527a_100000124888_100000745993 [1,1,0,0,0,0|2,0,0]=4 997 B15R1.128 CCCOCC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000745993 [1,1,0,0,0,0|2,0,0]=4 998 B15R1.128 CCCOCC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000745993 [1,1,0,0,0,0|2,0,0]=4 999 B15R1.128 CCCOCC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000745993 [1,1,0,0,0,0|2,0,0]=4 1000 B15R1.128 CCCOCC(=O)Nc1ccc(cc1)Cl 34a_100000210258_100000182960 [1,1,0,0,0,0|2,0,0]=4 1001 B15R1.128 CCCOCC(=O)Nc1ccc(cc1)Cl 527a_100000210052_100000745993 [1,1,0,0,0,0|2,0,0]=4 1002 B15R1.128 CCCOCC(=O)Nc1ccc(cc1)F 11a_100000185862_100000745993 [1,1,0,0,0,0|2,0,0]=4 1003 B15R1.128 CCCOCC(=O)Nc1ccc(cc1)F 1626a_100000185862_100000745993 [1,1,0,0,0,0|2,0,0]=4 1004 B15R1.128 CCCOCC(=O)Nc1ccc(cc1)F 22a_100000185862_100000745993 [1,1,0,0,0,0|2,0,0]=4 1005 B15R1.128 CCCOCC(=O)Nc1ccc(cc1)F 34a_100000210258_100000181725 [1,1,0,0,0,0|2,0,0]=4 1006 B15R1.128 CCCOCC(=O)Nc1ccc(cc1)F 527a_100000185862_100000745993 [1,1,0,0,0,0|2,0,0]=4 1007 B15R1.128 CCCOCC(=O)Nc1ccc(cc1)I 11a_100000185761_100000745993 [1,1,0,0,0,0|2,0,0]=4 1008 B15R1.128 CCCOCC(=O)Nc1ccc(cc1)I 1626a_100000185761_100000745993 [1,1,0,0,0,0|2,0,0]=4 1009 B15R1.128 CCCOCC(=O)Nc1ccc(cc1)I 22a_100000185761_100000745993 [1,1,0,0,0,0|2,0,0]=4 1010 B15R1.128 CCCOCC(=O)Nc1ccc(cc1)I 34a_100000210258_100000183000 [1,1,0,0,0,0|2,0,0]=4 1011 B15R1.128 CCCOCC(=O)Nc1ccc(cc1)I 527a_100000185761_100000745993 [1,1,0,0,0,0|2,0,0]=4 1012 B15R1.128 CCCOCC(=O)Nc1ccc(cc1)N 34a_100011269904_100000210303 [1,1,0,0,0,0|2,0,0]=4 1013 B15R1.128 CCCOCC(=O)Nc1ccc(cc1)O 22a_100000185829_100000745993 [1,1,0,0,0,0|2,0,0]=4 1014 B15R1.128 CCCOCC(=O)Nc1ccc(cc1)O 34a_100000210258_100000233757 [1,1,0,0,0,0|2,0,0]=4 1015 B15R1.128 CCCOCC(=O)Oc1ccc(cc1)Br 34a_100000210258_200010760497 [1,1,0,0,0,0|2,0,0]=4 1016 B15R1.128 CCCSCC(=O)Cc1ccc(cc1)Br 1458a_100000217233_100000189115 [1,1,0,0,0,0|1,0,1]=4 1017 B15R1.128 CCCSCC(=O)Cc1ccc(cc1)C 1458a_100000217233_100000210814 [1,1,0,0,0,0|1,0,1]=4 1018 B15R1.128 CCCSCC(=O)Cc1ccc(cc1)Cl 1458a_100000217233_100000694040 [1,1,0,0,0,0|1,0,1]=4 1019 B15R1.128 CCCSCC(=O)Cc1ccc(cc1)F 1458a_100000217233_100000198546 [1,1,0,0,0,0|1,0,1]=4 1020 B15R1.128 CCCSCC(=O)Cc1ccc(cc1)I 1458a_100000217233_100000189116 [1,1,0,0,0,0|1,0,1]=4 1021 B15R1.128 CCCSCC(=O)Nc1ccc(cc1)Br 11a_100000210018_100000217233 [1,1,0,0,0,0|2,0,0]=4 1022 B15R1.128 CCCSCC(=O)Nc1ccc(cc1)Br 1626a_100000210018_100000217233 [1,1,0,0,0,0|2,0,0]=4 1023 B15R1.128 CCCSCC(=O)Nc1ccc(cc1)Br 22a_100000210018_100000217233 [1,1,0,0,0,0|2,0,0]=4 1024 B15R1.128 CCCSCC(=O)Nc1ccc(cc1)Br 527a_100000210018_100000217233 [1,1,0,0,0,0|2,0,0]=4 1025 B15R1.128 CCCSCC(=O)Nc1ccc(cc1)Br 62a_100000183692_100000210303 [1,1,0,0,0,0|2,0,0]=4 1026 B15R1.128 CCCSCC(=O)Nc1ccc(cc1)Br 62a_100000210303_100000183692 [1,1,0,0,0,0|2,0,0]=4 1027 B15R1.128 CCCSCC(=O)Nc1ccc(cc1)C 11a_100000124888_100000217233 [1,1,0,0,0,0|2,0,0]=4 1028 B15R1.128 CCCSCC(=O)Nc1ccc(cc1)C 1626a_100000124888_100000217233 [1,1,0,0,0,0|2,0,0]=4 1029 B15R1.128 CCCSCC(=O)Nc1ccc(cc1)C 22a_100000124888_100000217233 [1,1,0,0,0,0|2,0,0]=4 1030 B15R1.128 CCCSCC(=O)Nc1ccc(cc1)C 527a_100000124888_100000217233 [1,1,0,0,0,0|2,0,0]=4 1031 B15R1.128 CCCSCC(=O)Nc1ccc(cc1)C 62a_100000210303_100000182914 [1,1,0,0,0,0|2,0,0]=4 1032 B15R1.128 CCCSCC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000217233 [1,1,0,0,0,0|2,0,0]=4 1033 B15R1.128 CCCSCC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000217233 [1,1,0,0,0,0|2,0,0]=4 1034 B15R1.128 CCCSCC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000217233 [1,1,0,0,0,0|2,0,0]=4 1035 B15R1.128 CCCSCC(=O)Nc1ccc(cc1)Cl 527a_100000210052_100000217233 [1,1,0,0,0,0|2,0,0]=4 1036 B15R1.128 CCCSCC(=O)Nc1ccc(cc1)Cl 62a_100000210303_100000182960 [1,1,0,0,0,0|2,0,0]=4 1037 B15R1.128 CCCSCC(=O)Nc1ccc(cc1)Cl 62a_200011202288_100000210303 [1,1,0,0,0,0|2,0,0]=4 1038 B15R1.128 CCCSCC(=O)Nc1ccc(cc1)F 11a_100000185862_100000217233 [1,1,0,0,0,0|2,0,0]=4 1039 B15R1.128 CCCSCC(=O)Nc1ccc(cc1)F 1626a_100000185862_100000217233 [1,1,0,0,0,0|2,0,0]=4 1040 B15R1.128 CCCSCC(=O)Nc1ccc(cc1)F 22a_100000185862_100000217233 [1,1,0,0,0,0|2,0,0]=4 1041 B15R1.128 CCCSCC(=O)Nc1ccc(cc1)F 527a_100000185862_100000217233 [1,1,0,0,0,0|2,0,0]=4 1042 B15R1.128 CCCSCC(=O)Nc1ccc(cc1)F 62a_100000210303_100000181725 [1,1,0,0,0,0|2,0,0]=4 1043 B15R1.128 CCCSCC(=O)Nc1ccc(cc1)F 62a_200000243717_100000210303 [1,1,0,0,0,0|2,0,0]=4 1044 B15R1.128 CCCSCC(=O)Nc1ccc(cc1)I 11a_100000185761_100000217233 [1,1,0,0,0,0|2,0,0]=4 1045 B15R1.128 CCCSCC(=O)Nc1ccc(cc1)I 1626a_100000185761_100000217233 [1,1,0,0,0,0|2,0,0]=4 1046 B15R1.128 CCCSCC(=O)Nc1ccc(cc1)I 22a_100000185761_100000217233 [1,1,0,0,0,0|2,0,0]=4 1047 B15R1.128 CCCSCC(=O)Nc1ccc(cc1)I 527a_100000185761_100000217233 [1,1,0,0,0,0|2,0,0]=4 1048 B15R1.128 CCCSCC(=O)Nc1ccc(cc1)I 62a_100000183000_100000210303 [1,1,0,0,0,0|2,0,0]=4 1049 B15R1.128 CCCSCC(=O)Nc1ccc(cc1)I 62a_100000210303_100000183000 [1,1,0,0,0,0|2,0,0]=4 1050 B15R1.128 CCCSCC(=O)Nc1ccc(cc1)O 22a_100000185829_100000217233 [1,1,0,0,0,0|2,0,0]=4 1051 B15R1.128 CCCSCC(=O)Nc1ccc(cc1)O 62a_100000210303_100000233757 [1,1,0,0,0,0|2,0,0]=4 1052 B15R1.128 CCCSCC(=O)Oc1ccc(cc1)Br 62a_100000210303_200010760497 [1,1,0,0,0,0|2,0,0]=4 1053 B15R1.128 CCCSCC(=O)Oc1ccc(cc1)Br 62a_200010760497_100000210303 [1,1,0,0,0,0|2,0,0]=4 1054 B15R1.128 CCNCCC(=O)Nc1ccc(cc1)Br 2230a_100000743120_100000210202 [1,1,0,0,0,0|2,0,0]=4 1055 B15R1.128 CCNCCC(=O)Nc1ccc(cc1)Br 2230a_100015525214_100000740023 [1,1,0,0,0,0|2,0,0]=4 1056 B15R1.128 CCNCCC(=O)Nc1ccc(cc1)Br 34a_100000743120_100000210202 [1,1,0,0,0,0|2,0,0]=4 1057 B15R1.128 CCNCCC(=O)Nc1ccc(cc1)C 2230a_100015525214_200000187088 [1,1,0,0,0,0|2,0,0]=4 1058 B15R1.128 CCNCCC(=O)Nc1ccc(cc1)C 34a_100015187665_100000210202 [1,1,0,0,0,0|2,0,0]=4 1059 B15R1.128 CCNCCC(=O)Nc1ccc(cc1)Cl 2230a_100015525214_100000188356 [1,1,0,0,0,0|2,0,0]=4 1060 B15R1.128 CCNCCC(=O)Nc1ccc(cc1)F 2230a_100015184513_100000210202 [1,1,0,0,0,0|2,0,0]=4 1061 B15R1.128 CCNCCC(=O)Nc1ccc(cc1)F 2230a_100015525214_100000736363 [1,1,0,0,0,0|2,0,0]=4 1062 B15R1.128 CCNCCC(=O)Nc1ccc(cc1)F 34a_100015184513_100000210202 [1,1,0,0,0,0|2,0,0]=4 1063 B15R1.128 CCNCCC(=O)Nc1ccc(cc1)O 2230a_100015525214_100011302330 [1,1,0,0,0,0|2,0,0]=4 1064 B15R1.128 CCOCCC(=O)Cc1ccc(cc1)Br 1458a_100000198978_100011215890 [1,1,0,0,0,0|1,0,1]=4 1065 B15R1.128 CCOCCC(=O)Cc1ccc(cc1)Br 1458a_100000749530_100000189115 [1,1,0,0,0,0|1,0,1]=4 1066 B15R1.128 CCOCCC(=O)Cc1ccc(cc1)C 1458a_100000212244_100011215890 [1,1,0,0,0,0|1,0,1]=4 1067 B15R1.128 CCOCCC(=O)Cc1ccc(cc1)C 1458a_100000749530_100000210814 [1,1,0,0,0,0|1,0,1]=4 1068 B15R1.128 CCOCCC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100011215890 [1,1,0,0,0,0|1,0,1]=4 1069 B15R1.128 CCOCCC(=O)Cc1ccc(cc1)Cl 1458a_100000749530_100000694040 [1,1,0,0,0,0|1,0,1]=4 1070 B15R1.128 CCOCCC(=O)Cc1ccc(cc1)F 1458a_100000210951_100011215890 [1,1,0,0,0,0|1,0,1]=4 1071 B15R1.128 CCOCCC(=O)Cc1ccc(cc1)F 1458a_100000749530_100000198546 [1,1,0,0,0,0|1,0,1]=4 1072 B15R1.128 CCOCCC(=O)Cc1ccc(cc1)I 1458a_100000688869_100011215890 [1,1,0,0,0,0|1,0,1]=4 1073 B15R1.128 CCOCCC(=O)Cc1ccc(cc1)I 1458a_100000749530_100000189116 [1,1,0,0,0,0|1,0,1]=4 1074 B15R1.128 CCOCCC(=O)Cc1ccc(cc1)O 1458a_100000198540_100011215890 [1,1,0,0,0,0|1,0,1]=4 1075 B15R1.128 CCOCCC(=O)Nc1ccc(cc1)Br 11a_100000210018_100000749530 [1,1,0,0,0,0|2,0,0]=4 1076 B15R1.128 CCOCCC(=O)Nc1ccc(cc1)Br 1626a_100000210018_100000749530 [1,1,0,0,0,0|2,0,0]=4 1077 B15R1.128 CCOCCC(=O)Nc1ccc(cc1)Br 22a_100000210018_100000749530 [1,1,0,0,0,0|2,0,0]=4 1078 B15R1.128 CCOCCC(=O)Nc1ccc(cc1)Br 34a_100121572206_100000740023 [1,1,0,0,0,0|2,0,0]=4 1079 B15R1.128 CCOCCC(=O)Nc1ccc(cc1)Br 527a_100000210018_100000749530 [1,1,0,0,0,0|2,0,0]=4 1080 B15R1.128 CCOCCC(=O)Nc1ccc(cc1)C 11a_100000124888_100000749530 [1,1,0,0,0,0|2,0,0]=4 1081 B15R1.128 CCOCCC(=O)Nc1ccc(cc1)C 1626a_100000124888_100000749530 [1,1,0,0,0,0|2,0,0]=4 1082 B15R1.128 CCOCCC(=O)Nc1ccc(cc1)C 22a_100000124888_100000749530 [1,1,0,0,0,0|2,0,0]=4 1083 B15R1.128 CCOCCC(=O)Nc1ccc(cc1)C 34a_100121572206_200000187088 [1,1,0,0,0,0|2,0,0]=4 1084 B15R1.128 CCOCCC(=O)Nc1ccc(cc1)C 34a_200009859269_100000210202 [1,1,0,0,0,0|2,0,0]=4 1085 B15R1.128 CCOCCC(=O)Nc1ccc(cc1)C 527a_100000124888_100000749530 [1,1,0,0,0,0|2,0,0]=4 1086 B15R1.128 CCOCCC(=O)Nc1ccc(cc1)C 7a_200009859269_100000210202 [1,1,0,0,0,0|2,0,0]=4 1087 B15R1.128 CCOCCC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000749530 [1,1,0,0,0,0|2,0,0]=4 1088 B15R1.128 CCOCCC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000749530 [1,1,0,0,0,0|2,0,0]=4 1089 B15R1.128 CCOCCC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000749530 [1,1,0,0,0,0|2,0,0]=4 1090 B15R1.128 CCOCCC(=O)Nc1ccc(cc1)Cl 527a_100000210052_100000749530 [1,1,0,0,0,0|2,0,0]=4 1091 B15R1.128 CCOCCC(=O)Nc1ccc(cc1)F 11a_100000185862_100000749530 [1,1,0,0,0,0|2,0,0]=4 1092 B15R1.128 CCOCCC(=O)Nc1ccc(cc1)F 1626a_100000185862_100000749530 [1,1,0,0,0,0|2,0,0]=4 1093 B15R1.128 CCOCCC(=O)Nc1ccc(cc1)F 22a_100000185862_100000749530 [1,1,0,0,0,0|2,0,0]=4 1094 B15R1.128 CCOCCC(=O)Nc1ccc(cc1)F 527a_100000185862_100000749530 [1,1,0,0,0,0|2,0,0]=4 1095 B15R1.128 CCOCCC(=O)Nc1ccc(cc1)I 11a_100000185761_100000749530 [1,1,0,0,0,0|2,0,0]=4 1096 B15R1.128 CCOCCC(=O)Nc1ccc(cc1)I 1626a_100000185761_100000749530 [1,1,0,0,0,0|2,0,0]=4 1097 B15R1.128 CCOCCC(=O)Nc1ccc(cc1)I 22a_100000185761_100000749530 [1,1,0,0,0,0|2,0,0]=4 1098 B15R1.128 CCOCCC(=O)Nc1ccc(cc1)I 527a_100000185761_100000749530 [1,1,0,0,0,0|2,0,0]=4 1099 B15R1.128 CCOCCC(=O)Nc1ccc(cc1)O 22a_100000185829_100000749530 [1,1,0,0,0,0|2,0,0]=4 1100 B15R1.128 CCSCCC(=O)Cc1ccc(cc1)Br 1458a_100000198978_100000757381 [1,1,0,0,0,0|1,0,1]=4 1101 B15R1.128 CCSCCC(=O)Cc1ccc(cc1)Br 1458a_100000230768_100000189115 [1,1,0,0,0,0|1,0,1]=4 1102 B15R1.128 CCSCCC(=O)Cc1ccc(cc1)C 1458a_100000212244_100000757381 [1,1,0,0,0,0|1,0,1]=4 1103 B15R1.128 CCSCCC(=O)Cc1ccc(cc1)C 1458a_100000230768_100000210814 [1,1,0,0,0,0|1,0,1]=4 1104 B15R1.128 CCSCCC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100000757381 [1,1,0,0,0,0|1,0,1]=4 1105 B15R1.128 CCSCCC(=O)Cc1ccc(cc1)Cl 1458a_100000230768_100000694040 [1,1,0,0,0,0|1,0,1]=4 1106 B15R1.128 CCSCCC(=O)Cc1ccc(cc1)F 1458a_100000210951_100000757381 [1,1,0,0,0,0|1,0,1]=4 1107 B15R1.128 CCSCCC(=O)Cc1ccc(cc1)F 1458a_100000230768_100000198546 [1,1,0,0,0,0|1,0,1]=4 1108 B15R1.128 CCSCCC(=O)Cc1ccc(cc1)I 1458a_100000230768_100000189116 [1,1,0,0,0,0|1,0,1]=4 1109 B15R1.128 CCSCCC(=O)Cc1ccc(cc1)I 1458a_100000688869_100000757381 [1,1,0,0,0,0|1,0,1]=4 1110 B15R1.128 CCSCCC(=O)Cc1ccc(cc1)O 1458a_100000198540_100000757381 [1,1,0,0,0,0|1,0,1]=4 1111 B15R1.128 CCSCCC(=O)Nc1ccc(cc1)Br 11a_100000210018_100000230768 [1,1,0,0,0,0|2,0,0]=4 1112 B15R1.128 CCSCCC(=O)Nc1ccc(cc1)Br 1626a_100000210018_100000230768 [1,1,0,0,0,0|2,0,0]=4 1113 B15R1.128 CCSCCC(=O)Nc1ccc(cc1)Br 22a_100000210018_100000230768 [1,1,0,0,0,0|2,0,0]=4 1114 B15R1.128 CCSCCC(=O)Nc1ccc(cc1)Br 527a_100000210018_100000230768 [1,1,0,0,0,0|2,0,0]=4 1115 B15R1.128 CCSCCC(=O)Nc1ccc(cc1)Br 62a_100000210202_100000740023 [1,1,0,0,0,0|2,0,0]=4 1116 B15R1.128 CCSCCC(=O)Nc1ccc(cc1)Br 62a_100011219129_100000210202 [1,1,0,0,0,0|2,0,0]=4 1117 B15R1.128 CCSCCC(=O)Nc1ccc(cc1)C 11a_100000124888_100000230768 [1,1,0,0,0,0|2,0,0]=4 1118 B15R1.128 CCSCCC(=O)Nc1ccc(cc1)C 1626a_100000124888_100000230768 [1,1,0,0,0,0|2,0,0]=4 1119 B15R1.128 CCSCCC(=O)Nc1ccc(cc1)C 22a_100000124888_100000230768 [1,1,0,0,0,0|2,0,0]=4 1120 B15R1.128 CCSCCC(=O)Nc1ccc(cc1)C 527a_100000124888_100000230768 [1,1,0,0,0,0|2,0,0]=4 1121 B15R1.128 CCSCCC(=O)Nc1ccc(cc1)C 62a_100000210202_200000187088 [1,1,0,0,0,0|2,0,0]=4 1122 B15R1.128 CCSCCC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000230768 [1,1,0,0,0,0|2,0,0]=4 1123 B15R1.128 CCSCCC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000230768 [1,1,0,0,0,0|2,0,0]=4 1124 B15R1.128 CCSCCC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000230768 [1,1,0,0,0,0|2,0,0]=4 1125 B15R1.128 CCSCCC(=O)Nc1ccc(cc1)Cl 527a_100000210052_100000230768 [1,1,0,0,0,0|2,0,0]=4 1126 B15R1.128 CCSCCC(=O)Nc1ccc(cc1)Cl 62a_100000210202_100000188356 [1,1,0,0,0,0|2,0,0]=4 1127 B15R1.128 CCSCCC(=O)Nc1ccc(cc1)F 11a_100000185862_100000230768 [1,1,0,0,0,0|2,0,0]=4 1128 B15R1.128 CCSCCC(=O)Nc1ccc(cc1)F 1626a_100000185862_100000230768 [1,1,0,0,0,0|2,0,0]=4 1129 B15R1.128 CCSCCC(=O)Nc1ccc(cc1)F 22a_100000185862_100000230768 [1,1,0,0,0,0|2,0,0]=4 1130 B15R1.128 CCSCCC(=O)Nc1ccc(cc1)F 527a_100000185862_100000230768 [1,1,0,0,0,0|2,0,0]=4 1131 B15R1.128 CCSCCC(=O)Nc1ccc(cc1)F 62a_100000210202_100000736363 [1,1,0,0,0,0|2,0,0]=4 1132 B15R1.128 CCSCCC(=O)Nc1ccc(cc1)I 11a_100000185761_100000230768 [1,1,0,0,0,0|2,0,0]=4 1133 B15R1.128 CCSCCC(=O)Nc1ccc(cc1)I 1626a_100000185761_100000230768 [1,1,0,0,0,0|2,0,0]=4 1134 B15R1.128 CCSCCC(=O)Nc1ccc(cc1)I 22a_100000185761_100000230768 [1,1,0,0,0,0|2,0,0]=4 1135 B15R1.128 CCSCCC(=O)Nc1ccc(cc1)I 527a_100000185761_100000230768 [1,1,0,0,0,0|2,0,0]=4 1136 B15R1.128 CCSCCC(=O)Nc1ccc(cc1)O 22a_100000185829_100000230768 [1,1,0,0,0,0|2,0,0]=4 1137 B15R1.128 CCSCCC(=O)Nc1ccc(cc1)O 62a_100000210202_100011302330 [1,1,0,0,0,0|2,0,0]=4 1138 B15R1.128 CNCCCC(=O)Nc1ccc(cc1)Br 34a_100102657272_100000190511 [1,1,0,0,0,0|2,0,0]=4 1139 B15R1.128 CNCCCC(=O)Nc1ccc(cc1)Br 7a_106832991635_100000190511 [1,1,0,0,0,0|2,0,0]=4 1140 B15R1.128 CNCCCC(=O)Nc1ccc(cc1)C 2230a_106832991635_200011194843 [1,1,0,0,0,0|2,0,0]=4 1141 B15R1.128 CNCCCC(=O)Nc1ccc(cc1)C 34a_100102657272_200011194843 [1,1,0,0,0,0|2,0,0]=4 1142 B15R1.128 CNCCCC(=O)Nc1ccc(cc1)C 7a_106832991635_200011194843 [1,1,0,0,0,0|2,0,0]=4 1143 B15R1.128 COCCCC(=O)Cc1ccc(cc1)Br 1458a_100000198978_100000740836 [1,1,0,0,0,0|1,0,1]=4 1144 B15R1.128 COCCCC(=O)Cc1ccc(cc1)Br 1458a_100000741012_100000189115 [1,1,0,0,0,0|1,0,1]=4 1145 B15R1.128 COCCCC(=O)Cc1ccc(cc1)C 1458a_100000212244_100000740836 [1,1,0,0,0,0|1,0,1]=4 1146 B15R1.128 COCCCC(=O)Cc1ccc(cc1)C 1458a_100000741012_100000210814 [1,1,0,0,0,0|1,0,1]=4 1147 B15R1.128 COCCCC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100000740836 [1,1,0,0,0,0|1,0,1]=4 1148 B15R1.128 COCCCC(=O)Cc1ccc(cc1)Cl 1458a_100000741012_100000694040 [1,1,0,0,0,0|1,0,1]=4 1149 B15R1.128 COCCCC(=O)Cc1ccc(cc1)F 1458a_100000210951_100000740836 [1,1,0,0,0,0|1,0,1]=4 1150 B15R1.128 COCCCC(=O)Cc1ccc(cc1)F 1458a_100000741012_100000198546 [1,1,0,0,0,0|1,0,1]=4 1151 B15R1.128 COCCCC(=O)Cc1ccc(cc1)I 1458a_100000688869_100000740836 [1,1,0,0,0,0|1,0,1]=4 1152 B15R1.128 COCCCC(=O)Cc1ccc(cc1)I 1458a_100000741012_100000189116 [1,1,0,0,0,0|1,0,1]=4 1153 B15R1.128 COCCCC(=O)Cc1ccc(cc1)O 1458a_100000198540_100000740836 [1,1,0,0,0,0|1,0,1]=4 1154 B15R1.128 COCCCC(=O)Nc1ccc(cc1)Br 11a_100000210018_100000741012 [1,1,0,0,0,0|2,0,0]=4 1155 B15R1.128 COCCCC(=O)Nc1ccc(cc1)Br 1626a_100000210018_100000741012 [1,1,0,0,0,0|2,0,0]=4 1156 B15R1.128 COCCCC(=O)Nc1ccc(cc1)Br 22a_100000210018_100000741012 [1,1,0,0,0,0|2,0,0]=4 1157 B15R1.128 COCCCC(=O)Nc1ccc(cc1)Br 34a_100138415774_100000190511 [1,1,0,0,0,0|2,0,0]=4 1158 B15R1.128 COCCCC(=O)Nc1ccc(cc1)Br 527a_100000210018_100000741012 [1,1,0,0,0,0|2,0,0]=4 1159 B15R1.128 COCCCC(=O)Nc1ccc(cc1)C 11a_100000124888_100000741012 [1,1,0,0,0,0|2,0,0]=4 1160 B15R1.128 COCCCC(=O)Nc1ccc(cc1)C 1626a_100000124888_100000741012 [1,1,0,0,0,0|2,0,0]=4 1161 B15R1.128 COCCCC(=O)Nc1ccc(cc1)C 22a_100000124888_100000741012 [1,1,0,0,0,0|2,0,0]=4 1162 B15R1.128 COCCCC(=O)Nc1ccc(cc1)C 34a_100138415774_200011194843 [1,1,0,0,0,0|2,0,0]=4 1163 B15R1.128 COCCCC(=O)Nc1ccc(cc1)C 527a_100000124888_100000741012 [1,1,0,0,0,0|2,0,0]=4 1164 B15R1.128 COCCCC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000741012 [1,1,0,0,0,0|2,0,0]=4 1165 B15R1.128 COCCCC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000741012 [1,1,0,0,0,0|2,0,0]=4 1166 B15R1.128 COCCCC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000741012 [1,1,0,0,0,0|2,0,0]=4 1167 B15R1.128 COCCCC(=O)Nc1ccc(cc1)Cl 527a_100000210052_100000741012 [1,1,0,0,0,0|2,0,0]=4 1168 B15R1.128 COCCCC(=O)Nc1ccc(cc1)F 11a_100000185862_100000741012 [1,1,0,0,0,0|2,0,0]=4 1169 B15R1.128 COCCCC(=O)Nc1ccc(cc1)F 1626a_100000185862_100000741012 [1,1,0,0,0,0|2,0,0]=4 1170 B15R1.128 COCCCC(=O)Nc1ccc(cc1)F 22a_100000185862_100000741012 [1,1,0,0,0,0|2,0,0]=4 1171 B15R1.128 COCCCC(=O)Nc1ccc(cc1)F 527a_100000185862_100000741012 [1,1,0,0,0,0|2,0,0]=4 1172 B15R1.128 COCCCC(=O)Nc1ccc(cc1)I 11a_100000185761_100000741012 [1,1,0,0,0,0|2,0,0]=4 1173 B15R1.128 COCCCC(=O)Nc1ccc(cc1)I 1626a_100000185761_100000741012 [1,1,0,0,0,0|2,0,0]=4 1174 B15R1.128 COCCCC(=O)Nc1ccc(cc1)I 22a_100000185761_100000741012 [1,1,0,0,0,0|2,0,0]=4 1175 B15R1.128 COCCCC(=O)Nc1ccc(cc1)I 527a_100000185761_100000741012 [1,1,0,0,0,0|2,0,0]=4 1176 B15R1.128 COCCCC(=O)Nc1ccc(cc1)O 22a_100000185829_100000741012 [1,1,0,0,0,0|2,0,0]=4 1177 B15R1.128 CSCCCC(=O)Cc1ccc(cc1)Br 1458a_100000173376_100000189115 [1,1,0,0,0,0|1,0,1]=4 1178 B15R1.128 CSCCCC(=O)Cc1ccc(cc1)C 1458a_100000173376_100000210814 [1,1,0,0,0,0|1,0,1]=4 1179 B15R1.128 CSCCCC(=O)Cc1ccc(cc1)Cl 1458a_100000173376_100000694040 [1,1,0,0,0,0|1,0,1]=4 1180 B15R1.128 CSCCCC(=O)Cc1ccc(cc1)F 1458a_100000173376_100000198546 [1,1,0,0,0,0|1,0,1]=4 1181 B15R1.128 CSCCCC(=O)Cc1ccc(cc1)I 1458a_100000173376_100000189116 [1,1,0,0,0,0|1,0,1]=4 1182 B15R1.128 CSCCCC(=O)Nc1ccc(cc1)Br 11a_100000210018_100000173376 [1,1,0,0,0,0|2,0,0]=4 1183 B15R1.128 CSCCCC(=O)Nc1ccc(cc1)Br 1626a_100000210018_100000173376 [1,1,0,0,0,0|2,0,0]=4 1184 B15R1.128 CSCCCC(=O)Nc1ccc(cc1)Br 22a_100000210018_100000173376 [1,1,0,0,0,0|2,0,0]=4 1185 B15R1.128 CSCCCC(=O)Nc1ccc(cc1)Br 527a_100000210018_100000173376 [1,1,0,0,0,0|2,0,0]=4 1186 B15R1.128 CSCCCC(=O)Nc1ccc(cc1)Br 62a_200000210301_100000190511 [1,1,0,0,0,0|2,0,0]=4 1187 B15R1.128 CSCCCC(=O)Nc1ccc(cc1)C 11a_100000124888_100000173376 [1,1,0,0,0,0|2,0,0]=4 1188 B15R1.128 CSCCCC(=O)Nc1ccc(cc1)C 1626a_100000124888_100000173376 [1,1,0,0,0,0|2,0,0]=4 1189 B15R1.128 CSCCCC(=O)Nc1ccc(cc1)C 22a_100000124888_100000173376 [1,1,0,0,0,0|2,0,0]=4 1190 B15R1.128 CSCCCC(=O)Nc1ccc(cc1)C 527a_100000124888_100000173376 [1,1,0,0,0,0|2,0,0]=4 1191 B15R1.128 CSCCCC(=O)Nc1ccc(cc1)C 62a_200000210301_200011194843 [1,1,0,0,0,0|2,0,0]=4 1192 B15R1.128 CSCCCC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000173376 [1,1,0,0,0,0|2,0,0]=4 1193 B15R1.128 CSCCCC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000173376 [1,1,0,0,0,0|2,0,0]=4 1194 B15R1.128 CSCCCC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000173376 [1,1,0,0,0,0|2,0,0]=4 1195 B15R1.128 CSCCCC(=O)Nc1ccc(cc1)Cl 527a_100000210052_100000173376 [1,1,0,0,0,0|2,0,0]=4 1196 B15R1.128 CSCCCC(=O)Nc1ccc(cc1)F 11a_100000185862_100000173376 [1,1,0,0,0,0|2,0,0]=4 1197 B15R1.128 CSCCCC(=O)Nc1ccc(cc1)F 1626a_100000185862_100000173376 [1,1,0,0,0,0|2,0,0]=4 1198 B15R1.128 CSCCCC(=O)Nc1ccc(cc1)F 22a_100000185862_100000173376 [1,1,0,0,0,0|2,0,0]=4 1199 B15R1.128 CSCCCC(=O)Nc1ccc(cc1)F 527a_100000185862_100000173376 [1,1,0,0,0,0|2,0,0]=4 1200 B15R1.128 CSCCCC(=O)Nc1ccc(cc1)I 11a_100000185761_100000173376 [1,1,0,0,0,0|2,0,0]=4 1201 B15R1.128 CSCCCC(=O)Nc1ccc(cc1)I 1626a_100000185761_100000173376 [1,1,0,0,0,0|2,0,0]=4 1202 B15R1.128 CSCCCC(=O)Nc1ccc(cc1)I 22a_100000185761_100000173376 [1,1,0,0,0,0|2,0,0]=4 1203 B15R1.128 CSCCCC(=O)Nc1ccc(cc1)I 527a_100000185761_100000173376 [1,1,0,0,0,0|2,0,0]=4 1204 B15R1.128 CSCCCC(=O)Nc1ccc(cc1)O 22a_100000185829_100000173376 [1,1,0,0,0,0|2,0,0]=4 1205 B15R1.128 CSCCCC(=O)Oc1ccc(cc1)F 62a_200000210301_100000010882 [1,1,0,0,0,0|2,0,0]=4 1206 B15R1.128 Cc1ccc(cc1)CC(=O)CCCCF 1458a_100000212244_100000729493 [1,1,0,0,0,0|1,0,1]=4 1207 B15R1.128 Cc1ccc(cc1)CC(=O)CCCCO 1458a_100000212244_100000210776 [1,1,0,0,0,0|1,0,1]=4 1208 B15R1.128 Cc1ccc(cc1)CC(=O)CCCCO 1458a_100000695505_100000210814 [1,1,0,0,0,0|1,0,1]=4 1209 B15R1.128 Cc1ccc(cc1)NC(=O)CCCCO 1626a_100000124888_100000695505 [1,1,0,0,0,0|2,0,0]=4 1210 B15R1.128 Cc1ccc(cc1)NC(=O)CCCS[13CH3] 62a_200025704644_200011194843 [1,1,0,0,0,0|2,0,0]=4 1211 B15R1.128 O=C(CCCCF)Cc1ccc(cc1)Br 1458a_100000198978_100000729493 [1,1,0,0,0,0|1,0,1]=4 1212 B15R1.128 O=C(CCCCF)Cc1ccc(cc1)Cl 1458a_100000211027_100000729493 [1,1,0,0,0,0|1,0,1]=4 1213 B15R1.128 O=C(CCCCF)Cc1ccc(cc1)F 1458a_100000210951_100000729493 [1,1,0,0,0,0|1,0,1]=4 1214 B15R1.128 O=C(CCCCF)Cc1ccc(cc1)I 1458a_100000688869_100000729493 [1,1,0,0,0,0|1,0,1]=4 1215 B15R1.128 O=C(CCCCF)Cc1ccc(cc1)O 1458a_100000198540_100000729493 [1,1,0,0,0,0|1,0,1]=4 1216 B15R1.128 O=C(CCCCO)Cc1ccc(cc1)Br 1458a_100000198978_100000210776 [1,1,0,0,0,0|1,0,1]=4 1217 B15R1.128 O=C(CCCCO)Cc1ccc(cc1)Br 1458a_100000695505_100000189115 [1,1,0,0,0,0|1,0,1]=4 1218 B15R1.128 O=C(CCCCO)Cc1ccc(cc1)Cl 1458a_100000211027_100000210776 [1,1,0,0,0,0|1,0,1]=4 1219 B15R1.128 O=C(CCCCO)Cc1ccc(cc1)Cl 1458a_100000695505_100000694040 [1,1,0,0,0,0|1,0,1]=4 1220 B15R1.128 O=C(CCCCO)Cc1ccc(cc1)F 1458a_100000210951_100000210776 [1,1,0,0,0,0|1,0,1]=4 1221 B15R1.128 O=C(CCCCO)Cc1ccc(cc1)F 1458a_100000695505_100000198546 [1,1,0,0,0,0|1,0,1]=4 1222 B15R1.128 O=C(CCCCO)Cc1ccc(cc1)I 1458a_100000688869_100000210776 [1,1,0,0,0,0|1,0,1]=4 1223 B15R1.128 O=C(CCCCO)Cc1ccc(cc1)I 1458a_100000695505_100000189116 [1,1,0,0,0,0|1,0,1]=4 1224 B15R1.128 O=C(CCCCO)Cc1ccc(cc1)O 1458a_100000198540_100000210776 [1,1,0,0,0,0|1,0,1]=4 1225 B15R1.128 O=C(CCCCO)Nc1ccc(cc1)Br 1626a_100000210018_100000695505 [1,1,0,0,0,0|2,0,0]=4 1226 B15R1.128 O=C(CCCCO)Nc1ccc(cc1)Cl 1626a_100000210052_100000695505 [1,1,0,0,0,0|2,0,0]=4 1227 B15R1.128 O=C(CCCCO)Nc1ccc(cc1)F 1626a_100000185862_100000695505 [1,1,0,0,0,0|2,0,0]=4 1228 B15R1.128 O=C(CCCCO)Nc1ccc(cc1)I 1626a_100000185761_100000695505 [1,1,0,0,0,0|2,0,0]=4 1229 B15R1.128 [13CH3]SCCCC(=O)Nc1ccc(cc1)Br 62a_200025704644_100000190511 [1,1,0,0,0,0|2,0,0]=4 1230 B15R1.128 [13CH3]SCCCC(=O)Oc1ccc(cc1)F 62a_200025704644_100000010882 [1,1,0,0,0,0|2,0,0]=4 1231 B15R1.129 CCCCCC(=O)Cc1cc(ccn1)Br 1458a_100000212188_100010173614 [1,1,0,0,0,0|1,0,1]=4 1232 B15R1.129 CCCCCC(=O)Cc1cc(ccn1)C 1458a_100000212188_100000718516 [1,1,0,0,0,0|1,0,1]=4 1233 B15R1.129 CCCCCC(=O)Cc1cc(ccn1)Cl 1458a_100000212188_100016988179 [1,1,0,0,0,0|1,0,1]=4 1234 B15R1.129 CCCCCC(=O)Cc1cccc(c1)Br 1458a_100000212188_100000211773 [1,1,0,0,0,0|0,0,1]=3 1235 B15R1.129 CCCCCC(=O)Cc1cccc(c1)Br 1458a_100000747190_100000210326 [1,1,0,0,0,0|0,0,1]=3 1236 B15R1.129 CCCCCC(=O)Cc1cccc(c1)C 1458a_100000212188_100000211840 [1,1,0,0,0,0|0,0,1]=3 1237 B15R1.129 CCCCCC(=O)Cc1cccc(c1)C 1458a_100011206899_100000210326 [1,1,0,0,0,0|0,0,1]=3 1238 B15R1.129 CCCCCC(=O)Cc1cccc(c1)Cl 1458a_100000212188_100000181238 [1,1,0,0,0,0|0,0,1]=3 1239 B15R1.129 CCCCCC(=O)Cc1cccc(c1)Cl 1458a_100000749307_100000210326 [1,1,0,0,0,0|0,0,1]=3 1240 B15R1.129 CCCCCC(=O)Cc1cccc(c1)F 1458a_100000211661_100000210326 [1,1,0,0,0,0|0,0,1]=3 1241 B15R1.129 CCCCCC(=O)Cc1cccc(c1)F 1458a_100000212188_100000230114 [1,1,0,0,0,0|0,0,1]=3 1242 B15R1.129 CCCCCC(=O)Cc1cccc(c1)I 1458a_100000212188_100011218688 [1,1,0,0,0,0|0,0,1]=3 1243 B15R1.129 CCCCCC(=O)Cc1cccc(c1)I 1458a_100000238430_100000210326 [1,1,0,0,0,0|0,0,1]=3 1244 B15R1.129 CCCCCC(=O)Cc1cccc(c1)O 1458a_100000212188_100011660834 [1,1,0,0,0,0|0,0,1]=3 1245 B15R1.129 CCCCCC(=O)Cc1cccc(c1)O 1458a_100000745134_100000210326 [1,1,0,0,0,0|0,0,1]=3 1246 B15R1.129 CCCCCC(=O)Cc1cccc(n1)Br 1458a_100000212188_100009889011 [1,1,0,0,0,0|1,0,1]=4 1247 B15R1.129 CCCCCC(=O)Cc1cccc(n1)Br 1458a_100010201708_100000210326 [1,1,0,0,0,0|1,0,1]=4 1248 B15R1.129 CCCCCC(=O)Cc1cccc(n1)C 1458a_100000212188_100000757606 [1,1,0,0,0,0|1,0,1]=4 1249 B15R1.129 CCCCCC(=O)Cc1cccc(n1)C 1458a_100012001110_100000210326 [1,1,0,0,0,0|1,0,1]=4 1250 B15R1.129 CCCCCC(=O)Cc1cccc(n1)Cl 1458a_100000090259_100000210326 [1,1,0,0,0,0|1,0,1]=4 1251 B15R1.129 CCCCCC(=O)Cc1cccc(n1)Cl 1458a_100000212188_100000086093 [1,1,0,0,0,0|1,0,1]=4 1252 B15R1.129 CCCCCC(=O)Cc1cccc(n1)F 1458a_100000096803_100000210326 [1,1,0,0,0,0|1,0,1]=4 1253 B15R1.129 CCCCCC(=O)Cc1cccc(n1)F 1458a_100000212188_100009819644 [1,1,0,0,0,0|1,0,1]=4 1254 B15R1.129 CCCCCC(=O)Cc1ccnc(c1)Br 1458a_100000212188_100010243470 [1,1,0,0,0,0|1,0,1]=4 1255 B15R1.129 CCCCCC(=O)Cc1ccnc(c1)Br 1458a_100010126891_100000210326 [1,1,0,0,0,0|1,0,1]=4 1256 B15R1.129 CCCCCC(=O)Cc1ccnc(c1)C 1458a_100000212188_200020672517 [1,1,0,0,0,0|1,0,1]=4 1257 B15R1.129 CCCCCC(=O)Cc1ccnc(c1)Cl 1458a_100000212188_100000764220 [1,1,0,0,0,0|1,0,1]=4 1258 B15R1.129 CCCCCC(=O)Cc1cncc(c1)Br 1458a_100000212188_100011740620 [1,1,0,0,0,0|1,0,1]=4 1259 B15R1.129 CCCCCC(=O)Cc1cncc(c1)Br 1458a_100000239331_100000210326 [1,1,0,0,0,0|1,0,1]=4 1260 B15R1.129 CCCCCC(=O)Cc1cncc(c1)C 1458a_100000212188_100000716715 [1,1,0,0,0,0|1,0,1]=4 1261 B15R1.129 CCCCCC(=O)Cc1cncc(c1)Cl 1458a_100000212188_100016992070 [1,1,0,0,0,0|1,0,1]=4 1262 B15R1.129 CCCCCC(=O)Cc1cncc(c1)F 1458a_100000212188_100000725299 [1,1,0,0,0,0|1,0,1]=4 1263 B15R1.129 CCCCCC(=O)Cc1cncc(c1)F 1458a_100011667516_100000210326 [1,1,0,0,0,0|1,0,1]=4 1264 B15R1.129 CCCCCC(=O)Nc1cccc(c1)Br 11a_100000210019_100000212188 [1,1,0,0,0,0|1,0,0]=3 1265 B15R1.129 CCCCCC(=O)Nc1cccc(c1)Br 1626a_100000210019_100000212188 [1,1,0,0,0,0|1,0,0]=3 1266 B15R1.129 CCCCCC(=O)Nc1cccc(c1)Br 22a_100000210019_100000212188 [1,1,0,0,0,0|1,0,0]=3 1267 B15R1.129 CCCCCC(=O)Nc1cccc(c1)Br 527a_100000210019_100000212188 [1,1,0,0,0,0|1,0,0]=3 1268 B15R1.129 CCCCCC(=O)Nc1cccc(c1)C 11a_100000188690_100000212188 [1,1,0,0,0,0|1,0,0]=3 1269 B15R1.129 CCCCCC(=O)Nc1cccc(c1)C 1626a_100000188690_100000212188 [1,1,0,0,0,0|1,0,0]=3 1270 B15R1.129 CCCCCC(=O)Nc1cccc(c1)C 22a_100000188690_100000212188 [1,1,0,0,0,0|1,0,0]=3 1271 B15R1.129 CCCCCC(=O)Nc1cccc(c1)C 527a_100000188690_100000212188 [1,1,0,0,0,0|1,0,0]=3 1272 B15R1.129 CCCCCC(=O)Nc1cccc(c1)Cl 11a_100000185859_100000212188 [1,1,0,0,0,0|1,0,0]=3 1273 B15R1.129 CCCCCC(=O)Nc1cccc(c1)Cl 1626a_100000185859_100000212188 [1,1,0,0,0,0|1,0,0]=3 1274 B15R1.129 CCCCCC(=O)Nc1cccc(c1)Cl 22a_100000185859_100000212188 [1,1,0,0,0,0|1,0,0]=3 1275 B15R1.129 CCCCCC(=O)Nc1cccc(c1)F 11a_100000210047_100000212188 [1,1,0,0,0,0|1,0,0]=3 1276 B15R1.129 CCCCCC(=O)Nc1cccc(c1)F 1626a_100000210047_100000212188 [1,1,0,0,0,0|1,0,0]=3 1277 B15R1.129 CCCCCC(=O)Nc1cccc(c1)F 22a_100000210047_100000212188 [1,1,0,0,0,0|1,0,0]=3 1278 B15R1.129 CCCCCC(=O)Nc1cccc(c1)F 527a_100000210047_100000212188 [1,1,0,0,0,0|1,0,0]=3 1279 B15R1.129 CCCCCC(=O)Nc1cccc(c1)I 11a_100000211102_100000212188 [1,1,0,0,0,0|1,0,0]=3 1280 B15R1.129 CCCCCC(=O)Nc1cccc(c1)I 1626a_100000211102_100000212188 [1,1,0,0,0,0|1,0,0]=3 1281 B15R1.129 CCCCCC(=O)Nc1cccc(c1)I 22a_100000211102_100000212188 [1,1,0,0,0,0|1,0,0]=3 1282 B15R1.129 CCCCCC(=O)Nc1cccc(c1)I 527a_100000211102_100000212188 [1,1,0,0,0,0|1,0,0]=3 1283 B15R1.129 CCCCCC(=O)Nc1cccc(c1)O 1626a_100000210217_100000212188 [1,1,0,0,0,0|1,0,0]=3 1284 B15R1.129 CCCCCC(=O)Nc1cccc(c1)O 22a_100000210217_100000212188 [1,1,0,0,0,0|1,0,0]=3 1285 B15R1.129 CCCCCC(=O)Nc1cccc(c1)O 527a_100000210217_100000212188 [1,1,0,0,0,0|1,0,0]=3 1286 B15R1.129 CCCCNC(=O)Cc1cccc(c1)Br 11a_100000102301_100000747190 [1,1,0,0,0,0|1,0,1]=4 1287 B15R1.129 CCCCNC(=O)Cc1cccc(c1)Br 240690a_100000102301_100000747190 [1,1,0,0,0,0|1,0,1]=4 1288 B15R1.129 CCCCNC(=O)Cc1cccc(c1)Br 527a_100000102301_100000747190 [1,1,0,0,0,0|1,0,1]=4 1289 B15R1.129 CCCCNC(=O)Cc1cccc(c1)C 11a_100000102301_100011206899 [1,1,0,0,0,0|1,0,1]=4 1290 B15R1.129 CCCCNC(=O)Cc1cccc(c1)C 1626a_100000102301_100011206899 [1,1,0,0,0,0|1,0,1]=4 1291 B15R1.129 CCCCNC(=O)Cc1cccc(c1)C 240690a_100000102301_100011206899 [1,1,0,0,0,0|1,0,1]=4 1292 B15R1.129 CCCCNC(=O)Cc1cccc(c1)C 527a_100000102301_100011206899 [1,1,0,0,0,0|1,0,1]=4 1293 B15R1.129 CCCCNC(=O)Cc1cccc(c1)Cl 11a_100000102301_100000749307 [1,1,0,0,0,0|1,0,1]=4 1294 B15R1.129 CCCCNC(=O)Cc1cccc(c1)Cl 1626a_100000102301_100000749307 [1,1,0,0,0,0|1,0,1]=4 1295 B15R1.129 CCCCNC(=O)Cc1cccc(c1)Cl 240690a_100000102301_100000749307 [1,1,0,0,0,0|1,0,1]=4 1296 B15R1.129 CCCCNC(=O)Cc1cccc(c1)Cl 527a_100000102301_100000749307 [1,1,0,0,0,0|1,0,1]=4 1297 B15R1.129 CCCCNC(=O)Cc1cccc(c1)F 11a_100000102301_100000211661 [1,1,0,0,0,0|1,0,1]=4 1298 B15R1.129 CCCCNC(=O)Cc1cccc(c1)F 1626a_100000102301_100000211661 [1,1,0,0,0,0|1,0,1]=4 1299 B15R1.129 CCCCNC(=O)Cc1cccc(c1)F 240690a_100000102301_100000211661 [1,1,0,0,0,0|1,0,1]=4 1300 B15R1.129 CCCCNC(=O)Cc1cccc(c1)F 527a_100000102301_100000211661 [1,1,0,0,0,0|1,0,1]=4 1301 B15R1.129 CCCCNC(=O)Cc1cccc(c1)I 11a_100000102301_100000238430 [1,1,0,0,0,0|1,0,1]=4 1302 B15R1.129 CCCCNC(=O)Cc1cccc(c1)I 1626a_100000102301_100000238430 [1,1,0,0,0,0|1,0,1]=4 1303 B15R1.129 CCCCNC(=O)Cc1cccc(c1)I 240690a_100000102301_100000238430 [1,1,0,0,0,0|1,0,1]=4 1304 B15R1.129 CCCCNC(=O)Cc1cccc(c1)I 527a_100000102301_100000238430 [1,1,0,0,0,0|1,0,1]=4 1305 B15R1.129 CCCCNC(=O)Cc1cccc(c1)O 240690a_100000102301_100000745134 [1,1,0,0,0,0|1,0,1]=4 1306 B15R1.129 CCCCNC(=O)Cc1cccc(c1)O 527a_100000102301_100000745134 [1,1,0,0,0,0|1,0,1]=4 1307 B15R1.129 CCCCNC(=O)Nc1cccc(c1)Br 2430a_100000210019_100000102301 [1,1,0,0,0,0|2,0,0]=4 1308 B15R1.129 CCCCNC(=O)Nc1cccc(c1)Br 512a_100000210019_100000102301 [1,1,0,0,0,0|2,0,0]=4 1309 B15R1.129 CCCCNC(=O)Nc1cccc(c1)C 2430a_100000188690_100000102301 [1,1,0,0,0,0|2,0,0]=4 1310 B15R1.129 CCCCNC(=O)Nc1cccc(c1)C 512a_100000188690_100000102301 [1,1,0,0,0,0|2,0,0]=4 1311 B15R1.129 CCCCNC(=O)Nc1cccc(c1)Cl 2430a_100000185859_100000102301 [1,1,0,0,0,0|2,0,0]=4 1312 B15R1.129 CCCCNC(=O)Nc1cccc(c1)F 2430a_100000210047_100000102301 [1,1,0,0,0,0|2,0,0]=4 1313 B15R1.129 CCCCNC(=O)Nc1cccc(c1)F 512a_100000210047_100000102301 [1,1,0,0,0,0|2,0,0]=4 1314 B15R1.129 CCCCNC(=O)Nc1cccc(c1)I 2430a_100000211102_100000102301 [1,1,0,0,0,0|2,0,0]=4 1315 B15R1.129 CCCCNC(=O)Nc1cccc(c1)I 512a_100000211102_100000102301 [1,1,0,0,0,0|2,0,0]=4 1316 B15R1.129 CCCCNC(=O)Nc1cccc(c1)O 2430a_100000210217_100000102301 [1,1,0,0,0,0|2,0,0]=4 1317 B15R1.129 CCCCNC(=O)Nc1cccc(c1)O 512a_100000210217_100000102301 [1,1,0,0,0,0|2,0,0]=4 1318 B15R1.129 CCCNCC(=O)Nc1cccc(c1)Cl 2230a_100102560372_100000210303 [1,1,0,0,0,0|2,0,0]=4 1319 B15R1.129 CCCNCC(=O)Nc1cccc(c1)F 2230a_100000168492_100000210303 [1,1,0,0,0,0|2,0,0]=4 1320 B15R1.129 CCCNCC(=O)Nc1cccc(c1)F 34a_100000168492_100000210303 [1,1,0,0,0,0|2,0,0]=4 1321 B15R1.129 CCCOCC(=O)Cc1cccc(c1)Br 1458a_100000745993_100000211773 [1,1,0,0,0,0|1,0,1]=4 1322 B15R1.129 CCCOCC(=O)Cc1cccc(c1)C 1458a_100000745993_100000211840 [1,1,0,0,0,0|1,0,1]=4 1323 B15R1.129 CCCOCC(=O)Cc1cccc(c1)Cl 1458a_100000745993_100000181238 [1,1,0,0,0,0|1,0,1]=4 1324 B15R1.129 CCCOCC(=O)Cc1cccc(c1)F 1458a_100000745993_100000230114 [1,1,0,0,0,0|1,0,1]=4 1325 B15R1.129 CCCOCC(=O)Cc1cccc(c1)I 1458a_100000745993_100011218688 [1,1,0,0,0,0|1,0,1]=4 1326 B15R1.129 CCCOCC(=O)Cc1cccc(c1)O 1458a_100000745993_100011660834 [1,1,0,0,0,0|1,0,1]=4 1327 B15R1.129 CCCOCC(=O)Nc1cccc(c1)Br 11a_100000210019_100000745993 [1,1,0,0,0,0|2,0,0]=4 1328 B15R1.129 CCCOCC(=O)Nc1cccc(c1)Br 1626a_100000210019_100000745993 [1,1,0,0,0,0|2,0,0]=4 1329 B15R1.129 CCCOCC(=O)Nc1cccc(c1)Br 22a_100000210019_100000745993 [1,1,0,0,0,0|2,0,0]=4 1330 B15R1.129 CCCOCC(=O)Nc1cccc(c1)Br 34a_100000210258_100000183509 [1,1,0,0,0,0|2,0,0]=4 1331 B15R1.129 CCCOCC(=O)Nc1cccc(c1)Br 527a_100000210019_100000745993 [1,1,0,0,0,0|2,0,0]=4 1332 B15R1.129 CCCOCC(=O)Nc1cccc(c1)C 11a_100000188690_100000745993 [1,1,0,0,0,0|2,0,0]=4 1333 B15R1.129 CCCOCC(=O)Nc1cccc(c1)C 1626a_100000188690_100000745993 [1,1,0,0,0,0|2,0,0]=4 1334 B15R1.129 CCCOCC(=O)Nc1cccc(c1)C 22a_100000188690_100000745993 [1,1,0,0,0,0|2,0,0]=4 1335 B15R1.129 CCCOCC(=O)Nc1cccc(c1)C 34a_100000210258_100000182861 [1,1,0,0,0,0|2,0,0]=4 1336 B15R1.129 CCCOCC(=O)Nc1cccc(c1)C 34a_100000749660_100000210303 [1,1,0,0,0,0|2,0,0]=4 1337 B15R1.129 CCCOCC(=O)Nc1cccc(c1)C 527a_100000188690_100000745993 [1,1,0,0,0,0|2,0,0]=4 1338 B15R1.129 CCCOCC(=O)Nc1cccc(c1)Cl 11a_100000185859_100000745993 [1,1,0,0,0,0|2,0,0]=4 1339 B15R1.129 CCCOCC(=O)Nc1cccc(c1)Cl 1626a_100000185859_100000745993 [1,1,0,0,0,0|2,0,0]=4 1340 B15R1.129 CCCOCC(=O)Nc1cccc(c1)Cl 22a_100000185859_100000745993 [1,1,0,0,0,0|2,0,0]=4 1341 B15R1.129 CCCOCC(=O)Nc1cccc(c1)Cl 34a_100000210258_100000182995 [1,1,0,0,0,0|2,0,0]=4 1342 B15R1.129 CCCOCC(=O)Nc1cccc(c1)F 11a_100000210047_100000745993 [1,1,0,0,0,0|2,0,0]=4 1343 B15R1.129 CCCOCC(=O)Nc1cccc(c1)F 1626a_100000210047_100000745993 [1,1,0,0,0,0|2,0,0]=4 1344 B15R1.129 CCCOCC(=O)Nc1cccc(c1)F 22a_100000210047_100000745993 [1,1,0,0,0,0|2,0,0]=4 1345 B15R1.129 CCCOCC(=O)Nc1cccc(c1)F 34a_100000210258_100000183335 [1,1,0,0,0,0|2,0,0]=4 1346 B15R1.129 CCCOCC(=O)Nc1cccc(c1)F 527a_100000210047_100000745993 [1,1,0,0,0,0|2,0,0]=4 1347 B15R1.129 CCCOCC(=O)Nc1cccc(c1)I 11a_100000211102_100000745993 [1,1,0,0,0,0|2,0,0]=4 1348 B15R1.129 CCCOCC(=O)Nc1cccc(c1)I 1626a_100000211102_100000745993 [1,1,0,0,0,0|2,0,0]=4 1349 B15R1.129 CCCOCC(=O)Nc1cccc(c1)I 22a_100000211102_100000745993 [1,1,0,0,0,0|2,0,0]=4 1350 B15R1.129 CCCOCC(=O)Nc1cccc(c1)I 527a_100000211102_100000745993 [1,1,0,0,0,0|2,0,0]=4 1351 B15R1.129 CCCOCC(=O)Nc1cccc(c1)O 1626a_100000210217_100000745993 [1,1,0,0,0,0|2,0,0]=4 1352 B15R1.129 CCCOCC(=O)Nc1cccc(c1)O 22a_100000210217_100000745993 [1,1,0,0,0,0|2,0,0]=4 1353 B15R1.129 CCCOCC(=O)Nc1cccc(c1)O 34a_100000210258_100011236192 [1,1,0,0,0,0|2,0,0]=4 1354 B15R1.129 CCCOCC(=O)Nc1cccc(c1)O 527a_100000210217_100000745993 [1,1,0,0,0,0|2,0,0]=4 1355 B15R1.129 CCCSCC(=O)Cc1cccc(c1)Br 1458a_100000217233_100000211773 [1,1,0,0,0,0|1,0,1]=4 1356 B15R1.129 CCCSCC(=O)Cc1cccc(c1)C 1458a_100000217233_100000211840 [1,1,0,0,0,0|1,0,1]=4 1357 B15R1.129 CCCSCC(=O)Cc1cccc(c1)Cl 1458a_100000217233_100000181238 [1,1,0,0,0,0|1,0,1]=4 1358 B15R1.129 CCCSCC(=O)Cc1cccc(c1)F 1458a_100000217233_100000230114 [1,1,0,0,0,0|1,0,1]=4 1359 B15R1.129 CCCSCC(=O)Cc1cccc(c1)I 1458a_100000217233_100011218688 [1,1,0,0,0,0|1,0,1]=4 1360 B15R1.129 CCCSCC(=O)Cc1cccc(c1)O 1458a_100000217233_100011660834 [1,1,0,0,0,0|1,0,1]=4 1361 B15R1.129 CCCSCC(=O)Nc1cccc(c1)Br 11a_100000210019_100000217233 [1,1,0,0,0,0|2,0,0]=4 1362 B15R1.129 CCCSCC(=O)Nc1cccc(c1)Br 1626a_100000210019_100000217233 [1,1,0,0,0,0|2,0,0]=4 1363 B15R1.129 CCCSCC(=O)Nc1cccc(c1)Br 22a_100000210019_100000217233 [1,1,0,0,0,0|2,0,0]=4 1364 B15R1.129 CCCSCC(=O)Nc1cccc(c1)Br 527a_100000210019_100000217233 [1,1,0,0,0,0|2,0,0]=4 1365 B15R1.129 CCCSCC(=O)Nc1cccc(c1)Br 62a_100000183509_100000210303 [1,1,0,0,0,0|2,0,0]=4 1366 B15R1.129 CCCSCC(=O)Nc1cccc(c1)Br 62a_100000210303_100000183509 [1,1,0,0,0,0|2,0,0]=4 1367 B15R1.129 CCCSCC(=O)Nc1cccc(c1)C 11a_100000188690_100000217233 [1,1,0,0,0,0|2,0,0]=4 1368 B15R1.129 CCCSCC(=O)Nc1cccc(c1)C 1626a_100000188690_100000217233 [1,1,0,0,0,0|2,0,0]=4 1369 B15R1.129 CCCSCC(=O)Nc1cccc(c1)C 22a_100000188690_100000217233 [1,1,0,0,0,0|2,0,0]=4 1370 B15R1.129 CCCSCC(=O)Nc1cccc(c1)C 527a_100000188690_100000217233 [1,1,0,0,0,0|2,0,0]=4 1371 B15R1.129 CCCSCC(=O)Nc1cccc(c1)C 62a_100000210303_100000182861 [1,1,0,0,0,0|2,0,0]=4 1372 B15R1.129 CCCSCC(=O)Nc1cccc(c1)C 62a_100000243722_100000210303 [1,1,0,0,0,0|2,0,0]=4 1373 B15R1.129 CCCSCC(=O)Nc1cccc(c1)Cl 11a_100000185859_100000217233 [1,1,0,0,0,0|2,0,0]=4 1374 B15R1.129 CCCSCC(=O)Nc1cccc(c1)Cl 1626a_100000185859_100000217233 [1,1,0,0,0,0|2,0,0]=4 1375 B15R1.129 CCCSCC(=O)Nc1cccc(c1)Cl 22a_100000185859_100000217233 [1,1,0,0,0,0|2,0,0]=4 1376 B15R1.129 CCCSCC(=O)Nc1cccc(c1)Cl 62a_100000210303_100000182995 [1,1,0,0,0,0|2,0,0]=4 1377 B15R1.129 CCCSCC(=O)Nc1cccc(c1)F 11a_100000210047_100000217233 [1,1,0,0,0,0|2,0,0]=4 1378 B15R1.129 CCCSCC(=O)Nc1cccc(c1)F 1626a_100000210047_100000217233 [1,1,0,0,0,0|2,0,0]=4 1379 B15R1.129 CCCSCC(=O)Nc1cccc(c1)F 22a_100000210047_100000217233 [1,1,0,0,0,0|2,0,0]=4 1380 B15R1.129 CCCSCC(=O)Nc1cccc(c1)F 527a_100000210047_100000217233 [1,1,0,0,0,0|2,0,0]=4 1381 B15R1.129 CCCSCC(=O)Nc1cccc(c1)F 62a_100000183335_100000210303 [1,1,0,0,0,0|2,0,0]=4 1382 B15R1.129 CCCSCC(=O)Nc1cccc(c1)F 62a_100000210303_100000183335 [1,1,0,0,0,0|2,0,0]=4 1383 B15R1.129 CCCSCC(=O)Nc1cccc(c1)I 11a_100000211102_100000217233 [1,1,0,0,0,0|2,0,0]=4 1384 B15R1.129 CCCSCC(=O)Nc1cccc(c1)I 1626a_100000211102_100000217233 [1,1,0,0,0,0|2,0,0]=4 1385 B15R1.129 CCCSCC(=O)Nc1cccc(c1)I 22a_100000211102_100000217233 [1,1,0,0,0,0|2,0,0]=4 1386 B15R1.129 CCCSCC(=O)Nc1cccc(c1)I 527a_100000211102_100000217233 [1,1,0,0,0,0|2,0,0]=4 1387 B15R1.129 CCCSCC(=O)Nc1cccc(c1)O 1626a_100000210217_100000217233 [1,1,0,0,0,0|2,0,0]=4 1388 B15R1.129 CCCSCC(=O)Nc1cccc(c1)O 22a_100000210217_100000217233 [1,1,0,0,0,0|2,0,0]=4 1389 B15R1.129 CCCSCC(=O)Nc1cccc(c1)O 527a_100000210217_100000217233 [1,1,0,0,0,0|2,0,0]=4 1390 B15R1.129 CCCSCC(=O)Nc1cccc(c1)O 62a_100000210303_100011236192 [1,1,0,0,0,0|2,0,0]=4 1391 B15R1.129 CCNCCC(=O)Nc1cccc(c1)C 2230a_100015525214_100011194834 [1,1,0,0,0,0|2,0,0]=4 1392 B15R1.129 CCNCCC(=O)Nc1cccc(c1)C 2230a_200015186421_100000210202 [1,1,0,0,0,0|2,0,0]=4 1393 B15R1.129 CCNCCC(=O)Nc1cccc(c1)C 34a_200015186421_100000210202 [1,1,0,0,0,0|2,0,0]=4 1394 B15R1.129 CCNCCC(=O)Nc1cccc(c1)Cl 2230a_100015525214_100000242061 [1,1,0,0,0,0|2,0,0]=4 1395 B15R1.129 CCNCCC(=O)Nc1cccc(c1)F 2230a_100015185233_100000210202 [1,1,0,0,0,0|2,0,0]=4 1396 B15R1.129 CCNCCC(=O)Nc1cccc(c1)F 2230a_100015525214_100000242062 [1,1,0,0,0,0|2,0,0]=4 1397 B15R1.129 CCNCCC(=O)Nc1cccc(c1)F 34a_100015185233_100000210202 [1,1,0,0,0,0|2,0,0]=4 1398 B15R1.129 CCNCCC(=O)Nc1cccc(c1)O 2230a_100015525214_200011436826 [1,1,0,0,0,0|2,0,0]=4 1399 B15R1.129 CCOCCC(=O)Cc1cccc(c1)Br 1458a_100000747190_100011215890 [1,1,0,0,0,0|1,0,1]=4 1400 B15R1.129 CCOCCC(=O)Cc1cccc(c1)Br 1458a_100000749530_100000211773 [1,1,0,0,0,0|1,0,1]=4 1401 B15R1.129 CCOCCC(=O)Cc1cccc(c1)C 1458a_100000749530_100000211840 [1,1,0,0,0,0|1,0,1]=4 1402 B15R1.129 CCOCCC(=O)Cc1cccc(c1)C 1458a_100011206899_100011215890 [1,1,0,0,0,0|1,0,1]=4 1403 B15R1.129 CCOCCC(=O)Cc1cccc(c1)Cl 1458a_100000749307_100011215890 [1,1,0,0,0,0|1,0,1]=4 1404 B15R1.129 CCOCCC(=O)Cc1cccc(c1)Cl 1458a_100000749530_100000181238 [1,1,0,0,0,0|1,0,1]=4 1405 B15R1.129 CCOCCC(=O)Cc1cccc(c1)F 1458a_100000211661_100011215890 [1,1,0,0,0,0|1,0,1]=4 1406 B15R1.129 CCOCCC(=O)Cc1cccc(c1)F 1458a_100000749530_100000230114 [1,1,0,0,0,0|1,0,1]=4 1407 B15R1.129 CCOCCC(=O)Cc1cccc(c1)I 1458a_100000238430_100011215890 [1,1,0,0,0,0|1,0,1]=4 1408 B15R1.129 CCOCCC(=O)Cc1cccc(c1)I 1458a_100000749530_100011218688 [1,1,0,0,0,0|1,0,1]=4 1409 B15R1.129 CCOCCC(=O)Cc1cccc(c1)O 1458a_100000745134_100011215890 [1,1,0,0,0,0|1,0,1]=4 1410 B15R1.129 CCOCCC(=O)Cc1cccc(c1)O 1458a_100000749530_100011660834 [1,1,0,0,0,0|1,0,1]=4 1411 B15R1.129 CCOCCC(=O)Nc1cccc(c1)Br 11a_100000210019_100000749530 [1,1,0,0,0,0|2,0,0]=4 1412 B15R1.129 CCOCCC(=O)Nc1cccc(c1)Br 1626a_100000210019_100000749530 [1,1,0,0,0,0|2,0,0]=4 1413 B15R1.129 CCOCCC(=O)Nc1cccc(c1)Br 22a_100000210019_100000749530 [1,1,0,0,0,0|2,0,0]=4 1414 B15R1.129 CCOCCC(=O)Nc1cccc(c1)Br 527a_100000210019_100000749530 [1,1,0,0,0,0|2,0,0]=4 1415 B15R1.129 CCOCCC(=O)Nc1cccc(c1)C 11a_100000188690_100000749530 [1,1,0,0,0,0|2,0,0]=4 1416 B15R1.129 CCOCCC(=O)Nc1cccc(c1)C 1626a_100000188690_100000749530 [1,1,0,0,0,0|2,0,0]=4 1417 B15R1.129 CCOCCC(=O)Nc1cccc(c1)C 22a_100000188690_100000749530 [1,1,0,0,0,0|2,0,0]=4 1418 B15R1.129 CCOCCC(=O)Nc1cccc(c1)C 34a_100121572206_100011194834 [1,1,0,0,0,0|2,0,0]=4 1419 B15R1.129 CCOCCC(=O)Nc1cccc(c1)C 527a_100000188690_100000749530 [1,1,0,0,0,0|2,0,0]=4 1420 B15R1.129 CCOCCC(=O)Nc1cccc(c1)Cl 11a_100000185859_100000749530 [1,1,0,0,0,0|2,0,0]=4 1421 B15R1.129 CCOCCC(=O)Nc1cccc(c1)Cl 1626a_100000185859_100000749530 [1,1,0,0,0,0|2,0,0]=4 1422 B15R1.129 CCOCCC(=O)Nc1cccc(c1)Cl 22a_100000185859_100000749530 [1,1,0,0,0,0|2,0,0]=4 1423 B15R1.129 CCOCCC(=O)Nc1cccc(c1)Cl 34a_100121572206_100000242061 [1,1,0,0,0,0|2,0,0]=4 1424 B15R1.129 CCOCCC(=O)Nc1cccc(c1)F 11a_100000210047_100000749530 [1,1,0,0,0,0|2,0,0]=4 1425 B15R1.129 CCOCCC(=O)Nc1cccc(c1)F 1626a_100000210047_100000749530 [1,1,0,0,0,0|2,0,0]=4 1426 B15R1.129 CCOCCC(=O)Nc1cccc(c1)F 22a_100000210047_100000749530 [1,1,0,0,0,0|2,0,0]=4 1427 B15R1.129 CCOCCC(=O)Nc1cccc(c1)F 34a_100121572206_100000242062 [1,1,0,0,0,0|2,0,0]=4 1428 B15R1.129 CCOCCC(=O)Nc1cccc(c1)F 527a_100000210047_100000749530 [1,1,0,0,0,0|2,0,0]=4 1429 B15R1.129 CCOCCC(=O)Nc1cccc(c1)I 11a_100000211102_100000749530 [1,1,0,0,0,0|2,0,0]=4 1430 B15R1.129 CCOCCC(=O)Nc1cccc(c1)I 1626a_100000211102_100000749530 [1,1,0,0,0,0|2,0,0]=4 1431 B15R1.129 CCOCCC(=O)Nc1cccc(c1)I 22a_100000211102_100000749530 [1,1,0,0,0,0|2,0,0]=4 1432 B15R1.129 CCOCCC(=O)Nc1cccc(c1)I 527a_100000211102_100000749530 [1,1,0,0,0,0|2,0,0]=4 1433 B15R1.129 CCOCCC(=O)Nc1cccc(c1)O 1626a_100000210217_100000749530 [1,1,0,0,0,0|2,0,0]=4 1434 B15R1.129 CCOCCC(=O)Nc1cccc(c1)O 22a_100000210217_100000749530 [1,1,0,0,0,0|2,0,0]=4 1435 B15R1.129 CCOCCC(=O)Nc1cccc(c1)O 34a_100121572206_200011436826 [1,1,0,0,0,0|2,0,0]=4 1436 B15R1.129 CCOCCC(=O)Nc1cccc(c1)O 527a_100000210217_100000749530 [1,1,0,0,0,0|2,0,0]=4 1437 B15R1.129 CCSCCC(=O)Cc1cccc(c1)Br 1458a_100000230768_100000211773 [1,1,0,0,0,0|1,0,1]=4 1438 B15R1.129 CCSCCC(=O)Cc1cccc(c1)Br 1458a_100000747190_100000757381 [1,1,0,0,0,0|1,0,1]=4 1439 B15R1.129 CCSCCC(=O)Cc1cccc(c1)C 1458a_100000230768_100000211840 [1,1,0,0,0,0|1,0,1]=4 1440 B15R1.129 CCSCCC(=O)Cc1cccc(c1)C 1458a_100011206899_100000757381 [1,1,0,0,0,0|1,0,1]=4 1441 B15R1.129 CCSCCC(=O)Cc1cccc(c1)Cl 1458a_100000230768_100000181238 [1,1,0,0,0,0|1,0,1]=4 1442 B15R1.129 CCSCCC(=O)Cc1cccc(c1)Cl 1458a_100000749307_100000757381 [1,1,0,0,0,0|1,0,1]=4 1443 B15R1.129 CCSCCC(=O)Cc1cccc(c1)F 1458a_100000211661_100000757381 [1,1,0,0,0,0|1,0,1]=4 1444 B15R1.129 CCSCCC(=O)Cc1cccc(c1)F 1458a_100000230768_100000230114 [1,1,0,0,0,0|1,0,1]=4 1445 B15R1.129 CCSCCC(=O)Cc1cccc(c1)I 1458a_100000230768_100011218688 [1,1,0,0,0,0|1,0,1]=4 1446 B15R1.129 CCSCCC(=O)Cc1cccc(c1)I 1458a_100000238430_100000757381 [1,1,0,0,0,0|1,0,1]=4 1447 B15R1.129 CCSCCC(=O)Cc1cccc(c1)O 1458a_100000230768_100011660834 [1,1,0,0,0,0|1,0,1]=4 1448 B15R1.129 CCSCCC(=O)Cc1cccc(c1)O 1458a_100000745134_100000757381 [1,1,0,0,0,0|1,0,1]=4 1449 B15R1.129 CCSCCC(=O)Nc1cccc(c1)Br 11a_100000210019_100000230768 [1,1,0,0,0,0|2,0,0]=4 1450 B15R1.129 CCSCCC(=O)Nc1cccc(c1)Br 1626a_100000210019_100000230768 [1,1,0,0,0,0|2,0,0]=4 1451 B15R1.129 CCSCCC(=O)Nc1cccc(c1)Br 22a_100000210019_100000230768 [1,1,0,0,0,0|2,0,0]=4 1452 B15R1.129 CCSCCC(=O)Nc1cccc(c1)Br 527a_100000210019_100000230768 [1,1,0,0,0,0|2,0,0]=4 1453 B15R1.129 CCSCCC(=O)Nc1cccc(c1)C 11a_100000188690_100000230768 [1,1,0,0,0,0|2,0,0]=4 1454 B15R1.129 CCSCCC(=O)Nc1cccc(c1)C 1626a_100000188690_100000230768 [1,1,0,0,0,0|2,0,0]=4 1455 B15R1.129 CCSCCC(=O)Nc1cccc(c1)C 22a_100000188690_100000230768 [1,1,0,0,0,0|2,0,0]=4 1456 B15R1.129 CCSCCC(=O)Nc1cccc(c1)C 527a_100000188690_100000230768 [1,1,0,0,0,0|2,0,0]=4 1457 B15R1.129 CCSCCC(=O)Nc1cccc(c1)C 62a_100000210202_100011194834 [1,1,0,0,0,0|2,0,0]=4 1458 B15R1.129 CCSCCC(=O)Nc1cccc(c1)Cl 11a_100000185859_100000230768 [1,1,0,0,0,0|2,0,0]=4 1459 B15R1.129 CCSCCC(=O)Nc1cccc(c1)Cl 1626a_100000185859_100000230768 [1,1,0,0,0,0|2,0,0]=4 1460 B15R1.129 CCSCCC(=O)Nc1cccc(c1)Cl 22a_100000185859_100000230768 [1,1,0,0,0,0|2,0,0]=4 1461 B15R1.129 CCSCCC(=O)Nc1cccc(c1)Cl 62a_100000210202_100000242061 [1,1,0,0,0,0|2,0,0]=4 1462 B15R1.129 CCSCCC(=O)Nc1cccc(c1)F 11a_100000210047_100000230768 [1,1,0,0,0,0|2,0,0]=4 1463 B15R1.129 CCSCCC(=O)Nc1cccc(c1)F 1626a_100000210047_100000230768 [1,1,0,0,0,0|2,0,0]=4 1464 B15R1.129 CCSCCC(=O)Nc1cccc(c1)F 22a_100000210047_100000230768 [1,1,0,0,0,0|2,0,0]=4 1465 B15R1.129 CCSCCC(=O)Nc1cccc(c1)F 527a_100000210047_100000230768 [1,1,0,0,0,0|2,0,0]=4 1466 B15R1.129 CCSCCC(=O)Nc1cccc(c1)F 62a_100000210202_100000242062 [1,1,0,0,0,0|2,0,0]=4 1467 B15R1.129 CCSCCC(=O)Nc1cccc(c1)I 11a_100000211102_100000230768 [1,1,0,0,0,0|2,0,0]=4 1468 B15R1.129 CCSCCC(=O)Nc1cccc(c1)I 1626a_100000211102_100000230768 [1,1,0,0,0,0|2,0,0]=4 1469 B15R1.129 CCSCCC(=O)Nc1cccc(c1)I 22a_100000211102_100000230768 [1,1,0,0,0,0|2,0,0]=4 1470 B15R1.129 CCSCCC(=O)Nc1cccc(c1)I 527a_100000211102_100000230768 [1,1,0,0,0,0|2,0,0]=4 1471 B15R1.129 CCSCCC(=O)Nc1cccc(c1)O 1626a_100000210217_100000230768 [1,1,0,0,0,0|2,0,0]=4 1472 B15R1.129 CCSCCC(=O)Nc1cccc(c1)O 22a_100000210217_100000230768 [1,1,0,0,0,0|2,0,0]=4 1473 B15R1.129 CCSCCC(=O)Nc1cccc(c1)O 527a_100000210217_100000230768 [1,1,0,0,0,0|2,0,0]=4 1474 B15R1.129 CCSCCC(=O)Nc1cccc(c1)O 62a_100000210202_200011436826 [1,1,0,0,0,0|2,0,0]=4 1475 B15R1.129 CNCCCC(=O)Nc1cccc(c1)C 2230a_106832991635_100000184976 [1,1,0,0,0,0|2,0,0]=4 1476 B15R1.129 CNCCCC(=O)Nc1cccc(c1)C 34a_100102657272_100000184976 [1,1,0,0,0,0|2,0,0]=4 1477 B15R1.129 CNCCCC(=O)Nc1cccc(c1)C 7a_106832991635_100000184976 [1,1,0,0,0,0|2,0,0]=4 1478 B15R1.129 CNCCCC(=O)Nc1cccc(c1)Cl 2230a_114873766722_200000210301 [1,1,0,0,0,0|2,0,0]=4 1479 B15R1.129 CNCCCC(=O)Nc1cccc(c1)Cl 34a_114873766722_200000210301 [1,1,0,0,0,0|2,0,0]=4 1480 B15R1.129 COCCCC(=O)Cc1cccc(c1)Br 1458a_100000741012_100000211773 [1,1,0,0,0,0|1,0,1]=4 1481 B15R1.129 COCCCC(=O)Cc1cccc(c1)Br 1458a_100000747190_100000740836 [1,1,0,0,0,0|1,0,1]=4 1482 B15R1.129 COCCCC(=O)Cc1cccc(c1)C 1458a_100000741012_100000211840 [1,1,0,0,0,0|1,0,1]=4 1483 B15R1.129 COCCCC(=O)Cc1cccc(c1)C 1458a_100011206899_100000740836 [1,1,0,0,0,0|1,0,1]=4 1484 B15R1.129 COCCCC(=O)Cc1cccc(c1)Cl 1458a_100000741012_100000181238 [1,1,0,0,0,0|1,0,1]=4 1485 B15R1.129 COCCCC(=O)Cc1cccc(c1)Cl 1458a_100000749307_100000740836 [1,1,0,0,0,0|1,0,1]=4 1486 B15R1.129 COCCCC(=O)Cc1cccc(c1)F 1458a_100000211661_100000740836 [1,1,0,0,0,0|1,0,1]=4 1487 B15R1.129 COCCCC(=O)Cc1cccc(c1)F 1458a_100000741012_100000230114 [1,1,0,0,0,0|1,0,1]=4 1488 B15R1.129 COCCCC(=O)Cc1cccc(c1)I 1458a_100000238430_100000740836 [1,1,0,0,0,0|1,0,1]=4 1489 B15R1.129 COCCCC(=O)Cc1cccc(c1)I 1458a_100000741012_100011218688 [1,1,0,0,0,0|1,0,1]=4 1490 B15R1.129 COCCCC(=O)Cc1cccc(c1)O 1458a_100000741012_100011660834 [1,1,0,0,0,0|1,0,1]=4 1491 B15R1.129 COCCCC(=O)Cc1cccc(c1)O 1458a_100000745134_100000740836 [1,1,0,0,0,0|1,0,1]=4 1492 B15R1.129 COCCCC(=O)Nc1cccc(c1)Br 11a_100000210019_100000741012 [1,1,0,0,0,0|2,0,0]=4 1493 B15R1.129 COCCCC(=O)Nc1cccc(c1)Br 1626a_100000210019_100000741012 [1,1,0,0,0,0|2,0,0]=4 1494 B15R1.129 COCCCC(=O)Nc1cccc(c1)Br 22a_100000210019_100000741012 [1,1,0,0,0,0|2,0,0]=4 1495 B15R1.129 COCCCC(=O)Nc1cccc(c1)Br 527a_100000210019_100000741012 [1,1,0,0,0,0|2,0,0]=4 1496 B15R1.129 COCCCC(=O)Nc1cccc(c1)C 11a_100000188690_100000741012 [1,1,0,0,0,0|2,0,0]=4 1497 B15R1.129 COCCCC(=O)Nc1cccc(c1)C 1626a_100000188690_100000741012 [1,1,0,0,0,0|2,0,0]=4 1498 B15R1.129 COCCCC(=O)Nc1cccc(c1)C 22a_100000188690_100000741012 [1,1,0,0,0,0|2,0,0]=4 1499 B15R1.129 COCCCC(=O)Nc1cccc(c1)C 34a_100138415774_100000184976 [1,1,0,0,0,0|2,0,0]=4 1500 B15R1.129 COCCCC(=O)Nc1cccc(c1)C 527a_100000188690_100000741012 [1,1,0,0,0,0|2,0,0]=4 1501 B15R1.129 COCCCC(=O)Nc1cccc(c1)Cl 11a_100000185859_100000741012 [1,1,0,0,0,0|2,0,0]=4 1502 B15R1.129 COCCCC(=O)Nc1cccc(c1)Cl 1626a_100000185859_100000741012 [1,1,0,0,0,0|2,0,0]=4 1503 B15R1.129 COCCCC(=O)Nc1cccc(c1)Cl 22a_100000185859_100000741012 [1,1,0,0,0,0|2,0,0]=4 1504 B15R1.129 COCCCC(=O)Nc1cccc(c1)F 11a_100000210047_100000741012 [1,1,0,0,0,0|2,0,0]=4 1505 B15R1.129 COCCCC(=O)Nc1cccc(c1)F 1626a_100000210047_100000741012 [1,1,0,0,0,0|2,0,0]=4 1506 B15R1.129 COCCCC(=O)Nc1cccc(c1)F 22a_100000210047_100000741012 [1,1,0,0,0,0|2,0,0]=4 1507 B15R1.129 COCCCC(=O)Nc1cccc(c1)F 527a_100000210047_100000741012 [1,1,0,0,0,0|2,0,0]=4 1508 B15R1.129 COCCCC(=O)Nc1cccc(c1)I 11a_100000211102_100000741012 [1,1,0,0,0,0|2,0,0]=4 1509 B15R1.129 COCCCC(=O)Nc1cccc(c1)I 1626a_100000211102_100000741012 [1,1,0,0,0,0|2,0,0]=4 1510 B15R1.129 COCCCC(=O)Nc1cccc(c1)I 22a_100000211102_100000741012 [1,1,0,0,0,0|2,0,0]=4 1511 B15R1.129 COCCCC(=O)Nc1cccc(c1)I 527a_100000211102_100000741012 [1,1,0,0,0,0|2,0,0]=4 1512 B15R1.129 COCCCC(=O)Nc1cccc(c1)O 1626a_100000210217_100000741012 [1,1,0,0,0,0|2,0,0]=4 1513 B15R1.129 COCCCC(=O)Nc1cccc(c1)O 22a_100000210217_100000741012 [1,1,0,0,0,0|2,0,0]=4 1514 B15R1.129 COCCCC(=O)Nc1cccc(c1)O 527a_100000210217_100000741012 [1,1,0,0,0,0|2,0,0]=4 1515 B15R1.129 CSCCCC(=O)Cc1cccc(c1)Br 1458a_100000173376_100000211773 [1,1,0,0,0,0|1,0,1]=4 1516 B15R1.129 CSCCCC(=O)Cc1cccc(c1)C 1458a_100000173376_100000211840 [1,1,0,0,0,0|1,0,1]=4 1517 B15R1.129 CSCCCC(=O)Cc1cccc(c1)Cl 1458a_100000173376_100000181238 [1,1,0,0,0,0|1,0,1]=4 1518 B15R1.129 CSCCCC(=O)Cc1cccc(c1)F 1458a_100000173376_100000230114 [1,1,0,0,0,0|1,0,1]=4 1519 B15R1.129 CSCCCC(=O)Cc1cccc(c1)I 1458a_100000173376_100011218688 [1,1,0,0,0,0|1,0,1]=4 1520 B15R1.129 CSCCCC(=O)Cc1cccc(c1)O 1458a_100000173376_100011660834 [1,1,0,0,0,0|1,0,1]=4 1521 B15R1.129 CSCCCC(=O)Nc1cccc(c1)Br 11a_100000210019_100000173376 [1,1,0,0,0,0|2,0,0]=4 1522 B15R1.129 CSCCCC(=O)Nc1cccc(c1)Br 1626a_100000210019_100000173376 [1,1,0,0,0,0|2,0,0]=4 1523 B15R1.129 CSCCCC(=O)Nc1cccc(c1)Br 22a_100000210019_100000173376 [1,1,0,0,0,0|2,0,0]=4 1524 B15R1.129 CSCCCC(=O)Nc1cccc(c1)Br 527a_100000210019_100000173376 [1,1,0,0,0,0|2,0,0]=4 1525 B15R1.129 CSCCCC(=O)Nc1cccc(c1)C 11a_100000188690_100000173376 [1,1,0,0,0,0|2,0,0]=4 1526 B15R1.129 CSCCCC(=O)Nc1cccc(c1)C 1626a_100000188690_100000173376 [1,1,0,0,0,0|2,0,0]=4 1527 B15R1.129 CSCCCC(=O)Nc1cccc(c1)C 22a_100000188690_100000173376 [1,1,0,0,0,0|2,0,0]=4 1528 B15R1.129 CSCCCC(=O)Nc1cccc(c1)C 527a_100000188690_100000173376 [1,1,0,0,0,0|2,0,0]=4 1529 B15R1.129 CSCCCC(=O)Nc1cccc(c1)C 62a_200000210301_100000184976 [1,1,0,0,0,0|2,0,0]=4 1530 B15R1.129 CSCCCC(=O)Nc1cccc(c1)Cl 11a_100000185859_100000173376 [1,1,0,0,0,0|2,0,0]=4 1531 B15R1.129 CSCCCC(=O)Nc1cccc(c1)Cl 1626a_100000185859_100000173376 [1,1,0,0,0,0|2,0,0]=4 1532 B15R1.129 CSCCCC(=O)Nc1cccc(c1)Cl 22a_100000185859_100000173376 [1,1,0,0,0,0|2,0,0]=4 1533 B15R1.129 CSCCCC(=O)Nc1cccc(c1)F 11a_100000210047_100000173376 [1,1,0,0,0,0|2,0,0]=4 1534 B15R1.129 CSCCCC(=O)Nc1cccc(c1)F 1626a_100000210047_100000173376 [1,1,0,0,0,0|2,0,0]=4 1535 B15R1.129 CSCCCC(=O)Nc1cccc(c1)F 22a_100000210047_100000173376 [1,1,0,0,0,0|2,0,0]=4 1536 B15R1.129 CSCCCC(=O)Nc1cccc(c1)F 527a_100000210047_100000173376 [1,1,0,0,0,0|2,0,0]=4 1537 B15R1.129 CSCCCC(=O)Nc1cccc(c1)I 11a_100000211102_100000173376 [1,1,0,0,0,0|2,0,0]=4 1538 B15R1.129 CSCCCC(=O)Nc1cccc(c1)I 1626a_100000211102_100000173376 [1,1,0,0,0,0|2,0,0]=4 1539 B15R1.129 CSCCCC(=O)Nc1cccc(c1)I 22a_100000211102_100000173376 [1,1,0,0,0,0|2,0,0]=4 1540 B15R1.129 CSCCCC(=O)Nc1cccc(c1)I 527a_100000211102_100000173376 [1,1,0,0,0,0|2,0,0]=4 1541 B15R1.129 CSCCCC(=O)Nc1cccc(c1)O 1626a_100000210217_100000173376 [1,1,0,0,0,0|2,0,0]=4 1542 B15R1.129 CSCCCC(=O)Nc1cccc(c1)O 22a_100000210217_100000173376 [1,1,0,0,0,0|2,0,0]=4 1543 B15R1.129 CSCCCC(=O)Nc1cccc(c1)O 527a_100000210217_100000173376 [1,1,0,0,0,0|2,0,0]=4 1544 B15R1.129 Cc1cccc(c1)CC(=O)CCCCF 1458a_100011206899_100000729493 [1,1,0,0,0,0|1,0,1]=4 1545 B15R1.129 Cc1cccc(c1)CC(=O)CCCCO 1458a_100000695505_100000211840 [1,1,0,0,0,0|1,0,1]=4 1546 B15R1.129 Cc1cccc(c1)CC(=O)CCCCO 1458a_100011206899_100000210776 [1,1,0,0,0,0|1,0,1]=4 1547 B15R1.129 Cc1cccc(c1)NC(=O)CCCCO 1626a_100000188690_100000695505 [1,1,0,0,0,0|2,0,0]=4 1548 B15R1.129 Cc1cccc(c1)NC(=O)CCCS[13CH3] 62a_200025704644_100000184976 [1,1,0,0,0,0|2,0,0]=4 1549 B15R1.129 O=C(CCCCF)Cc1cccc(c1)Br 1458a_100000747190_100000729493 [1,1,0,0,0,0|1,0,1]=4 1550 B15R1.129 O=C(CCCCF)Cc1cccc(c1)Cl 1458a_100000749307_100000729493 [1,1,0,0,0,0|1,0,1]=4 1551 B15R1.129 O=C(CCCCF)Cc1cccc(c1)F 1458a_100000211661_100000729493 [1,1,0,0,0,0|1,0,1]=4 1552 B15R1.129 O=C(CCCCF)Cc1cccc(c1)I 1458a_100000238430_100000729493 [1,1,0,0,0,0|1,0,1]=4 1553 B15R1.129 O=C(CCCCF)Cc1cccc(c1)O 1458a_100000745134_100000729493 [1,1,0,0,0,0|1,0,1]=4 1554 B15R1.129 O=C(CCCCO)Cc1cccc(c1)Br 1458a_100000695505_100000211773 [1,1,0,0,0,0|1,0,1]=4 1555 B15R1.129 O=C(CCCCO)Cc1cccc(c1)Br 1458a_100000747190_100000210776 [1,1,0,0,0,0|1,0,1]=4 1556 B15R1.129 O=C(CCCCO)Cc1cccc(c1)Cl 1458a_100000695505_100000181238 [1,1,0,0,0,0|1,0,1]=4 1557 B15R1.129 O=C(CCCCO)Cc1cccc(c1)Cl 1458a_100000749307_100000210776 [1,1,0,0,0,0|1,0,1]=4 1558 B15R1.129 O=C(CCCCO)Cc1cccc(c1)F 1458a_100000211661_100000210776 [1,1,0,0,0,0|1,0,1]=4 1559 B15R1.129 O=C(CCCCO)Cc1cccc(c1)F 1458a_100000695505_100000230114 [1,1,0,0,0,0|1,0,1]=4 1560 B15R1.129 O=C(CCCCO)Cc1cccc(c1)I 1458a_100000238430_100000210776 [1,1,0,0,0,0|1,0,1]=4 1561 B15R1.129 O=C(CCCCO)Cc1cccc(c1)I 1458a_100000695505_100011218688 [1,1,0,0,0,0|1,0,1]=4 1562 B15R1.129 O=C(CCCCO)Cc1cccc(c1)O 1458a_100000695505_100011660834 [1,1,0,0,0,0|1,0,1]=4 1563 B15R1.129 O=C(CCCCO)Cc1cccc(c1)O 1458a_100000745134_100000210776 [1,1,0,0,0,0|1,0,1]=4 1564 B15R1.129 O=C(CCCCO)Nc1cccc(c1)Br 1626a_100000210019_100000695505 [1,1,0,0,0,0|2,0,0]=4 1565 B15R1.129 O=C(CCCCO)Nc1cccc(c1)Cl 1626a_100000185859_100000695505 [1,1,0,0,0,0|2,0,0]=4 1566 B15R1.129 O=C(CCCCO)Nc1cccc(c1)F 1626a_100000210047_100000695505 [1,1,0,0,0,0|2,0,0]=4 1567 B15R1.129 O=C(CCCCO)Nc1cccc(c1)I 1626a_100000211102_100000695505 [1,1,0,0,0,0|2,0,0]=4 1568 B15R1.129 O=C(CCCCO)Nc1cccc(c1)O 1626a_100000210217_100000695505 [1,1,0,0,0,0|2,0,0]=4 1569 B15R1.129 [13CH3]NCCCC(=O)Nc1cccc(c1)Cl 2230a_114873766722_200025704644 [1,1,0,0,0,0|2,0,0]=4 1570 B15R1.129 [13CH3]NCCCC(=O)Nc1cccc(c1)Cl 34a_114873766722_200025704644 [1,1,0,0,0,0|2,0,0]=4 1571 B15R1.551 CCCCC(=O)/C(=C/c1ccccc1)/C 1458a_100016990649_100000210211 [1,1,0,0,0,0|0,0,2]=4 1572 B15R1.551 CCCCC(=O)/C(=C/c1ccccc1)/Cl 1458a_200020598536_100000210211 [1,1,0,0,0,0|1,0,1]=4 1573 B15R1.551 CCCCC(=O)/C(=C\c1ccccc1)/F 1458a_100020889036_100000210211 [1,1,0,0,0,0|1,0,1]=4 1574 B15R1.551 CCCCC(=O)C(=O)Nc1ccccc1 1458a_100000738435_100000210211 [1,1,0,0,0,0|1,0,1]=4 1575 B15R1.551 CCCCC(C)C(=O)C[n+]1ccccc1 1458a_200000086051_200011215066 [1,1,0,0,0,0|1,0,1]=4 1576 B15R1.551 CCCCC(C)C(=O)Cc1ccccc1 1458a_100000725509_100015291786 [1,1,0,0,0,0|0,0,1]=3 1577 B15R1.551 CCCCC(C)C(=O)Cc1ccccn1 1458a_100000233486_200011215066 [1,1,0,0,0,0|1,0,1]=4 1578 B15R1.551 CCCCC(C)C(=O)Cc1ccccn1 1458a_100000725509_100000721315 [1,1,0,0,0,0|1,0,1]=4 1579 B15R1.551 CCCCC(C)C(=O)Cc1cccnc1 1458a_100000725509_100000733263 [1,1,0,0,0,0|1,0,1]=4 1580 B15R1.551 CCCCC(C)C(=O)Cc1cccnc1 1458a_100000737805_200011215066 [1,1,0,0,0,0|1,0,1]=4 1581 B15R1.551 CCCCC(C)C(=O)Cc1ccncc1 1458a_100000725509_100000705612 [1,1,0,0,0,0|1,0,1]=4 1582 B15R1.551 CCCCC(C)C(=O)Nc1ccccc1 11a_100000106764_100000725509 [1,1,0,0,0,0|1,0,0]=3 1583 B15R1.551 CCCCC(C)C(=O)Nc1ccccc1 1626a_100000106764_100000725509 [1,1,0,0,0,0|1,0,0]=3 1584 B15R1.551 CCCCC(C)C(=O)Nc1ccccc1 22a_100000106764_100000725509 [1,1,0,0,0,0|1,0,0]=3 1585 B15R1.551 CCCCC(C)C(=O)Nc1ccccc1 527a_100000106764_100000725509 [1,1,0,0,0,0|1,0,0]=3 1586 B15R1.551 CCCCC(O)C(=O)Cc1ccccc1 1458a_100000720857_100015291786 [1,1,0,0,0,0|0,0,1]=3 1587 B15R1.551 CCCCC(O)C(=O)Cc1ccccn1 1458a_100000720857_100000721315 [1,1,0,0,0,0|1,0,1]=4 1588 B15R1.551 CCCCC(O)C(=O)Cc1cccnc1 1458a_100000720857_100000733263 [1,1,0,0,0,0|1,0,1]=4 1589 B15R1.551 CCCCC(O)C(=O)Cc1ccncc1 1458a_100000720857_100000705612 [1,1,0,0,0,0|1,0,1]=4 1590 B15R1.551 CCCCC(O)C(=O)Nc1ccccc1 22a_100000106764_100000720857 [1,1,0,0,0,0|1,0,0]=3 1591 B15R1.551 CCCCC(O)C(=O)Nc1ccccc1 527a_100000106764_100000720857 [1,1,0,0,0,0|1,0,0]=3 1592 B15R1.551 CCCCN(C)C(=O)Nc1ccccc1 2430a_100000106764_100000207549 [1,1,0,0,0,0|2,0,0]=4 1593 B15R1.551 CCCNC(C)C(=O)Nc1ccccc1 2230a_100000754830_100000210303 [1,1,0,0,0,0|2,0,0]=4 1594 B15R1.551 CCCNC(C)C(=O)Nc1ccccc1 34a_100000754830_100000210303 [1,1,0,0,0,0|2,0,0]=4 1595 B15R1.551 CCCOC(C)C(=O)Nc1ccccc1 34a_100000210258_100000183986 [1,1,0,0,0,0|2,0,0]=4 1596 B15R1.551 CCCSC(C)C(=O)Nc1ccccc1 62a_100000183986_100000210303 [1,1,0,0,0,0|2,0,0]=4 1597 B15R1.551 CCCSC(C)C(=O)Nc1ccccc1 62a_100000210303_100000183986 [1,1,0,0,0,0|2,0,0]=4 1598 B15R1.551 CSCCC(O)C(=O)Cc1ccccc1 1458a_100000685904_100015291786 [1,1,0,0,0,0|1,0,1]=4 1599 B15R1.551 CSCCC(O)C(=O)Nc1ccccc1 22a_100000106764_100000685904 [1,1,0,0,0,0|2,0,0]=4 1600 B15R1.809 C=C(CCC)CC(=O)Cc1ccccc1 1458a_100000138376_100015291786 [1,1,0,0,0,0|0,0,2]=4 1601 B15R1.809 C=C(CCC)CC(=O)Nc1ccccc1 11a_100000106764_100000138376 [1,1,0,0,0,0|1,0,1]=4 1602 B15R1.809 C=C(CCC)CC(=O)Nc1ccccc1 22a_100000106764_100000138376 [1,1,0,0,0,0|1,0,1]=4 1603 B15R1.809 C=C(CCC)CC(=O)Nc1ccccc1 527a_100000106764_100000138376 [1,1,0,0,0,0|1,0,1]=4 1604 B15R1.809 CCCC(=O)CC(=O)Cc1ccccc1 1458a_100000211992_100000233483 [1,1,0,0,0,0|0,0,2]=4 1605 B15R1.809 CCCC(=O)CC(=O)Nc1ccccc1 1458a_100000211992_100000182850 [1,1,0,0,0,0|1,0,1]=4 1606 B15R1.809 CCCC(=O)CC(=O)Oc1ccccc1 1458a_100000211992_100009813826 [1,1,0,0,0,0|1,0,1]=4 1607 B15R1.809 CCCC(C)CC(=O)C[n+]1ccccc1 1458a_200000086051_100011216630 [1,1,0,0,0,0|1,0,1]=4 1608 B15R1.809 CCCC(C)CC(=O)Cc1ccccc1 1458a_100000748435_100015291786 [1,1,0,0,0,0|0,0,1]=3 1609 B15R1.809 CCCC(C)CC(=O)Cc1ccccn1 1458a_100000233486_100011216630 [1,1,0,0,0,0|1,0,1]=4 1610 B15R1.809 CCCC(C)CC(=O)Cc1ccccn1 1458a_100000748435_100000721315 [1,1,0,0,0,0|1,0,1]=4 1611 B15R1.809 CCCC(C)CC(=O)Cc1cccnc1 1458a_100000737805_100011216630 [1,1,0,0,0,0|1,0,1]=4 1612 B15R1.809 CCCC(C)CC(=O)Cc1cccnc1 1458a_100000748435_100000733263 [1,1,0,0,0,0|1,0,1]=4 1613 B15R1.809 CCCC(C)CC(=O)Cc1ccncc1 1458a_100000748435_100000705612 [1,1,0,0,0,0|1,0,1]=4 1614 B15R1.809 CCCC(C)CC(=O)Nc1ccccc1 11a_100000106764_100000748435 [1,1,0,0,0,0|1,0,0]=3 1615 B15R1.809 CCCC(C)CC(=O)Nc1ccccc1 1626a_100000106764_100000748435 [1,1,0,0,0,0|1,0,0]=3 1616 B15R1.809 CCCC(C)CC(=O)Nc1ccccc1 22a_100000106764_100000748435 [1,1,0,0,0,0|1,0,0]=3 1617 B15R1.809 CCCC(C)CC(=O)Nc1ccccc1 527a_100000106764_100000748435 [1,1,0,0,0,0|1,0,0]=3 1618 B15R1.809 CCCC(C)NC(=O)Nc1ccccc1 2430a_100000106764_100000741246 [1,1,0,0,0,0|2,0,0]=4 1619 B15R1.809 CCCN(C)CC(=O)Cc1ccccc1 2230a_100000747261_100000233483 [1,1,0,0,0,0|1,0,1]=4 1620 B15R1.809 CCCN(C)CC(=O)Cc1ccccc1 269982a_100000747261_100000233483 [1,1,0,0,0,0|1,0,1]=4 1621 B15R1.809 CCCN(C)CC(=O)Nc1ccccc1 2230a_100000747261_100000182850 [1,1,0,0,0,0|2,0,0]=4 1622 B15R1.809 CCCN(C)CC(=O)Nc1ccccc1 269982a_100000747261_100000182850 [1,1,0,0,0,0|2,0,0]=4 1623 B15R1.809 CCCN(C)CC(=O)Oc1ccccc1 2230a_100000747261_100009813826 [1,1,0,0,0,0|2,0,0]=4 1624 B15R1.809 CCCN(C)CC(=O)Oc1ccccc1 269982a_100000747261_100009813826 [1,1,0,0,0,0|2,0,0]=4 1625 B15R1.809 CCCS(=O)CC(=O)Cc1ccccc1 1458a_100011387404_100015291786 [1,1,0,0,0,0|1,0,1]=4 1626 B15R1.809 CCCS(=O)CC(=O)Nc1ccccc1 11a_100000106764_100011387404 [1,1,0,0,0,0|2,0,0]=4 1627 B15R1.809 CCCS(=O)CC(=O)Nc1ccccc1 1626a_100000106764_100011387404 [1,1,0,0,0,0|2,0,0]=4 1628 B15R1.809 CCCS(=O)CC(=O)Nc1ccccc1 22a_100000106764_100011387404 [1,1,0,0,0,0|2,0,0]=4 1629 B15R1.809 CCCS(=O)CC(=O)Nc1ccccc1 527a_100000106764_100011387404 [1,1,0,0,0,0|2,0,0]=4 1630 B15R1.809 CCSC(C)CC(=O)Cc1ccccc1 1458a_200011311441_100015291786 [1,1,0,0,0,0|1,0,1]=4 1631 B15R1.809 CCSC(C)CC(=O)Nc1ccccc1 11a_100000106764_200011311441 [1,1,0,0,0,0|2,0,0]=4 1632 B15R1.809 CCSC(C)CC(=O)Nc1ccccc1 1626a_100000106764_200011311441 [1,1,0,0,0,0|2,0,0]=4 1633 B15R1.809 CCSC(C)CC(=O)Nc1ccccc1 22a_100000106764_200011311441 [1,1,0,0,0,0|2,0,0]=4 1634 B15R1.809 CCSC(C)CC(=O)Nc1ccccc1 527a_100000106764_200011311441 [1,1,0,0,0,0|2,0,0]=4 1635 B15R1.964 CCC(=O)CCC(=O)Nc1ccccc1 1458a_100000180958_100000210202 [1,1,0,0,0,0|1,0,1]=4 1636 B15R1.964 CCC(=O)CCC(=O)Nc1ccccc1 1458a_100000210414_100000242058 [1,1,0,0,0,0|1,0,1]=4 1637 B15R1.964 CCC(=O)CCC(=O)Oc1ccccc1 1458a_100000210414_200000035796 [1,1,0,0,0,0|1,0,1]=4 1638 B15R1.964 CCC(C)CCC(=O)Cc1ccccc1 1458a_100000701222_100015291786 [1,1,0,0,0,0|0,0,1]=3 1639 B15R1.964 CCC(C)CCC(=O)Cc1ccccn1 1458a_100000701222_100000721315 [1,1,0,0,0,0|1,0,1]=4 1640 B15R1.964 CCC(C)CCC(=O)Cc1cccnc1 1458a_100000701222_100000733263 [1,1,0,0,0,0|1,0,1]=4 1641 B15R1.964 CCC(C)CCC(=O)Cc1ccncc1 1458a_100000701222_100000705612 [1,1,0,0,0,0|1,0,1]=4 1642 B15R1.964 CCC(C)CCC(=O)Nc1ccccc1 11a_100000106764_100000701222 [1,1,0,0,0,0|1,0,0]=3 1643 B15R1.964 CCC(C)CCC(=O)Nc1ccccc1 1626a_100000106764_100000701222 [1,1,0,0,0,0|1,0,0]=3 1644 B15R1.964 CCC(C)CCC(=O)Nc1ccccc1 22a_100000106764_100000701222 [1,1,0,0,0,0|1,0,0]=3 1645 B15R1.964 CCC(C)CCC(=O)Nc1ccccc1 527a_100000106764_100000701222 [1,1,0,0,0,0|1,0,0]=3 1646 B15R1.964 CCC(C)CNC(=O)Nc1ccccc1 2430a_100000106764_100020588543 [1,1,0,0,0,0|2,0,0]=4 1647 B15R1.964 CCC(C)NCC(=O)Cc1ccccc1 2230a_100000209981_100000233483 [1,1,0,0,0,0|1,0,1]=4 1648 B15R1.964 CCC(C)NCC(=O)Nc1ccccc1 2230a_100000209981_100000182850 [1,1,0,0,0,0|2,0,0]=4 1649 B15R1.964 CCC(C)NCC(=O)Oc1ccccc1 2230a_100000209981_100009813826 [1,1,0,0,0,0|2,0,0]=4 1650 B15R1.964 CCC(C)OC/C(=C/c1ccccc1)/C 34a_200025717232_100011215416 [1,1,0,0,0,0|1,0,1]=4 1651 B15R1.964 CCC(C)OC/C(=C/c1ccccc1)/C 7a_200025717232_100000758301 [1,1,0,0,0,0|1,0,1]=4 1652 B15R1.964 CCC(C)OCC(=O)Cc1ccccc1 7a_100000210228_100000233483 [1,1,0,0,0,0|1,0,1]=4 1653 B15R1.964 CCC(C)OCC(=O)Nc1ccccc1 34a_100000246334_100011215416 [1,1,0,0,0,0|2,0,0]=4 1654 B15R1.964 CCC(C)OCC(=O)Nc1ccccc1 7a_100000210228_100000182850 [1,1,0,0,0,0|2,0,0]=4 1655 B15R1.964 CCC(C)OCC(=O)Oc1ccccc1 7a_100000210228_100009813826 [1,1,0,0,0,0|2,0,0]=4 1656 B15R1.964 CCC(C)SCC(=O)Cc1ccccc1 62a_100000233483_100000758301 [1,1,0,0,0,0|1,0,1]=4 1657 B15R1.964 CCC(C)SCC(=O)Cc1ccccc1 62a_100000758301_100000233483 [1,1,0,0,0,0|1,0,1]=4 1658 B15R1.964 CCC(C)SCC(=O)Nc1ccccc1 62a_100000758301_100000182850 [1,1,0,0,0,0|2,0,0]=4 1659 B15R1.964 CCC(C)SCC(=O)Nc1ccccc1 62a_100012148978_100000758301 [1,1,0,0,0,0|2,0,0]=4 1660 B15R1.964 CCC(C)SCC(=O)Oc1ccccc1 62a_100000758301_100009813826 [1,1,0,0,0,0|2,0,0]=4 1661 B15R1.964 CCC(C)SCC(=O)Oc1ccccc1 62a_100009813826_100000758301 [1,1,0,0,0,0|2,0,0]=4 1662 B15R1.964 CCC(O)CCC(=O)Nc1ccccc1 1626a_100000106764_203496584001 [1,1,0,0,0,0|1,0,0]=3 1663 B15R1.964 CCC(O)CCC(=O)Nc1ccccc1 22a_100000106764_203496584001 [1,1,0,0,0,0|1,0,0]=3 1664 B15R1.964 CCC(O)CNC(=O)Nc1ccccc1 2430a_100000106764_100011218483 [1,1,0,0,0,0|2,0,0]=4 1665 B15R1.964 CCN(C)CCC(=O)Cc1ccccc1 1458a_100000755305_100015291786 [1,1,0,0,0,0|1,0,1]=4 1666 B15R1.964 CCN(C)CCC(=O)Nc1ccccc1 2230a_100000225621_100000242058 [1,1,0,0,0,0|2,0,0]=4 1667 B15R1.964 CCN(C)CCC(=O)Nc1ccccc1 22a_100000106764_100000755305 [1,1,0,0,0,0|2,0,0]=4 1668 B15R1.964 CCN(C)CCC(=O)Nc1ccccc1 269982a_100000225621_100000242058 [1,1,0,0,0,0|2,0,0]=4 1669 B15R1.964 CCN(C)CCC(=O)Oc1ccccc1 2230a_100000225621_200000035796 [1,1,0,0,0,0|2,0,0]=4 1670 B15R1.964 CCN(C)CCC(=O)Oc1ccccc1 269982a_100000225621_200000035796 [1,1,0,0,0,0|2,0,0]=4 1671 B15R1.964 CCS(=O)CCC(=O)Cc1ccccc1 1458a_100011387550_100015291786 [1,1,0,0,0,0|1,0,1]=4 1672 B15R1.964 CCS(=O)CCC(=O)Nc1ccccc1 11a_100000106764_100011387550 [1,1,0,0,0,0|2,0,0]=4 1673 B15R1.964 CCS(=O)CCC(=O)Nc1ccccc1 1626a_100000106764_100011387550 [1,1,0,0,0,0|2,0,0]=4 1674 B15R1.964 CCS(=O)CCC(=O)Nc1ccccc1 527a_100000106764_100011387550 [1,1,0,0,0,0|2,0,0]=4 1675 B15R1.1081 C/C(=C\c1ccccc1)/COCC(C)C 34a_200025717232_100000210624 [1,1,0,0,0,0|1,0,1]=4 1676 B15R1.1081 C/C(=C\c1ccccc1)/COCC(C)C 7a_200025717232_100000210760 [1,1,0,0,0,0|1,0,1]=4 1677 B15R1.1081 C/C(=C\c1ccccc1)/COCC(C)O 34a_200025717232_100011218427 [1,1,0,0,0,0|1,0,1]=4 1678 B15R1.1081 C/C(=C\c1ccccc1)/COCC(C)O 7a_200025717232_100011218427 [1,1,0,0,0,0|1,0,1]=4 1679 B15R1.1081 C/C(=C\c1ccccc1)/COC[C@@H](C)O 34a_200025717232_100009817552 [1,1,0,0,0,0|1,0,1]=4 1680 B15R1.1081 C/C(=C\c1ccccc1)/COC[C@@H](C)O 7a_200025717232_100009817552 [1,1,0,0,0,0|1,0,1]=4 1681 B15R1.1081 CC(=O)CCCC(=O)Nc1ccccc1 1458a_100000070787_100011194425 [1,1,0,0,0,0|1,0,1]=4 1682 B15R1.1081 CC(=O)CCCC(=O)Nc1ccccc1 1458a_200000181736_200000210301 [1,1,0,0,0,0|1,0,1]=4 1683 B15R1.1081 CC(Br)COCC(=O)Nc1ccccc1 34a_100012180447_100000182850 [1,1,0,0,0,0|2,0,0]=4 1684 B15R1.1081 CC(Br)COCC(=O)Oc1ccccc1 34a_100012180447_100009813826 [1,1,0,0,0,0|2,0,0]=4 1685 B15R1.1081 CC(C)CCCC(=O)C[n+]1ccccc1 1458a_200000086051_100011214892 [1,1,0,0,0,0|1,0,1]=4 1686 B15R1.1081 CC(C)CCCC(=O)Cc1ccccc1 1458a_100011216857_100015291786 [1,1,0,0,0,0|0,0,1]=3 1687 B15R1.1081 CC(C)CCCC(=O)Cc1ccccn1 1458a_100000233486_100011214892 [1,1,0,0,0,0|1,0,1]=4 1688 B15R1.1081 CC(C)CCCC(=O)Cc1ccccn1 1458a_100011216857_100000721315 [1,1,0,0,0,0|1,0,1]=4 1689 B15R1.1081 CC(C)CCCC(=O)Cc1cccnc1 1458a_100000737805_100011214892 [1,1,0,0,0,0|1,0,1]=4 1690 B15R1.1081 CC(C)CCCC(=O)Cc1cccnc1 1458a_100011216857_100000733263 [1,1,0,0,0,0|1,0,1]=4 1691 B15R1.1081 CC(C)CCCC(=O)Cc1ccncc1 1458a_100011216857_100000705612 [1,1,0,0,0,0|1,0,1]=4 1692 B15R1.1081 CC(C)CCCC(=O)Nc1ccccc1 11a_100000106764_100011216857 [1,1,0,0,0,0|1,0,0]=3 1693 B15R1.1081 CC(C)CCCC(=O)Nc1ccccc1 1626a_100000106764_100011216857 [1,1,0,0,0,0|1,0,0]=3 1694 B15R1.1081 CC(C)CCCC(=O)Nc1ccccc1 22a_100000106764_100011216857 [1,1,0,0,0,0|1,0,0]=3 1695 B15R1.1081 CC(C)CCCC(=O)Nc1ccccc1 527a_100000106764_100011216857 [1,1,0,0,0,0|1,0,0]=3 1696 B15R1.1081 CC(C)CCNC(=O)Nc1ccccc1 2430a_100000106764_100000210545 [1,1,0,0,0,0|2,0,0]=4 1697 B15R1.1081 CC(C)CNCC(=O)Cc1ccccc1 2230a_100000210953_100000233483 [1,1,0,0,0,0|1,0,1]=4 1698 B15R1.1081 CC(C)CNCC(=O)Nc1ccccc1 2230a_100000210953_100000182850 [1,1,0,0,0,0|2,0,0]=4 1699 B15R1.1081 CC(C)CNCC(=O)Nc1ccccc1 270004a_100000742222_100000210432 [1,1,0,0,0,0|2,0,0]=4 1700 B15R1.1081 CC(C)CNCC(=O)Nc1ccccc1 34a_100000210953_100000182850 [1,1,0,0,0,0|2,0,0]=4 1701 B15R1.1081 CC(C)CNCC(=O)Oc1ccccc1 2230a_100000210953_100009813826 [1,1,0,0,0,0|2,0,0]=4 1702 B15R1.1081 CC(C)CNCC(=O)Oc1ccccc1 34a_100000210953_100009813826 [1,1,0,0,0,0|2,0,0]=4 1703 B15R1.1081 CC(C)COCC(=O)Cc1ccccc1 1458a_100011223364_100015291786 [1,1,0,0,0,0|1,0,1]=4 1704 B15R1.1081 CC(C)COCC(=O)Nc1ccccc1 11a_100000106764_100011223364 [1,1,0,0,0,0|2,0,0]=4 1705 B15R1.1081 CC(C)COCC(=O)Nc1ccccc1 1626a_100000106764_100011223364 [1,1,0,0,0,0|2,0,0]=4 1706 B15R1.1081 CC(C)COCC(=O)Nc1ccccc1 22a_100000106764_100011223364 [1,1,0,0,0,0|2,0,0]=4 1707 B15R1.1081 CC(C)COCC(=O)Nc1ccccc1 34a_100000210257_100000182850 [1,1,0,0,0,0|2,0,0]=4 1708 B15R1.1081 CC(C)COCC(=O)Nc1ccccc1 34a_100000246334_100000210624 [1,1,0,0,0,0|2,0,0]=4 1709 B15R1.1081 CC(C)COCC(=O)Nc1ccccc1 527a_100000106764_100011223364 [1,1,0,0,0,0|2,0,0]=4 1710 B15R1.1081 CC(C)COCC(=O)Oc1ccccc1 34a_100000210257_100009813826 [1,1,0,0,0,0|2,0,0]=4 1711 B15R1.1081 CC(C)CSCC(=O)Cc1ccccc1 62a_100000210624_100000233483 [1,1,0,0,0,0|1,0,1]=4 1712 B15R1.1081 CC(C)CSCC(=O)Cc1ccccc1 62a_100000233483_100000210760 [1,1,0,0,0,0|1,0,1]=4 1713 B15R1.1081 CC(C)CSCC(=O)Nc1ccccc1 62a_100000210624_100000182850 [1,1,0,0,0,0|2,0,0]=4 1714 B15R1.1081 CC(C)CSCC(=O)Nc1ccccc1 62a_100012148978_100000210760 [1,1,0,0,0,0|2,0,0]=4 1715 B15R1.1081 CC(C)CSCC(=O)Oc1ccccc1 62a_100000210624_100009813826 [1,1,0,0,0,0|2,0,0]=4 1716 B15R1.1081 CC(C)CSCC(=O)Oc1ccccc1 62a_100009813826_100000210760 [1,1,0,0,0,0|2,0,0]=4 1717 B15R1.1081 CC(C)NCCC(=O)Nc1ccccc1 2230a_100138425928_100000242058 [1,1,0,0,0,0|2,0,0]=4 1718 B15R1.1081 CC(C)NCCC(=O)Nc1ccccc1 34a_100138425928_100000242058 [1,1,0,0,0,0|2,0,0]=4 1719 B15R1.1081 CC(C)NCCC(=O)Oc1ccccc1 2230a_100138425928_200000035796 [1,1,0,0,0,0|2,0,0]=4 1720 B15R1.1081 CC(C)OCCC(=O)Nc1ccccc1 34a_100000212225_100000242058 [1,1,0,0,0,0|2,0,0]=4 1721 B15R1.1081 CC(C)SCCC(=O)Nc1ccccc1 62a_100000210206_100000242058 [1,1,0,0,0,0|2,0,0]=4 1722 B15R1.1081 CC(C)SCCC(=O)Oc1ccccc1 62a_100000210206_200000035796 [1,1,0,0,0,0|2,0,0]=4 1723 B15R1.1081 CC(F)COCC(=O)Nc1ccccc1 34a_100015925927_100000182850 [1,1,0,0,0,0|2,0,0]=4 1724 B15R1.1081 CC(F)COCC(=O)Oc1ccccc1 34a_100015925927_100009813826 [1,1,0,0,0,0|2,0,0]=4 1725 B15R1.1081 CC(O)CCCC(=O)C[n+]1ccccc1 1458a_200000086051_200000718107 [1,1,0,0,0,0|1,0,1]=4 1726 B15R1.1081 CC(O)CCCC(=O)Cc1ccccn1 1458a_100000233486_200000718107 [1,1,0,0,0,0|1,0,1]=4 1727 B15R1.1081 CC(O)CCCC(=O)Cc1cccnc1 1458a_100000737805_200000718107 [1,1,0,0,0,0|1,0,1]=4 1728 B15R1.1081 CC(O)CCCC(=O)Nc1ccccc1 1626a_100000106764_100000761597 [1,1,0,0,0,0|1,0,0]=3 1729 B15R1.1081 CC(O)CCCC(=O)Nc1ccccc1 22a_100000106764_100000761597 [1,1,0,0,0,0|1,0,0]=3 1730 B15R1.1081 CC(O)CCCC(=O)Nc1ccccc1 527a_100000106764_100000761597 [1,1,0,0,0,0|1,0,0]=3 1731 B15R1.1081 CC(O)CCNC(=O)Nc1ccccc1 2430a_100000106764_200000755665 [1,1,0,0,0,0|2,0,0]=4 1732 B15R1.1081 CC(O)CNCC(=O)Cc1ccccc1 2230a_100000210904_100000233483 [1,1,0,0,0,0|1,0,1]=4 1733 B15R1.1081 CC(O)CNCC(=O)Nc1ccccc1 2230a_100000210904_100000182850 [1,1,0,0,0,0|2,0,0]=4 1734 B15R1.1081 CC(O)CNCC(=O)Nc1ccccc1 34a_100000210904_100000182850 [1,1,0,0,0,0|2,0,0]=4 1735 B15R1.1081 CC(O)CNCC(=O)Oc1ccccc1 2230a_100000210904_100009813826 [1,1,0,0,0,0|2,0,0]=4 1736 B15R1.1081 CC(O)CNCC(=O)Oc1ccccc1 34a_100000210904_100009813826 [1,1,0,0,0,0|2,0,0]=4 1737 B15R1.1081 CC(O)COCC(=O)Nc1ccccc1 34a_100000246334_100011218427 [1,1,0,0,0,0|2,0,0]=4 1738 B15R1.1081 CC(O)CSCC(=O)Cc1ccccc1 62a_100000233483_100011218427 [1,1,0,0,0,0|1,0,1]=4 1739 B15R1.1081 CC(O)CSCC(=O)Cc1ccccc1 62a_100011218427_100000233483 [1,1,0,0,0,0|1,0,1]=4 1740 B15R1.1081 CC(O)CSCC(=O)Nc1ccccc1 62a_100011218427_100000182850 [1,1,0,0,0,0|2,0,0]=4 1741 B15R1.1081 CC(O)CSCC(=O)Nc1ccccc1 62a_100012148978_100011218427 [1,1,0,0,0,0|2,0,0]=4 1742 B15R1.1081 CC(O)CSCC(=O)Oc1ccccc1 62a_100009813826_100011218427 [1,1,0,0,0,0|2,0,0]=4 1743 B15R1.1081 CC(O)CSCC(=O)Oc1ccccc1 62a_100011218427_100009813826 [1,1,0,0,0,0|2,0,0]=4 1744 B15R1.1081 CN(C)CCCC(=O)Nc1ccccc1 11a_100000106764_100000740757 [1,1,0,0,0,0|2,0,0]=4 1745 B15R1.1081 CN(C)CCCC(=O)Nc1ccccc1 2230a_100102631434_100011194425 [1,1,0,0,0,0|2,0,0]=4 1746 B15R1.1081 CN(C)CCCC(=O)Nc1ccccc1 22a_100000106764_100000740757 [1,1,0,0,0,0|2,0,0]=4 1747 B15R1.1081 CN(C)CCCC(=O)Nc1ccccc1 269982a_100102631434_100011194425 [1,1,0,0,0,0|2,0,0]=4 1748 B15R1.1081 C[C@@H](Cl)COCC(=O)Nc1ccccc1 34a_100016084084_100000182850 [1,1,0,0,0,0|2,0,0]=4 1749 B15R1.1081 C[C@@H](Cl)COCC(=O)Oc1ccccc1 34a_100016084084_100009813826 [1,1,0,0,0,0|2,0,0]=4 1750 B15R1.1081 C[C@@H](N)COCC(=O)Nc1ccccc1 34a_100000737577_100000182850 [1,1,0,0,0,0|2,0,0]=4 1751 B15R1.1081 C[C@@H](N)COCC(=O)Oc1ccccc1 34a_100000737577_100009813826 [1,1,0,0,0,0|2,0,0]=4 1752 B15R1.1081 C[C@@H](O)COCC(=O)Nc1ccccc1 34a_100000246334_100009817552 [1,1,0,0,0,0|2,0,0]=4 1753 B15R1.1081 C[C@@H](O)CSCC(=O)Cc1ccccc1 62a_100000233483_100009817552 [1,1,0,0,0,0|1,0,1]=4 1754 B15R1.1081 C[C@@H](O)CSCC(=O)Cc1ccccc1 62a_100009817552_100000233483 [1,1,0,0,0,0|1,0,1]=4 1755 B15R1.1081 C[C@@H](O)CSCC(=O)Nc1ccccc1 62a_100009817552_100000182850 [1,1,0,0,0,0|2,0,0]=4 1756 B15R1.1081 C[C@@H](O)CSCC(=O)Nc1ccccc1 62a_100012148978_100009817552 [1,1,0,0,0,0|2,0,0]=4 1757 B15R1.1081 C[C@@H](O)CSCC(=O)Oc1ccccc1 62a_100009813826_100009817552 [1,1,0,0,0,0|2,0,0]=4 1758 B15R1.1081 C[C@@H](O)CSCC(=O)Oc1ccccc1 62a_100009817552_100009813826 [1,1,0,0,0,0|2,0,0]=4 1759 B15R1.1081 [13CH3]C(=O)CCCC(=O)Nc1ccccc1 1458a_200000181736_200025704644 [1,1,0,0,0,0|1,0,1]=4 1760 B15R1.1409 CCCCCC(=O)Cc1ccccc1Br 1458a_100000212188_100000184730 [1,1,0,0,0,0|0,0,1]=3 1761 B15R1.1409 CCCCCC(=O)Cc1ccccc1Br 1458a_100000751119_100000210326 [1,1,0,0,0,0|0,0,1]=3 1762 B15R1.1409 CCCCCC(=O)Cc1ccccc1C 1458a_100000212180_100000210326 [1,1,0,0,0,0|0,0,1]=3 1763 B15R1.1409 CCCCCC(=O)Cc1ccccc1C 1458a_100000212188_100000211839 [1,1,0,0,0,0|0,0,1]=3 1764 B15R1.1409 CCCCCC(=O)Cc1ccccc1Cl 1458a_100000183793_100000210326 [1,1,0,0,0,0|0,0,1]=3 1765 B15R1.1409 CCCCCC(=O)Cc1ccccc1Cl 1458a_100000212188_100000187162 [1,1,0,0,0,0|0,0,1]=3 1766 B15R1.1409 CCCCCC(=O)Cc1ccccc1F 1458a_100000212012_100000210326 [1,1,0,0,0,0|0,0,1]=3 1767 B15R1.1409 CCCCCC(=O)Cc1ccccc1F 1458a_100000212188_100000187165 [1,1,0,0,0,0|0,0,1]=3 1768 B15R1.1409 CCCCCC(=O)Cc1ccccc1I 1458a_100000036491_100000210326 [1,1,0,0,0,0|0,0,1]=3 1769 B15R1.1409 CCCCCC(=O)Cc1ccccc1I 1458a_100000212188_100011216222 [1,1,0,0,0,0|0,0,1]=3 1770 B15R1.1409 CCCCCC(=O)Cc1ccccc1O 1458a_100000743006_100000210326 [1,1,0,0,0,0|0,0,1]=3 1771 B15R1.1409 CCCCCC(=O)Cc1cccnc1Br 1458a_100000212188_100010140945 [1,1,0,0,0,0|1,0,1]=4 1772 B15R1.1409 CCCCCC(=O)Cc1cccnc1C 1458a_100000212188_100000732876 [1,1,0,0,0,0|1,0,1]=4 1773 B15R1.1409 CCCCCC(=O)Cc1cccnc1Cl 1458a_100000093521_100000210326 [1,1,0,0,0,0|1,0,1]=4 1774 B15R1.1409 CCCCCC(=O)Cc1cccnc1Cl 1458a_100000212188_100000045678 [1,1,0,0,0,0|1,0,1]=4 1775 B15R1.1409 CCCCCC(=O)Cc1cccnc1F 1458a_100000212188_100000099810 [1,1,0,0,0,0|1,0,1]=4 1776 B15R1.1409 CCCCCC(=O)Cc1ccncc1C 1458a_100000212188_100020672808 [1,1,0,0,0,0|1,0,1]=4 1777 B15R1.1409 CCCCCC(=O)Cc1ccncc1Cl 1458a_100000212188_100000763264 [1,1,0,0,0,0|1,0,1]=4 1778 B15R1.1409 CCCCCC(=O)Cc1cnccc1C 1458a_100000212188_100000690890 [1,1,0,0,0,0|1,0,1]=4 1779 B15R1.1409 CCCCCC(=O)Cc1ncccc1Br 1458a_100000212188_100025702911 [1,1,0,0,0,0|1,0,1]=4 1780 B15R1.1409 CCCCCC(=O)Cc1ncccc1Br 1458a_200012357574_100000210326 [1,1,0,0,0,0|1,0,1]=4 1781 B15R1.1409 CCCCCC(=O)Cc1ncccc1C 1458a_100000212188_100000696600 [1,1,0,0,0,0|1,0,1]=4 1782 B15R1.1409 CCCCCC(=O)Cc1ncccc1C 1458a_200000722269_100000210326 [1,1,0,0,0,0|1,0,1]=4 1783 B15R1.1409 CCCCCC(=O)Cc1ncccc1Cl 1458a_100000212188_100000099807 [1,1,0,0,0,0|1,0,1]=4 1784 B15R1.1409 CCCCCC(=O)Cc1ncccc1Cl 1458a_100011998755_100000210326 [1,1,0,0,0,0|1,0,1]=4 1785 B15R1.1409 CCCCCC(=O)Cc1ncccc1F 1458a_100000212188_100000104219 [1,1,0,0,0,0|1,0,1]=4 1786 B15R1.1409 CCCCCC(=O)Cc1ncccc1O 1458a_100000212188_200020655725 [1,1,0,0,0,0|1,0,1]=4 1787 B15R1.1409 CCCCCC(=O)Cn1ccccc1=O 1458a_100000189665_100000210326 [1,1,0,0,0,0|1,0,1]=4 1788 B15R1.1409 CCCCCC(=O)Nc1ccccc1Br 11a_100000210017_100000212188 [1,1,0,0,0,0|1,0,0]=3 1789 B15R1.1409 CCCCCC(=O)Nc1ccccc1Br 1626a_100000210017_100000212188 [1,1,0,0,0,0|1,0,0]=3 1790 B15R1.1409 CCCCCC(=O)Nc1ccccc1C 11a_100015192222_100000212188 [1,1,0,0,0,0|1,0,0]=3 1791 B15R1.1409 CCCCCC(=O)Nc1ccccc1C 1626a_100015192222_100000212188 [1,1,0,0,0,0|1,0,0]=3 1792 B15R1.1409 CCCCCC(=O)Nc1ccccc1C 22a_100015192222_100000212188 [1,1,0,0,0,0|1,0,0]=3 1793 B15R1.1409 CCCCCC(=O)Nc1ccccc1C 527a_100015192222_100000212188 [1,1,0,0,0,0|1,0,0]=3 1794 B15R1.1409 CCCCCC(=O)Nc1ccccc1Cl 11a_100000185783_100000212188 [1,1,0,0,0,0|1,0,0]=3 1795 B15R1.1409 CCCCCC(=O)Nc1ccccc1Cl 1626a_100000185783_100000212188 [1,1,0,0,0,0|1,0,0]=3 1796 B15R1.1409 CCCCCC(=O)Nc1ccccc1Cl 22a_100000185783_100000212188 [1,1,0,0,0,0|1,0,0]=3 1797 B15R1.1409 CCCCCC(=O)Nc1ccccc1Cl 527a_100000185783_100000212188 [1,1,0,0,0,0|1,0,0]=3 1798 B15R1.1409 CCCCCC(=O)Nc1ccccc1F 11a_100000210422_100000212188 [1,1,0,0,0,0|1,0,0]=3 1799 B15R1.1409 CCCCCC(=O)Nc1ccccc1F 1626a_100000210422_100000212188 [1,1,0,0,0,0|1,0,0]=3 1800 B15R1.1409 CCCCCC(=O)Nc1ccccc1F 22a_100000210422_100000212188 [1,1,0,0,0,0|1,0,0]=3 1801 B15R1.1409 CCCCCC(=O)Nc1ccccc1F 527a_100000210422_100000212188 [1,1,0,0,0,0|1,0,0]=3 1802 B15R1.1409 CCCCCC(=O)Nc1ccccc1I 11a_100000210053_100000212188 [1,1,0,0,0,0|1,0,0]=3 1803 B15R1.1409 CCCCCC(=O)Nc1ccccc1I 1626a_100000210053_100000212188 [1,1,0,0,0,0|1,0,0]=3 1804 B15R1.1409 CCCCCC(=O)Nc1ccccc1O 22a_100000185747_100000212188 [1,1,0,0,0,0|1,0,0]=3 1805 B15R1.1409 CCCCCC(=O)Nc1ccccc1O 527a_100000185747_100000212188 [1,1,0,0,0,0|1,0,0]=3 1806 B15R1.1409 CCCCNC(=O)Cc1ccccc1Br 11a_100000102301_100000751119 [1,1,0,0,0,0|1,0,1]=4 1807 B15R1.1409 CCCCNC(=O)Cc1ccccc1Br 240690a_100000102301_100000751119 [1,1,0,0,0,0|1,0,1]=4 1808 B15R1.1409 CCCCNC(=O)Cc1ccccc1Br 527a_100000102301_100000751119 [1,1,0,0,0,0|1,0,1]=4 1809 B15R1.1409 CCCCNC(=O)Cc1ccccc1C 11a_100000102301_100000212180 [1,1,0,0,0,0|1,0,1]=4 1810 B15R1.1409 CCCCNC(=O)Cc1ccccc1C 1626a_100000102301_100000212180 [1,1,0,0,0,0|1,0,1]=4 1811 B15R1.1409 CCCCNC(=O)Cc1ccccc1C 240690a_100000102301_100000212180 [1,1,0,0,0,0|1,0,1]=4 1812 B15R1.1409 CCCCNC(=O)Cc1ccccc1C 527a_100000102301_100000212180 [1,1,0,0,0,0|1,0,1]=4 1813 B15R1.1409 CCCCNC(=O)Cc1ccccc1Cl 11a_100000102301_100000183793 [1,1,0,0,0,0|1,0,1]=4 1814 B15R1.1409 CCCCNC(=O)Cc1ccccc1Cl 1626a_100000102301_100000183793 [1,1,0,0,0,0|1,0,1]=4 1815 B15R1.1409 CCCCNC(=O)Cc1ccccc1Cl 240690a_100000102301_100000183793 [1,1,0,0,0,0|1,0,1]=4 1816 B15R1.1409 CCCCNC(=O)Cc1ccccc1Cl 527a_100000102301_100000183793 [1,1,0,0,0,0|1,0,1]=4 1817 B15R1.1409 CCCCNC(=O)Cc1ccccc1F 11a_100000102301_100000212012 [1,1,0,0,0,0|1,0,1]=4 1818 B15R1.1409 CCCCNC(=O)Cc1ccccc1F 1626a_100000102301_100000212012 [1,1,0,0,0,0|1,0,1]=4 1819 B15R1.1409 CCCCNC(=O)Cc1ccccc1F 240690a_100000102301_100000212012 [1,1,0,0,0,0|1,0,1]=4 1820 B15R1.1409 CCCCNC(=O)Cc1ccccc1F 527a_100000102301_100000212012 [1,1,0,0,0,0|1,0,1]=4 1821 B15R1.1409 CCCCNC(=O)Cc1ccccc1I 11a_100000102301_100000036491 [1,1,0,0,0,0|1,0,1]=4 1822 B15R1.1409 CCCCNC(=O)Cc1ccccc1I 1626a_100000102301_100000036491 [1,1,0,0,0,0|1,0,1]=4 1823 B15R1.1409 CCCCNC(=O)Cc1ccccc1I 240690a_100000102301_100000036491 [1,1,0,0,0,0|1,0,1]=4 1824 B15R1.1409 CCCCNC(=O)Cc1ccccc1I 527a_100000102301_100000036491 [1,1,0,0,0,0|1,0,1]=4 1825 B15R1.1409 CCCCNC(=O)Cc1ccccc1O 240690a_100000102301_100000743006 [1,1,0,0,0,0|1,0,1]=4 1826 B15R1.1409 CCCCNC(=O)Cc1ccccc1O 527a_100000102301_100000743006 [1,1,0,0,0,0|1,0,1]=4 1827 B15R1.1409 CCCCNC(=O)Nc1ccccc1Br 2430a_100000210017_100000102301 [1,1,0,0,0,0|2,0,0]=4 1828 B15R1.1409 CCCCNC(=O)Nc1ccccc1C 2430a_100015192222_100000102301 [1,1,0,0,0,0|2,0,0]=4 1829 B15R1.1409 CCCCNC(=O)Nc1ccccc1Cl 2430a_100000185783_100000102301 [1,1,0,0,0,0|2,0,0]=4 1830 B15R1.1409 CCCCNC(=O)Nc1ccccc1F 2430a_100000210422_100000102301 [1,1,0,0,0,0|2,0,0]=4 1831 B15R1.1409 CCCCNC(=O)Nc1ccccc1I 2430a_100000210053_100000102301 [1,1,0,0,0,0|2,0,0]=4 1832 B15R1.1409 CCCCNC(=O)Nc1ccccc1O 2430a_100000185747_100000102301 [1,1,0,0,0,0|2,0,0]=4 1833 B15R1.1409 CCCNCC(=O)Nc1ccccc1Br 2230a_100000683505_100000210303 [1,1,0,0,0,0|2,0,0]=4 1834 B15R1.1409 CCCNCC(=O)Nc1ccccc1C 2230a_100015186652_100000210303 [1,1,0,0,0,0|2,0,0]=4 1835 B15R1.1409 CCCOCC(=O)Cc1ccccc1Br 1458a_100000745993_100000184730 [1,1,0,0,0,0|1,0,1]=4 1836 B15R1.1409 CCCOCC(=O)Cc1ccccc1Br 34a_100000210258_100000700504 [1,1,0,0,0,0|1,0,1]=4 1837 B15R1.1409 CCCOCC(=O)Cc1ccccc1C 1458a_100000745993_100000211839 [1,1,0,0,0,0|1,0,1]=4 1838 B15R1.1409 CCCOCC(=O)Cc1ccccc1Cl 1458a_100000745993_100000187162 [1,1,0,0,0,0|1,0,1]=4 1839 B15R1.1409 CCCOCC(=O)Cc1ccccc1F 1458a_100000745993_100000187165 [1,1,0,0,0,0|1,0,1]=4 1840 B15R1.1409 CCCOCC(=O)Cc1ccccc1I 1458a_100000745993_100011216222 [1,1,0,0,0,0|1,0,1]=4 1841 B15R1.1409 CCCOCC(=O)Nc1ccccc1Br 11a_100000210017_100000745993 [1,1,0,0,0,0|2,0,0]=4 1842 B15R1.1409 CCCOCC(=O)Nc1ccccc1Br 1626a_100000210017_100000745993 [1,1,0,0,0,0|2,0,0]=4 1843 B15R1.1409 CCCOCC(=O)Nc1ccccc1C 11a_100015192222_100000745993 [1,1,0,0,0,0|2,0,0]=4 1844 B15R1.1409 CCCOCC(=O)Nc1ccccc1C 1626a_100015192222_100000745993 [1,1,0,0,0,0|2,0,0]=4 1845 B15R1.1409 CCCOCC(=O)Nc1ccccc1C 22a_100015192222_100000745993 [1,1,0,0,0,0|2,0,0]=4 1846 B15R1.1409 CCCOCC(=O)Nc1ccccc1C 34a_100000210258_100000183529 [1,1,0,0,0,0|2,0,0]=4 1847 B15R1.1409 CCCOCC(=O)Nc1ccccc1C 527a_100015192222_100000745993 [1,1,0,0,0,0|2,0,0]=4 1848 B15R1.1409 CCCOCC(=O)Nc1ccccc1Cl 11a_100000185783_100000745993 [1,1,0,0,0,0|2,0,0]=4 1849 B15R1.1409 CCCOCC(=O)Nc1ccccc1Cl 1626a_100000185783_100000745993 [1,1,0,0,0,0|2,0,0]=4 1850 B15R1.1409 CCCOCC(=O)Nc1ccccc1Cl 22a_100000185783_100000745993 [1,1,0,0,0,0|2,0,0]=4 1851 B15R1.1409 CCCOCC(=O)Nc1ccccc1Cl 34a_100000210258_100000182448 [1,1,0,0,0,0|2,0,0]=4 1852 B15R1.1409 CCCOCC(=O)Nc1ccccc1Cl 527a_100000185783_100000745993 [1,1,0,0,0,0|2,0,0]=4 1853 B15R1.1409 CCCOCC(=O)Nc1ccccc1F 11a_100000210422_100000745993 [1,1,0,0,0,0|2,0,0]=4 1854 B15R1.1409 CCCOCC(=O)Nc1ccccc1F 1626a_100000210422_100000745993 [1,1,0,0,0,0|2,0,0]=4 1855 B15R1.1409 CCCOCC(=O)Nc1ccccc1F 22a_100000210422_100000745993 [1,1,0,0,0,0|2,0,0]=4 1856 B15R1.1409 CCCOCC(=O)Nc1ccccc1F 34a_100000210258_100000243840 [1,1,0,0,0,0|2,0,0]=4 1857 B15R1.1409 CCCOCC(=O)Nc1ccccc1F 527a_100000210422_100000745993 [1,1,0,0,0,0|2,0,0]=4 1858 B15R1.1409 CCCOCC(=O)Nc1ccccc1I 11a_100000210053_100000745993 [1,1,0,0,0,0|2,0,0]=4 1859 B15R1.1409 CCCOCC(=O)Nc1ccccc1I 1626a_100000210053_100000745993 [1,1,0,0,0,0|2,0,0]=4 1860 B15R1.1409 CCCOCC(=O)Nc1ccccc1I 34a_100000210258_100000180142 [1,1,0,0,0,0|2,0,0]=4 1861 B15R1.1409 CCCOCC(=O)Nc1ccccc1O 22a_100000185747_100000745993 [1,1,0,0,0,0|2,0,0]=4 1862 B15R1.1409 CCCOCC(=O)Nc1ccccc1O 527a_100000185747_100000745993 [1,1,0,0,0,0|2,0,0]=4 1863 B15R1.1409 CCCSCC(=O)Cc1ccccc1Br 1458a_100000217233_100000184730 [1,1,0,0,0,0|1,0,1]=4 1864 B15R1.1409 CCCSCC(=O)Cc1ccccc1Br 62a_100000210303_100000700504 [1,1,0,0,0,0|1,0,1]=4 1865 B15R1.1409 CCCSCC(=O)Cc1ccccc1Br 62a_100000700504_100000210303 [1,1,0,0,0,0|1,0,1]=4 1866 B15R1.1409 CCCSCC(=O)Cc1ccccc1C 1458a_100000217233_100000211839 [1,1,0,0,0,0|1,0,1]=4 1867 B15R1.1409 CCCSCC(=O)Cc1ccccc1C 62a_100000210303_100011223134 [1,1,0,0,0,0|1,0,1]=4 1868 B15R1.1409 CCCSCC(=O)Cc1ccccc1C 62a_100011223134_100000210303 [1,1,0,0,0,0|1,0,1]=4 1869 B15R1.1409 CCCSCC(=O)Cc1ccccc1Cl 1458a_100000217233_100000187162 [1,1,0,0,0,0|1,0,1]=4 1870 B15R1.1409 CCCSCC(=O)Cc1ccccc1F 1458a_100000217233_100000187165 [1,1,0,0,0,0|1,0,1]=4 1871 B15R1.1409 CCCSCC(=O)Cc1ccccc1I 1458a_100000217233_100011216222 [1,1,0,0,0,0|1,0,1]=4 1872 B15R1.1409 CCCSCC(=O)Nc1ccccc1Br 11a_100000210017_100000217233 [1,1,0,0,0,0|2,0,0]=4 1873 B15R1.1409 CCCSCC(=O)Nc1ccccc1Br 1626a_100000210017_100000217233 [1,1,0,0,0,0|2,0,0]=4 1874 B15R1.1409 CCCSCC(=O)Nc1ccccc1Br 62a_100000182372_100000210303 [1,1,0,0,0,0|2,0,0]=4 1875 B15R1.1409 CCCSCC(=O)Nc1ccccc1Br 62a_100000210303_100000182372 [1,1,0,0,0,0|2,0,0]=4 1876 B15R1.1409 CCCSCC(=O)Nc1ccccc1C 11a_100015192222_100000217233 [1,1,0,0,0,0|2,0,0]=4 1877 B15R1.1409 CCCSCC(=O)Nc1ccccc1C 1626a_100015192222_100000217233 [1,1,0,0,0,0|2,0,0]=4 1878 B15R1.1409 CCCSCC(=O)Nc1ccccc1C 22a_100015192222_100000217233 [1,1,0,0,0,0|2,0,0]=4 1879 B15R1.1409 CCCSCC(=O)Nc1ccccc1C 527a_100015192222_100000217233 [1,1,0,0,0,0|2,0,0]=4 1880 B15R1.1409 CCCSCC(=O)Nc1ccccc1C 62a_100000210303_100000183529 [1,1,0,0,0,0|2,0,0]=4 1881 B15R1.1409 CCCSCC(=O)Nc1ccccc1Cl 11a_100000185783_100000217233 [1,1,0,0,0,0|2,0,0]=4 1882 B15R1.1409 CCCSCC(=O)Nc1ccccc1Cl 1626a_100000185783_100000217233 [1,1,0,0,0,0|2,0,0]=4 1883 B15R1.1409 CCCSCC(=O)Nc1ccccc1Cl 22a_100000185783_100000217233 [1,1,0,0,0,0|2,0,0]=4 1884 B15R1.1409 CCCSCC(=O)Nc1ccccc1Cl 527a_100000185783_100000217233 [1,1,0,0,0,0|2,0,0]=4 1885 B15R1.1409 CCCSCC(=O)Nc1ccccc1Cl 62a_100000210303_100000182448 [1,1,0,0,0,0|2,0,0]=4 1886 B15R1.1409 CCCSCC(=O)Nc1ccccc1Cl 62a_200011202291_100000210303 [1,1,0,0,0,0|2,0,0]=4 1887 B15R1.1409 CCCSCC(=O)Nc1ccccc1F 11a_100000210422_100000217233 [1,1,0,0,0,0|2,0,0]=4 1888 B15R1.1409 CCCSCC(=O)Nc1ccccc1F 1626a_100000210422_100000217233 [1,1,0,0,0,0|2,0,0]=4 1889 B15R1.1409 CCCSCC(=O)Nc1ccccc1F 22a_100000210422_100000217233 [1,1,0,0,0,0|2,0,0]=4 1890 B15R1.1409 CCCSCC(=O)Nc1ccccc1F 527a_100000210422_100000217233 [1,1,0,0,0,0|2,0,0]=4 1891 B15R1.1409 CCCSCC(=O)Nc1ccccc1F 62a_100000182988_100000210303 [1,1,0,0,0,0|2,0,0]=4 1892 B15R1.1409 CCCSCC(=O)Nc1ccccc1F 62a_100000210303_100000182988 [1,1,0,0,0,0|2,0,0]=4 1893 B15R1.1409 CCCSCC(=O)Nc1ccccc1I 11a_100000210053_100000217233 [1,1,0,0,0,0|2,0,0]=4 1894 B15R1.1409 CCCSCC(=O)Nc1ccccc1I 1626a_100000210053_100000217233 [1,1,0,0,0,0|2,0,0]=4 1895 B15R1.1409 CCCSCC(=O)Nc1ccccc1I 62a_100000180142_100000210303 [1,1,0,0,0,0|2,0,0]=4 1896 B15R1.1409 CCCSCC(=O)Nc1ccccc1I 62a_100000210303_100000180142 [1,1,0,0,0,0|2,0,0]=4 1897 B15R1.1409 CCCSCC(=O)Nc1ccccc1O 22a_100000185747_100000217233 [1,1,0,0,0,0|2,0,0]=4 1898 B15R1.1409 CCCSCC(=O)Nc1ccccc1O 527a_100000185747_100000217233 [1,1,0,0,0,0|2,0,0]=4 1899 B15R1.1409 CCCSCC(=O)Nc1ccccc1O 62a_100000210303_100000014494 [1,1,0,0,0,0|2,0,0]=4 1900 B15R1.1409 CCNCCC(=O)Nc1ccccc1Br 2230a_100015525214_100000181489 [1,1,0,0,0,0|2,0,0]=4 1901 B15R1.1409 CCNCCC(=O)Nc1ccccc1C 2230a_100015525214_200011206476 [1,1,0,0,0,0|2,0,0]=4 1902 B15R1.1409 CCNCCC(=O)Nc1ccccc1C 2230a_200015185780_100000210202 [1,1,0,0,0,0|2,0,0]=4 1903 B15R1.1409 CCNCCC(=O)Nc1ccccc1C 34a_200015185780_100000210202 [1,1,0,0,0,0|2,0,0]=4 1904 B15R1.1409 CCNCCC(=O)Nc1ccccc1Cl 2230a_100015525214_100000242055 [1,1,0,0,0,0|2,0,0]=4 1905 B15R1.1409 CCNCCC(=O)Nc1ccccc1F 2230a_100015185137_100000210202 [1,1,0,0,0,0|2,0,0]=4 1906 B15R1.1409 CCNCCC(=O)Nc1ccccc1F 2230a_100015525214_100000242066 [1,1,0,0,0,0|2,0,0]=4 1907 B15R1.1409 CCNCCC(=O)Nc1ccccc1F 34a_100015185137_100000210202 [1,1,0,0,0,0|2,0,0]=4 1908 B15R1.1409 CCOCCC(=O)Cc1ccccc1Br 1458a_100000749530_100000184730 [1,1,0,0,0,0|1,0,1]=4 1909 B15R1.1409 CCOCCC(=O)Cc1ccccc1Br 1458a_100000751119_100011215890 [1,1,0,0,0,0|1,0,1]=4 1910 B15R1.1409 CCOCCC(=O)Cc1ccccc1C 1458a_100000212180_100011215890 [1,1,0,0,0,0|1,0,1]=4 1911 B15R1.1409 CCOCCC(=O)Cc1ccccc1C 1458a_100000749530_100000211839 [1,1,0,0,0,0|1,0,1]=4 1912 B15R1.1409 CCOCCC(=O)Cc1ccccc1Cl 1458a_100000183793_100011215890 [1,1,0,0,0,0|1,0,1]=4 1913 B15R1.1409 CCOCCC(=O)Cc1ccccc1Cl 1458a_100000749530_100000187162 [1,1,0,0,0,0|1,0,1]=4 1914 B15R1.1409 CCOCCC(=O)Cc1ccccc1F 1458a_100000212012_100011215890 [1,1,0,0,0,0|1,0,1]=4 1915 B15R1.1409 CCOCCC(=O)Cc1ccccc1F 1458a_100000749530_100000187165 [1,1,0,0,0,0|1,0,1]=4 1916 B15R1.1409 CCOCCC(=O)Cc1ccccc1I 1458a_100000036491_100011215890 [1,1,0,0,0,0|1,0,1]=4 1917 B15R1.1409 CCOCCC(=O)Cc1ccccc1I 1458a_100000749530_100011216222 [1,1,0,0,0,0|1,0,1]=4 1918 B15R1.1409 CCOCCC(=O)Cc1ccccc1O 1458a_100000743006_100011215890 [1,1,0,0,0,0|1,0,1]=4 1919 B15R1.1409 CCOCCC(=O)Nc1ccccc1Br 11a_100000210017_100000749530 [1,1,0,0,0,0|2,0,0]=4 1920 B15R1.1409 CCOCCC(=O)Nc1ccccc1Br 1626a_100000210017_100000749530 [1,1,0,0,0,0|2,0,0]=4 1921 B15R1.1409 CCOCCC(=O)Nc1ccccc1C 11a_100015192222_100000749530 [1,1,0,0,0,0|2,0,0]=4 1922 B15R1.1409 CCOCCC(=O)Nc1ccccc1C 1626a_100015192222_100000749530 [1,1,0,0,0,0|2,0,0]=4 1923 B15R1.1409 CCOCCC(=O)Nc1ccccc1C 22a_100015192222_100000749530 [1,1,0,0,0,0|2,0,0]=4 1924 B15R1.1409 CCOCCC(=O)Nc1ccccc1C 527a_100015192222_100000749530 [1,1,0,0,0,0|2,0,0]=4 1925 B15R1.1409 CCOCCC(=O)Nc1ccccc1Cl 11a_100000185783_100000749530 [1,1,0,0,0,0|2,0,0]=4 1926 B15R1.1409 CCOCCC(=O)Nc1ccccc1Cl 1626a_100000185783_100000749530 [1,1,0,0,0,0|2,0,0]=4 1927 B15R1.1409 CCOCCC(=O)Nc1ccccc1Cl 22a_100000185783_100000749530 [1,1,0,0,0,0|2,0,0]=4 1928 B15R1.1409 CCOCCC(=O)Nc1ccccc1Cl 527a_100000185783_100000749530 [1,1,0,0,0,0|2,0,0]=4 1929 B15R1.1409 CCOCCC(=O)Nc1ccccc1F 11a_100000210422_100000749530 [1,1,0,0,0,0|2,0,0]=4 1930 B15R1.1409 CCOCCC(=O)Nc1ccccc1F 1626a_100000210422_100000749530 [1,1,0,0,0,0|2,0,0]=4 1931 B15R1.1409 CCOCCC(=O)Nc1ccccc1F 22a_100000210422_100000749530 [1,1,0,0,0,0|2,0,0]=4 1932 B15R1.1409 CCOCCC(=O)Nc1ccccc1F 527a_100000210422_100000749530 [1,1,0,0,0,0|2,0,0]=4 1933 B15R1.1409 CCOCCC(=O)Nc1ccccc1I 11a_100000210053_100000749530 [1,1,0,0,0,0|2,0,0]=4 1934 B15R1.1409 CCOCCC(=O)Nc1ccccc1I 1626a_100000210053_100000749530 [1,1,0,0,0,0|2,0,0]=4 1935 B15R1.1409 CCOCCC(=O)Nc1ccccc1O 22a_100000185747_100000749530 [1,1,0,0,0,0|2,0,0]=4 1936 B15R1.1409 CCOCCC(=O)Nc1ccccc1O 527a_100000185747_100000749530 [1,1,0,0,0,0|2,0,0]=4 1937 B15R1.1409 CCSCCC(=O)Cc1ccccc1Br 1458a_100000230768_100000184730 [1,1,0,0,0,0|1,0,1]=4 1938 B15R1.1409 CCSCCC(=O)Cc1ccccc1Br 1458a_100000751119_100000757381 [1,1,0,0,0,0|1,0,1]=4 1939 B15R1.1409 CCSCCC(=O)Cc1ccccc1C 1458a_100000212180_100000757381 [1,1,0,0,0,0|1,0,1]=4 1940 B15R1.1409 CCSCCC(=O)Cc1ccccc1C 1458a_100000230768_100000211839 [1,1,0,0,0,0|1,0,1]=4 1941 B15R1.1409 CCSCCC(=O)Cc1ccccc1Cl 1458a_100000183793_100000757381 [1,1,0,0,0,0|1,0,1]=4 1942 B15R1.1409 CCSCCC(=O)Cc1ccccc1Cl 1458a_100000230768_100000187162 [1,1,0,0,0,0|1,0,1]=4 1943 B15R1.1409 CCSCCC(=O)Cc1ccccc1F 1458a_100000212012_100000757381 [1,1,0,0,0,0|1,0,1]=4 1944 B15R1.1409 CCSCCC(=O)Cc1ccccc1F 1458a_100000230768_100000187165 [1,1,0,0,0,0|1,0,1]=4 1945 B15R1.1409 CCSCCC(=O)Cc1ccccc1I 1458a_100000036491_100000757381 [1,1,0,0,0,0|1,0,1]=4 1946 B15R1.1409 CCSCCC(=O)Cc1ccccc1I 1458a_100000230768_100011216222 [1,1,0,0,0,0|1,0,1]=4 1947 B15R1.1409 CCSCCC(=O)Cc1ccccc1O 1458a_100000743006_100000757381 [1,1,0,0,0,0|1,0,1]=4 1948 B15R1.1409 CCSCCC(=O)Nc1ccccc1Br 11a_100000210017_100000230768 [1,1,0,0,0,0|2,0,0]=4 1949 B15R1.1409 CCSCCC(=O)Nc1ccccc1Br 1626a_100000210017_100000230768 [1,1,0,0,0,0|2,0,0]=4 1950 B15R1.1409 CCSCCC(=O)Nc1ccccc1Br 62a_100000181489_100000210202 [1,1,0,0,0,0|2,0,0]=4 1951 B15R1.1409 CCSCCC(=O)Nc1ccccc1Br 62a_100000210202_100000181489 [1,1,0,0,0,0|2,0,0]=4 1952 B15R1.1409 CCSCCC(=O)Nc1ccccc1C 11a_100015192222_100000230768 [1,1,0,0,0,0|2,0,0]=4 1953 B15R1.1409 CCSCCC(=O)Nc1ccccc1C 1626a_100015192222_100000230768 [1,1,0,0,0,0|2,0,0]=4 1954 B15R1.1409 CCSCCC(=O)Nc1ccccc1C 22a_100015192222_100000230768 [1,1,0,0,0,0|2,0,0]=4 1955 B15R1.1409 CCSCCC(=O)Nc1ccccc1C 527a_100015192222_100000230768 [1,1,0,0,0,0|2,0,0]=4 1956 B15R1.1409 CCSCCC(=O)Nc1ccccc1C 62a_100000210202_200011206476 [1,1,0,0,0,0|2,0,0]=4 1957 B15R1.1409 CCSCCC(=O)Nc1ccccc1Cl 11a_100000185783_100000230768 [1,1,0,0,0,0|2,0,0]=4 1958 B15R1.1409 CCSCCC(=O)Nc1ccccc1Cl 1626a_100000185783_100000230768 [1,1,0,0,0,0|2,0,0]=4 1959 B15R1.1409 CCSCCC(=O)Nc1ccccc1Cl 22a_100000185783_100000230768 [1,1,0,0,0,0|2,0,0]=4 1960 B15R1.1409 CCSCCC(=O)Nc1ccccc1Cl 527a_100000185783_100000230768 [1,1,0,0,0,0|2,0,0]=4 1961 B15R1.1409 CCSCCC(=O)Nc1ccccc1Cl 62a_100000210202_100000242055 [1,1,0,0,0,0|2,0,0]=4 1962 B15R1.1409 CCSCCC(=O)Nc1ccccc1F 11a_100000210422_100000230768 [1,1,0,0,0,0|2,0,0]=4 1963 B15R1.1409 CCSCCC(=O)Nc1ccccc1F 1626a_100000210422_100000230768 [1,1,0,0,0,0|2,0,0]=4 1964 B15R1.1409 CCSCCC(=O)Nc1ccccc1F 22a_100000210422_100000230768 [1,1,0,0,0,0|2,0,0]=4 1965 B15R1.1409 CCSCCC(=O)Nc1ccccc1F 527a_100000210422_100000230768 [1,1,0,0,0,0|2,0,0]=4 1966 B15R1.1409 CCSCCC(=O)Nc1ccccc1F 62a_100000210202_100000242066 [1,1,0,0,0,0|2,0,0]=4 1967 B15R1.1409 CCSCCC(=O)Nc1ccccc1F 62a_100011216740_100000210202 [1,1,0,0,0,0|2,0,0]=4 1968 B15R1.1409 CCSCCC(=O)Nc1ccccc1I 11a_100000210053_100000230768 [1,1,0,0,0,0|2,0,0]=4 1969 B15R1.1409 CCSCCC(=O)Nc1ccccc1I 1626a_100000210053_100000230768 [1,1,0,0,0,0|2,0,0]=4 1970 B15R1.1409 CCSCCC(=O)Nc1ccccc1O 22a_100000185747_100000230768 [1,1,0,0,0,0|2,0,0]=4 1971 B15R1.1409 CCSCCC(=O)Nc1ccccc1O 527a_100000185747_100000230768 [1,1,0,0,0,0|2,0,0]=4 1972 B15R1.1409 COCCCC(=O)Cc1ccccc1Br 1458a_100000741012_100000184730 [1,1,0,0,0,0|1,0,1]=4 1973 B15R1.1409 COCCCC(=O)Cc1ccccc1Br 1458a_100000751119_100000740836 [1,1,0,0,0,0|1,0,1]=4 1974 B15R1.1409 COCCCC(=O)Cc1ccccc1C 1458a_100000212180_100000740836 [1,1,0,0,0,0|1,0,1]=4 1975 B15R1.1409 COCCCC(=O)Cc1ccccc1C 1458a_100000741012_100000211839 [1,1,0,0,0,0|1,0,1]=4 1976 B15R1.1409 COCCCC(=O)Cc1ccccc1Cl 1458a_100000183793_100000740836 [1,1,0,0,0,0|1,0,1]=4 1977 B15R1.1409 COCCCC(=O)Cc1ccccc1Cl 1458a_100000741012_100000187162 [1,1,0,0,0,0|1,0,1]=4 1978 B15R1.1409 COCCCC(=O)Cc1ccccc1F 1458a_100000212012_100000740836 [1,1,0,0,0,0|1,0,1]=4 1979 B15R1.1409 COCCCC(=O)Cc1ccccc1F 1458a_100000741012_100000187165 [1,1,0,0,0,0|1,0,1]=4 1980 B15R1.1409 COCCCC(=O)Cc1ccccc1I 1458a_100000036491_100000740836 [1,1,0,0,0,0|1,0,1]=4 1981 B15R1.1409 COCCCC(=O)Cc1ccccc1I 1458a_100000741012_100011216222 [1,1,0,0,0,0|1,0,1]=4 1982 B15R1.1409 COCCCC(=O)Cc1ccccc1O 1458a_100000743006_100000740836 [1,1,0,0,0,0|1,0,1]=4 1983 B15R1.1409 COCCCC(=O)Nc1ccccc1Br 11a_100000210017_100000741012 [1,1,0,0,0,0|2,0,0]=4 1984 B15R1.1409 COCCCC(=O)Nc1ccccc1Br 1626a_100000210017_100000741012 [1,1,0,0,0,0|2,0,0]=4 1985 B15R1.1409 COCCCC(=O)Nc1ccccc1C 11a_100015192222_100000741012 [1,1,0,0,0,0|2,0,0]=4 1986 B15R1.1409 COCCCC(=O)Nc1ccccc1C 1626a_100015192222_100000741012 [1,1,0,0,0,0|2,0,0]=4 1987 B15R1.1409 COCCCC(=O)Nc1ccccc1C 22a_100015192222_100000741012 [1,1,0,0,0,0|2,0,0]=4 1988 B15R1.1409 COCCCC(=O)Nc1ccccc1C 527a_100015192222_100000741012 [1,1,0,0,0,0|2,0,0]=4 1989 B15R1.1409 COCCCC(=O)Nc1ccccc1Cl 11a_100000185783_100000741012 [1,1,0,0,0,0|2,0,0]=4 1990 B15R1.1409 COCCCC(=O)Nc1ccccc1Cl 1626a_100000185783_100000741012 [1,1,0,0,0,0|2,0,0]=4 1991 B15R1.1409 COCCCC(=O)Nc1ccccc1Cl 22a_100000185783_100000741012 [1,1,0,0,0,0|2,0,0]=4 1992 B15R1.1409 COCCCC(=O)Nc1ccccc1Cl 527a_100000185783_100000741012 [1,1,0,0,0,0|2,0,0]=4 1993 B15R1.1409 COCCCC(=O)Nc1ccccc1F 11a_100000210422_100000741012 [1,1,0,0,0,0|2,0,0]=4 1994 B15R1.1409 COCCCC(=O)Nc1ccccc1F 1626a_100000210422_100000741012 [1,1,0,0,0,0|2,0,0]=4 1995 B15R1.1409 COCCCC(=O)Nc1ccccc1F 22a_100000210422_100000741012 [1,1,0,0,0,0|2,0,0]=4 1996 B15R1.1409 COCCCC(=O)Nc1ccccc1F 527a_100000210422_100000741012 [1,1,0,0,0,0|2,0,0]=4 1997 B15R1.1409 COCCCC(=O)Nc1ccccc1I 11a_100000210053_100000741012 [1,1,0,0,0,0|2,0,0]=4 1998 B15R1.1409 COCCCC(=O)Nc1ccccc1I 1626a_100000210053_100000741012 [1,1,0,0,0,0|2,0,0]=4 1999 B15R1.1409 COCCCC(=O)Nc1ccccc1O 22a_100000185747_100000741012 [1,1,0,0,0,0|2,0,0]=4 2000 B15R1.1409 COCCCC(=O)Nc1ccccc1O 527a_100000185747_100000741012 [1,1,0,0,0,0|2,0,0]=4 2001 B15R1.1409 CSCCCC(=O)Cc1ccccc1Br 1458a_100000173376_100000184730 [1,1,0,0,0,0|1,0,1]=4 2002 B15R1.1409 CSCCCC(=O)Cc1ccccc1C 1458a_100000173376_100000211839 [1,1,0,0,0,0|1,0,1]=4 2003 B15R1.1409 CSCCCC(=O)Cc1ccccc1Cl 1458a_100000173376_100000187162 [1,1,0,0,0,0|1,0,1]=4 2004 B15R1.1409 CSCCCC(=O)Cc1ccccc1F 1458a_100000173376_100000187165 [1,1,0,0,0,0|1,0,1]=4 2005 B15R1.1409 CSCCCC(=O)Cc1ccccc1I 1458a_100000173376_100011216222 [1,1,0,0,0,0|1,0,1]=4 2006 B15R1.1409 CSCCCC(=O)Nc1ccccc1Br 11a_100000210017_100000173376 [1,1,0,0,0,0|2,0,0]=4 2007 B15R1.1409 CSCCCC(=O)Nc1ccccc1Br 1626a_100000210017_100000173376 [1,1,0,0,0,0|2,0,0]=4 2008 B15R1.1409 CSCCCC(=O)Nc1ccccc1C 11a_100015192222_100000173376 [1,1,0,0,0,0|2,0,0]=4 2009 B15R1.1409 CSCCCC(=O)Nc1ccccc1C 1626a_100015192222_100000173376 [1,1,0,0,0,0|2,0,0]=4 2010 B15R1.1409 CSCCCC(=O)Nc1ccccc1C 22a_100015192222_100000173376 [1,1,0,0,0,0|2,0,0]=4 2011 B15R1.1409 CSCCCC(=O)Nc1ccccc1C 527a_100015192222_100000173376 [1,1,0,0,0,0|2,0,0]=4 2012 B15R1.1409 CSCCCC(=O)Nc1ccccc1Cl 11a_100000185783_100000173376 [1,1,0,0,0,0|2,0,0]=4 2013 B15R1.1409 CSCCCC(=O)Nc1ccccc1Cl 1626a_100000185783_100000173376 [1,1,0,0,0,0|2,0,0]=4 2014 B15R1.1409 CSCCCC(=O)Nc1ccccc1Cl 22a_100000185783_100000173376 [1,1,0,0,0,0|2,0,0]=4 2015 B15R1.1409 CSCCCC(=O)Nc1ccccc1Cl 527a_100000185783_100000173376 [1,1,0,0,0,0|2,0,0]=4 2016 B15R1.1409 CSCCCC(=O)Nc1ccccc1F 11a_100000210422_100000173376 [1,1,0,0,0,0|2,0,0]=4 2017 B15R1.1409 CSCCCC(=O)Nc1ccccc1F 1626a_100000210422_100000173376 [1,1,0,0,0,0|2,0,0]=4 2018 B15R1.1409 CSCCCC(=O)Nc1ccccc1F 22a_100000210422_100000173376 [1,1,0,0,0,0|2,0,0]=4 2019 B15R1.1409 CSCCCC(=O)Nc1ccccc1F 527a_100000210422_100000173376 [1,1,0,0,0,0|2,0,0]=4 2020 B15R1.1409 CSCCCC(=O)Nc1ccccc1I 11a_100000210053_100000173376 [1,1,0,0,0,0|2,0,0]=4 2021 B15R1.1409 CSCCCC(=O)Nc1ccccc1I 1626a_100000210053_100000173376 [1,1,0,0,0,0|2,0,0]=4 2022 B15R1.1409 CSCCCC(=O)Nc1ccccc1O 22a_100000185747_100000173376 [1,1,0,0,0,0|2,0,0]=4 2023 B15R1.1409 CSCCCC(=O)Nc1ccccc1O 527a_100000185747_100000173376 [1,1,0,0,0,0|2,0,0]=4 2024 B15R1.1409 Cc1ccccc1CC(=O)CCCCF 1458a_100000212180_100000729493 [1,1,0,0,0,0|1,0,1]=4 2025 B15R1.1409 Cc1ccccc1CC(=O)CCCCO 1458a_100000212180_100000210776 [1,1,0,0,0,0|1,0,1]=4 2026 B15R1.1409 Cc1ccccc1CC(=O)CCCCO 1458a_100000695505_100000211839 [1,1,0,0,0,0|1,0,1]=4 2027 B15R1.1409 Cc1ccccc1NC(=O)CCCCO 1626a_100015192222_100000695505 [1,1,0,0,0,0|2,0,0]=4 2028 B15R1.1409 O=C(CCCCF)Cc1ccccc1Br 1458a_100000751119_100000729493 [1,1,0,0,0,0|1,0,1]=4 2029 B15R1.1409 O=C(CCCCF)Cc1ccccc1Cl 1458a_100000183793_100000729493 [1,1,0,0,0,0|1,0,1]=4 2030 B15R1.1409 O=C(CCCCF)Cc1ccccc1F 1458a_100000212012_100000729493 [1,1,0,0,0,0|1,0,1]=4 2031 B15R1.1409 O=C(CCCCF)Cc1ccccc1I 1458a_100000036491_100000729493 [1,1,0,0,0,0|1,0,1]=4 2032 B15R1.1409 O=C(CCCCF)Cc1ccccc1O 1458a_100000743006_100000729493 [1,1,0,0,0,0|1,0,1]=4 2033 B15R1.1409 O=C(CCCCO)Cc1ccccc1Br 1458a_100000695505_100000184730 [1,1,0,0,0,0|1,0,1]=4 2034 B15R1.1409 O=C(CCCCO)Cc1ccccc1Br 1458a_100000751119_100000210776 [1,1,0,0,0,0|1,0,1]=4 2035 B15R1.1409 O=C(CCCCO)Cc1ccccc1Cl 1458a_100000183793_100000210776 [1,1,0,0,0,0|1,0,1]=4 2036 B15R1.1409 O=C(CCCCO)Cc1ccccc1Cl 1458a_100000695505_100000187162 [1,1,0,0,0,0|1,0,1]=4 2037 B15R1.1409 O=C(CCCCO)Cc1ccccc1F 1458a_100000212012_100000210776 [1,1,0,0,0,0|1,0,1]=4 2038 B15R1.1409 O=C(CCCCO)Cc1ccccc1F 1458a_100000695505_100000187165 [1,1,0,0,0,0|1,0,1]=4 2039 B15R1.1409 O=C(CCCCO)Cc1ccccc1I 1458a_100000036491_100000210776 [1,1,0,0,0,0|1,0,1]=4 2040 B15R1.1409 O=C(CCCCO)Cc1ccccc1I 1458a_100000695505_100011216222 [1,1,0,0,0,0|1,0,1]=4 2041 B15R1.1409 O=C(CCCCO)Cc1ccccc1O 1458a_100000743006_100000210776 [1,1,0,0,0,0|1,0,1]=4 2042 B15R1.1409 O=C(CCCCO)Nc1ccccc1Br 1626a_100000210017_100000695505 [1,1,0,0,0,0|2,0,0]=4 2043 B15R1.1409 O=C(CCCCO)Nc1ccccc1Cl 1626a_100000185783_100000695505 [1,1,0,0,0,0|2,0,0]=4 2044 B15R1.1409 O=C(CCCCO)Nc1ccccc1F 1626a_100000210422_100000695505 [1,1,0,0,0,0|2,0,0]=4 2045 B15R1.1409 O=C(CCCCO)Nc1ccccc1I 1626a_100000210053_100000695505 [1,1,0,0,0,0|2,0,0]=4 2046 B15R1.2074 CCCCCS(=O)(=O)Nc1ccccc1 20a_100000106764_100000753860 [1,1,0,0,0,0|2,0,0]=4 2047 B15R1.2074 CCCCCS(=O)(=O)Nc1ccccc1 232682a_100000106764_100000753860 [1,1,0,0,0,0|2,0,0]=4 2048 B15R1.564 CCCCC(=Cc1ccc(cc1)Br)C#N 6a_100000186029_200011207956 [1,1,0,0,0,0|1,0,1]=4 2049 B15R1.564 CCCCC(=Cc1ccc(cc1)F)C#N 6a_100000210084_200011207956 [1,1,0,0,0,0|1,0,1]=4 2050 B15R1.564 CCCCC(=Cc1ccc(cc1)I)C#N 6a_100000188517_200011207956 [1,1,0,0,0,0|1,0,1]=4 2051 B15R1.565 CCCCC(=Cc1cccc(c1)Br)C#N 6a_100000210085_200011207956 [1,1,0,0,0,0|1,0,1]=4 2052 B15R1.565 CCCCC(=Cc1cccc(c1)F)C#N 6a_100000210812_200011207956 [1,1,0,0,0,0|1,0,1]=4 2053 B15R1.565 CCCCC(=Cc1cccc(c1)I)C#N 6a_100000014684_200011207956 [1,1,0,0,0,0|1,0,1]=4 2054 B15R1.1064 CCCCN(CC=O)Cc1ccccc1 2230a_200000196024_200015260668 [1,1,0,0,0,0|1,0,1]=4 2055 B15R1.1064 CCCCN(CC=O)Cc1ccccc1 269982a_200000196024_200015260668 [1,1,0,0,0,0|1,0,1]=4 2056 B15R1.3922 CCCCC(Nc1ccccc1)C(=O)N 34a_100000106764_100000748834 [1,1,0,0,0,0|1,0,1]=4 2057 B15R1.3922 CCCCC(Oc1ccccc1)C(=O)N 34a_100000210340_100000748834 [1,1,0,0,0,0|1,0,1]=4 2058 B15R1.3922 CCCCC(Oc1ccccc1)C(=O)N 7a_100000210340_100000748834 [1,1,0,0,0,0|1,0,1]=4 2059 B15R1.3922 CCCCC(Sc1ccccc1)C(=O)N 62a_100000719477_100000748834 [1,1,0,0,0,0|1,0,1]=4 2060 B15R1.3922 CCCCC(Sc1ccccc1)C(=O)N 62a_100000748834_100000041952 [1,1,0,0,0,0|1,0,1]=4 2061 B15R1.3922 CCCCN(Cc1ccccc1)C(=O)C 11a_200000196024_100015343762 [1,1,0,0,0,0|1,0,1]=4 2062 B15R1.3922 CCCCN(Cc1ccccc1)C(=O)C 1626a_200000196024_100015343762 [1,1,0,0,0,0|1,0,1]=4 2063 B15R1.3922 CCCCN(Cc1ccccc1)C(=O)C 240690a_200000196024_100015343762 [1,1,0,0,0,0|1,0,1]=4 2064 B15R1.3922 CCCCN(Cc1ccccc1)C(=O)C 527a_200000196024_100103153847 [1,1,0,0,0,0|1,0,1]=4 2065 B15R1.33 C=CC(=NNCCCC)c1ccccc1 4a_100025702795_200000750708 [0,1,0,0,1,0|2,0,0]=4 2066 B15R1.33 C=CC(NCCCCC)c1ccccc1 2230a_100000209983_200000085779 [0,1,0,0,1,0|1,0,1]=4 2067 B15R1.33 C=CC(OCCCCC)c1ccccc1 34a_100011215659_100000718602 [0,1,0,0,1,0|1,0,1]=4 2068 B15R1.33 C=CC(OCCCCC)c1ccccc1 7a_100011215659_100000210326 [0,1,0,0,1,0|1,0,1]=4 2069 B15R1.33 C=CC(SCCCCC)c1ccccc1 62a_100000210326_200000085779 [0,1,0,0,1,0|1,0,1]=4 2070 B15R1.33 C=CC(SCCCCC)c1ccccc1 62a_200000085779_100000210326 [0,1,0,0,1,0|1,0,1]=4 2071 B15R1.1412 C=CCN(CCCCC)c1ccccc1 2230a_100000211662_100000210326 [0,1,0,0,1,0|2,0,0]=4 2072 B15R1.1412 C=CCN(CCCCC)c1ccccc1 2230a_200000219563_100000210623 [0,1,0,0,1,0|2,0,0]=4 2073 B15R1.1412 C=CCN(CCCCC)c1ccccc1 269982a_100000211662_100000210215 [0,1,0,0,1,0|2,0,0]=4 2074 B15R1.1412 C=CCN(CCCCC)c1ccccc1 269982a_200000219563_100000210623 [0,1,0,0,1,0|2,0,0]=4 2075 B15R1.1412 C=CCN(CCCCC)c1ccccc1 34a_100000211662_100000718602 [0,1,0,0,1,0|2,0,0]=4 2076 B15R1.1412 C=CCN(CCCCC)c1ccccc1 34a_200000219563_100015514636 [0,1,0,0,1,0|2,0,0]=4 2077 B15R1.1412 C=CCN(CCCCC)c1ccccc1 7a_200000219563_100015514636 [0,1,0,0,1,0|2,0,0]=4 2078 B15R1.1412 CCCCCN(CC=O)c1ccccc1 2230a_200000219563_200015260668 [0,1,0,0,1,0|1,0,0]=3 2079 B15R1.1412 CCCCCN(CC=O)c1ccccc1 269982a_200000219563_200015260668 [0,1,0,0,1,0|1,0,0]=3 2080 B15R1.1412 CCCCCN(CC=O)c1ccccc1 34a_200000219563_200009817547 [0,1,0,0,1,0|1,0,0]=3 2081 B15R1.1412 CCCCCN(CC=O)c1ccccc1 7a_200000219563_200015260668 [0,1,0,0,1,0|1,0,0]=3 2082 B15R1.3474 CCCCCN(C(=O)C)c1ccccc1 11a_200000219563_100015343762 [0,1,0,0,1,0|1,0,0]=3 2083 B15R1.3474 CCCCCN(C(=O)C)c1ccccc1 1626a_200000219563_100015343762 [0,1,0,0,1,0|1,0,0]=3 2084 B15R1.3474 CCCCCN(C(=O)C)c1ccccc1 22a_200000219563_100000070787 [0,1,0,0,1,0|1,0,0]=3 2085 B15R1.3474 CCCCNC(C(=O)C)c1ccccc1 2230a_100000102301_100009888967 [0,1,0,0,1,0|1,0,1]=4 2086 B15R1.3474 CCCCNC(C(=O)C)c1ccccc1 7a_106832991798_100009888967 [0,1,0,0,1,0|1,0,1]=4 2087 B15R1.3474 CCCCNC(C(=O)N)c1ccccc1 2230a_100000102301_100000188848 [0,1,0,0,1,0|1,0,1]=4 2088 B15R1.3474 CCCCNC(C(=O)N)c1ccccc1 7a_106832991798_100000188848 [0,1,0,0,1,0|1,0,1]=4 2089 B15R1.3474 CCCCNC(C(=O)O)c1ccccc1 269956a_100000230147_100000210211 [0,1,0,0,1,0|1,0,1]=4 2090 B15R1.3474 CCCCN[C@@H](C(=O)N)c1ccccc1 2230a_100011423151_100000210211 [0,1,0,0,1,0|1,0,1]=4 2091 B15R1.3474 CCCCOC(C(=O)C)c1ccccc1 7a_100000210227_100009888967 [0,1,0,0,1,0|1,0,1]=4 2092 B15R1.3474 CCCCOC(C(=O)N)c1ccccc1 34a_100011200849_100000210210 [0,1,0,0,1,0|1,0,1]=4 2093 B15R1.3474 CCCCOC(C(=O)N)c1ccccc1 7a_100000210227_100000188848 [0,1,0,0,1,0|1,0,1]=4 2094 B15R1.3474 CCCCOC(C(=O)N)c1ccccc1 7a_100011200849_100000210211 [0,1,0,0,1,0|1,0,1]=4 2095 B15R1.3474 CCCCSC(C(=O)C)c1ccccc1 62a_100000210211_100009888967 [0,1,0,0,1,0|1,0,1]=4 2096 B15R1.3474 CCCCSC(C(=O)C)c1ccccc1 62a_100009888967_100000210210 [0,1,0,0,1,0|1,0,1]=4 2097 B15R1.3474 CCCCSC(C(=O)N)c1ccccc1 62a_100000188848_100000210210 [0,1,0,0,1,0|1,0,1]=4 2098 B15R1.3474 CCCCSC(C(=O)N)c1ccccc1 62a_100000210211_100000188848 [0,1,0,0,1,0|1,0,1]=4 2099 B15R1.3474 CCCNCC(C(=O)O)c1ccccc1 269956a_100000722792_100000210207 [0,1,0,0,1,0|1,0,1]=4 2100 B17R1.1910 C=CC(=NNc1ccc(cc1)Br)CCCCC 4a_100000735608_100011217817 [0,1,0,0,0,1|2,0,0]=4 2101 B17R1.1910 C=CC(=NNc1ccc(cc1)C)CCCCC 4a_100000683527_100011217817 [0,1,0,0,0,1|2,0,0]=4 2102 B17R1.1910 C=CC(=NNc1ccc(cc1)Cl)CCCCC 4a_100000683521_100011217817 [0,1,0,0,0,1|2,0,0]=4 2103 B17R1.1910 C=CC(=NNc1ccc(cc1)F)CCCCC 4a_100000728448_100011217817 [0,1,0,0,0,1|2,0,0]=4 2104 B17R1.1910 C=CC(=NNc1ccc(cc1)I)CCCCC 4a_100016988836_100011217817 [0,1,0,0,0,1|2,0,0]=4 2105 B17R1.1940 C=CC(=NNc1cccc(c1)Br)CCCCC 4a_100000217339_100011217817 [0,1,0,0,0,1|2,0,0]=4 2106 B17R1.1940 C=CC(=NNc1cccc(c1)C)CCCCC 4a_100000681630_100011217817 [0,1,0,0,0,1|2,0,0]=4 2107 B17R1.1940 C=CC(=NNc1cccc(c1)Cl)CCCCC 4a_100000184277_100011217817 [0,1,0,0,0,1|2,0,0]=4 2108 B17R1.1940 C=CC(=NNc1cccc(c1)F)CCCCC 4a_100000745080_100011217817 [0,1,0,0,0,1|2,0,0]=4 2109 B17R1.1940 C=CC(=NNc1cccc(c1)I)CCCCC 4a_100020605690_100011217817 [0,1,0,0,0,1|2,0,0]=4 2110 B17R1.7833 C=CC(=NNc1ccccc1Br)CCCCC 4a_100000241748_100011217817 [0,1,0,0,0,1|2,0,0]=4 2111 B17R1.7833 C=CC(=NNc1ccccc1C)CCCCC 4a_100000184220_100011217817 [0,1,0,0,0,1|2,0,0]=4 2112 B17R1.7833 C=CC(=NNc1ccccc1Cl)CCCCC 4a_100000683529_100011217817 [0,1,0,0,0,1|2,0,0]=4 2113 B17R1.7833 C=CC(=NNc1ccccc1F)CCCCC 4a_100000239246_100011217817 [0,1,0,0,0,1|2,0,0]=4 2114 B17R1.7833 C=CC(=NNc1ccccc1I)CCCCC 4a_100011218156_100011217817 [0,1,0,0,0,1|2,0,0]=4 2115 B17R1.4026 CCCCCC(=O)C(=Cc1ccccc1)C#N 1458a_100000162679_100000210326 [0,2,0,0,0,0|1,0,1]=4 2116 B17R1.1462 CCCCCCC(=Cc1ccc(cc1)F)C#N 6a_100000210084_200011216759 [0,2,0,0,0,0|1,0,1]=4 2117 B17R1.1462 CCCCOCC(=Cc1ccc(cc1)Br)C#N 6a_100000186029_100011215793 [0,2,0,0,0,0|1,0,1]=4 2118 B17R1.1462 CCCCOCC(=Cc1ccc(cc1)F)C#N 6a_100000210084_100011215793 [0,2,0,0,0,0|1,0,1]=4 2119 B17R1.1462 CCCCOCC(=Cc1ccc(cc1)I)C#N 6a_100000188517_100011215793 [0,2,0,0,0,0|1,0,1]=4 2120 B17R1.1462 N#CC(=Cc1ccc(cc1)F)CCCCCBr 6a_100000210084_100009813337 [0,2,0,0,0,0|1,0,1]=4 2121 B17R1.1462 N#CC(=Cc1ccc(cc1)F)CCCCCCl 6a_100000210084_200000039078 [0,2,0,0,0,0|1,0,1]=4 2122 B17R1.1500 CCCCCN(CC=O)Cc1ccc(cc1)Cl 2230a_100000189089_200015260668 [0,2,0,0,0,0|1,0,1]=4 2123 B17R1.1500 CCCCCN(CC=O)Cc1ccc(cc1)Cl 269982a_100000189089_200015260668 [0,2,0,0,0,0|1,0,1]=4 2124 B17R1.1500 CCCCCN(CC=O)Cc1ccc(cc1)Cl 34a_100000189089_200009817547 [0,2,0,0,0,0|1,0,1]=4 2125 B17R1.1500 CCCCCN(CC=O)Cc1ccc(cc1)F 2230a_100000180876_200015260668 [0,2,0,0,0,0|1,0,1]=4 2126 B17R1.1500 CCCCCN(CC=O)Cc1ccc(cc1)F 269982a_100000180876_200015260668 [0,2,0,0,0,0|1,0,1]=4 2127 B17R1.1500 CCCCCN(CC=O)Cc1ccc(cc1)F 34a_100000180876_200009817547 [0,2,0,0,0,0|1,0,1]=4 2128 B17R1.1923 CCCCCN(Cc1ccc(cc1)Cl)C(=O)C 11a_100000189089_100015343762 [0,2,0,0,0,0|1,0,1]=4 2129 B17R1.1923 CCCCCN(Cc1ccc(cc1)Cl)C(=O)C 1626a_100000189089_100015343762 [0,2,0,0,0,0|1,0,1]=4 2130 B17R1.1923 CCCCCN(Cc1ccc(cc1)Cl)C(=O)C 240690a_100000189089_100015343762 [0,2,0,0,0,0|1,0,1]=4 2131 B17R1.1923 CCCCCN(Cc1ccc(cc1)Cl)C(=O)C 527a_100000189089_100103153847 [0,2,0,0,0,0|1,0,1]=4 2132 B17R1.1923 CCCCCN(Cc1ccc(cc1)F)C(=O)C 11a_100000180876_100015343762 [0,2,0,0,0,0|1,0,1]=4 2133 B17R1.1923 CCCCCN(Cc1ccc(cc1)F)C(=O)C 1626a_100000180876_100015343762 [0,2,0,0,0,0|1,0,1]=4 2134 B17R1.1923 CCCCCN(Cc1ccc(cc1)F)C(=O)C 240690a_100000180876_100015343762 [0,2,0,0,0,0|1,0,1]=4 2135 B17R1.1923 CCCCCN(Cc1ccc(cc1)F)C(=O)C 527a_100000180876_100103153847 [0,2,0,0,0,0|1,0,1]=4 2136 B17R1.3740 CCCCCC(=Cc1ccc(cc1F)C)C#N 6a_100011217368_100011218096 [0,2,0,0,0,0|1,0,1]=4 2137 B17R1.3740 CCCCCC(=Cc1ccc(cc1F)F)C#N 6a_100000211964_100011218096 [0,2,0,0,0,0|1,0,1]=4 2138 B17R1.3740 CCCCCC(=Cc1ccc(cc1F)I)C#N 6a_100000050965_100011218096 [0,2,0,0,0,0|1,0,1]=4 2139 B17R1.3740 CCCCCC(=Cc1ccc(cc1I)F)C#N 6a_100010254405_100011218096 [0,2,0,0,0,0|1,0,1]=4 2140 B17R1.3740 CCCCCC(=Cc1ccc(cc1I)O)C#N 6a_100000051608_100011218096 [0,2,0,0,0,0|1,0,1]=4 2141 B17R1.3740 CCCCCC(=Cc1ccc(cc1O)I)C#N 6a_100000050530_100011218096 [0,2,0,0,0,0|1,0,1]=4 2142 B17R1.25624 CCCCCC(=Cc1ccc(c(c1)C)C)C#N 6a_100000229942_100011218096 [0,2,0,0,0,0|1,0,1]=4 2143 B17R1.25624 CCCCCC(=Cc1ccc(c(c1)C)F)C#N 6a_100000748208_100011218096 [0,2,0,0,0,0|1,0,1]=4 2144 B17R1.25624 CCCCCC(=Cc1ccc(c(c1)Cl)F)C#N 6a_100000742290_100011218096 [0,2,0,0,0,0|1,0,1]=4 2145 B17R1.25624 CCCCCC(=Cc1ccc(c(c1)Cl)O)C#N 6a_100000186751_100011218096 [0,2,0,0,0,0|1,0,1]=4 2146 B17R1.25624 CCCCCC(=Cc1ccc(c(c1)F)C)C#N 6a_100000753222_100011218096 [0,2,0,0,0,0|1,0,1]=4 2147 B17R1.25624 CCCCCC(=Cc1ccc(c(c1)F)Cl)C#N 6a_100000745630_100011218096 [0,2,0,0,0,0|1,0,1]=4 2148 B17R1.25624 CCCCCC(=Cc1ccc(c(c1)F)F)C#N 6a_100000211062_100011218096 [0,2,0,0,0,0|1,0,1]=4 2149 B17R1.25624 CCCCCC(=Cc1ccc(c(c1)F)I)C#N 6a_100000050832_100011218096 [0,2,0,0,0,0|1,0,1]=4 2150 B17R1.25624 CCCCCC(=Cc1ccc(c(c1)F)O)C#N 6a_100000742332_100011218096 [0,2,0,0,0,0|1,0,1]=4 2151 B17R1.25624 CCCCCC(=Cc1ccc(c(c1)I)F)C#N 6a_100010188209_100011218096 [0,2,0,0,0,0|1,0,1]=4 2152 B17R1.25624 CCCCCC(=Cc1ccc(c(c1)I)O)C#N 6a_100000186752_100011218096 [0,2,0,0,0,0|1,0,1]=4 2153 B17R1.25624 CCCCCC(=Cc1ccc(c(c1)O)Cl)C#N 6a_100009876013_100011218096 [0,2,0,0,0,0|1,0,1]=4 2154 B17R1.25624 CCCCCC(=Cc1ccc(c(c1)O)F)C#N 6a_100000102368_100011218096 [0,2,0,0,0,0|1,0,1]=4 2155 B17R1.25624 CCCCCC(=Cc1ccc(c(c1)O)I)C#N 6a_100000041418_100011218096 [0,2,0,0,0,0|1,0,1]=4 2156 B17R1.1269 CCCCCC(=Cc1cccc(c1F)F)C#N 6a_100000753312_100011218096 [0,2,0,0,0,0|1,0,1]=4 2157 B17R1.1269 CCCCCC(=Cc1cccc(c1F)I)C#N 6a_100010202174_100011218096 [0,2,0,0,0,0|1,0,1]=4 2158 B17R1.1269 CCCCCC(=Cc1cccc(c1I)F)C#N 6a_100010186293_100011218096 [0,2,0,0,0,0|1,0,1]=4 2159 B17R1.1463 CCCCCCC(=Cc1cccc(c1)F)C#N 6a_100000210812_200011216759 [0,2,0,0,0,0|1,0,1]=4 2160 B17R1.1463 CCCCOCC(=Cc1cccc(c1)Br)C#N 6a_100000210085_100011215793 [0,2,0,0,0,0|1,0,1]=4 2161 B17R1.1463 CCCCOCC(=Cc1cccc(c1)F)C#N 6a_100000210812_100011215793 [0,2,0,0,0,0|1,0,1]=4 2162 B17R1.1463 CCCCOCC(=Cc1cccc(c1)I)C#N 6a_100000014684_100011215793 [0,2,0,0,0,0|1,0,1]=4 2163 B17R1.1463 N#CC(=Cc1cccc(c1)F)CCCCCBr 6a_100000210812_100009813337 [0,2,0,0,0,0|1,0,1]=4 2164 B17R1.1463 N#CC(=Cc1cccc(c1)F)CCCCCCl 6a_100000210812_200000039078 [0,2,0,0,0,0|1,0,1]=4 2165 B17R1.25609 CCCCCC(=Cc1cc(ccc1F)C)C#N 6a_100000756917_100011218096 [0,2,0,0,0,0|1,0,1]=4 2166 B17R1.25609 CCCCCC(=Cc1cc(ccc1F)Cl)C#N 6a_100000745245_100011218096 [0,2,0,0,0,0|1,0,1]=4 2167 B17R1.25609 CCCCCC(=Cc1cc(ccc1F)F)C#N 6a_100000740046_100011218096 [0,2,0,0,0,0|1,0,1]=4 2168 B17R1.25609 CCCCCC(=Cc1cc(ccc1F)I)C#N 6a_100000050626_100011218096 [0,2,0,0,0,0|1,0,1]=4 2169 B17R1.25609 CCCCCC(=Cc1cc(ccc1I)F)C#N 6a_100010186294_100011218096 [0,2,0,0,0,0|1,0,1]=4 2170 B17R1.25609 CCCCCC(=Cc1cc(ccc1I)O)C#N 6a_100000069132_100011218096 [0,2,0,0,0,0|1,0,1]=4 2171 B17R1.25609 CCCCCC(=Cc1cc(ccc1O)I)C#N 6a_100011215628_100011218096 [0,2,0,0,0,0|1,0,1]=4 2172 B17R1.25611 CCCCCC(=Cc1cc(cc(c1)Br)O)C#N 6a_100010176088_100011218096 [0,2,0,0,0,0|1,0,1]=4 2173 B17R1.25611 CCCCCC(=Cc1cc(cc(c1)C)C)C#N 6a_100000745632_100011218096 [0,2,0,0,0,0|1,0,1]=4 2174 B17R1.25611 CCCCCC(=Cc1cc(cc(c1)Cl)F)C#N 6a_100000703917_100011218096 [0,2,0,0,0,0|1,0,1]=4 2175 B17R1.25611 CCCCCC(=Cc1cc(cc(c1)Cl)O)C#N 6a_100000050827_100011218096 [0,2,0,0,0,0|1,0,1]=4 2176 B17R1.25611 CCCCCC(=Cc1cc(cc(c1)F)C)C#N 6a_100011217087_100011218096 [0,2,0,0,0,0|1,0,1]=4 2177 B17R1.25611 CCCCCC(=Cc1cc(cc(c1)F)F)C#N 6a_100000743029_100011218096 [0,2,0,0,0,0|1,0,1]=4 2178 B17R1.25611 CCCCCC(=Cc1cc(cc(c1)F)O)C#N 6a_100000703664_100011218096 [0,2,0,0,0,0|1,0,1]=4 2179 B17R1.25611 CCCCCC(=Cc1cc(cc(c1)I)F)C#N 6a_100010185655_100011218096 [0,2,0,0,0,0|1,0,1]=4 2180 B17R1.25611 CCCCCC(=Cc1cc(cc(c1)O)C)C#N 6a_100009853434_100011218096 [0,2,0,0,0,0|1,0,1]=4 2181 B17R1.25611 CCCCCC(=Cc1cc(cc(c1)O)O)C#N 6a_100000043415_100011218096 [0,2,0,0,0,0|1,0,1]=4 2182 B17R1.335 O=CCN(CCCCCO)Cc1ccccc1 2230a_100011629535_200015260668 [0,2,0,0,0,0|1,0,1]=4 2183 B17R1.335 O=CCN(CCCCCO)Cc1ccccc1 269982a_100011629535_200015260668 [0,2,0,0,0,0|1,0,1]=4 2184 B17R1.335 O=CCN(CCCCCO)Cc1ccccc1 34a_100011629535_200009817547 [0,2,0,0,0,0|1,0,1]=4 2185 B17R1.5129 CC(=O)N(CCCCCO)Cc1ccccc1 240690a_100011629535_100015343762 [0,2,0,0,0,0|1,0,1]=4 2186 B17R1.5129 CC(=O)N(CCCCCO)Cc1ccccc1 527a_100011629535_100103153847 [0,2,0,0,0,0|1,0,1]=4 2187 B17R1.5129 CCCCCNC(Cc1ccccc1)C(=O)N 2230a_100000745710_100000210326 [0,2,0,0,0,0|0,0,2]=4 2188 B17R1.5129 CCCCCNC(Cc1ccccc1)C(=O)N 34a_100000745710_100000718602 [0,2,0,0,0,0|0,0,2]=4 2189 B17R1.1943 CCCCCN(CC(=O)O)Cc1ccccc1 269956a_100000745947_100000210326 [0,2,0,0,0,0|1,0,1]=4 2190 B17R1.25044 CCCCC/C(=C\c1ccccc1)/COCC 34a_200020681711_100000210202 [0,2,0,0,0,0|0,0,2]=4 2191 B17R1.25044 CCCCC/C(=C\c1ccccc1)/COCC 7a_200020681711_100000210202 [0,2,0,0,0,0|0,0,2]=4 2192 B17R1.25044 CCCCC/C(=C\c1ccccc1)/COCF 34a_200020681711_100015361967 [0,2,0,0,0,0|0,0,2]=4 2193 B17R1.25044 CCCCC/C(=C\c1ccccc1)/COCF 7a_200020681711_100015361967 [0,2,0,0,0,0|0,0,2]=4 2194 B17R1.186197 CCCCCC(=Cc1c(cccc1I)F)C#N 6a_100010178011_100011218096 [0,2,0,0,0,0|1,0,1]=4 2195 B15R2.64 O=C(C[n+]1ccccc1)C2CCCC2 1458a_200000086051_100000179811 [1,0,0,1,0,0|1,0,1]=4 2196 B15R2.64 O=C(Cc1ccccc1)C2CCCC2 1458a_100000210718_100015291786 [1,0,0,1,0,0|0,0,1]=3 2197 B15R2.64 O=C(Cc1ccccc1)C2CCCS2 1458a_100012002731_100015291786 [1,0,0,1,0,0|1,0,1]=4 2198 B15R2.64 O=C(Cc1ccccc1)C2CCOC2 1458a_100011219752_100015291786 [1,0,0,1,0,0|1,0,1]=4 2199 B15R2.64 O=C(Cc1ccccc1)[C@@H]2CCCO2 1458a_100000686382_100015291786 [1,0,0,1,0,0|1,0,1]=4 2200 B15R2.64 O=C(Cc1ccccn1)C2CCCC2 1458a_100000210718_100000721315 [1,0,0,1,0,0|1,0,1]=4 2201 B15R2.64 O=C(Cc1ccccn1)C2CCCC2 1458a_100000233486_100000179811 [1,0,0,1,0,0|1,0,1]=4 2202 B15R2.64 O=C(Cc1cccnc1)C2CCCC2 1458a_100000210718_100000733263 [1,0,0,1,0,0|1,0,1]=4 2203 B15R2.64 O=C(Cc1cccnc1)C2CCCC2 1458a_100000737805_100000179811 [1,0,0,1,0,0|1,0,1]=4 2204 B15R2.64 O=C(Cc1ccncc1)C2CCCC2 1458a_100000210718_100000705612 [1,0,0,1,0,0|1,0,1]=4 2205 B15R2.64 O=C(Nc1ccccc1)C2CCCC2 11a_100000106764_100000210718 [1,0,0,1,0,0|1,0,0]=3 2206 B15R2.64 O=C(Nc1ccccc1)C2CCCC2 1626a_100000106764_100000210718 [1,0,0,1,0,0|1,0,0]=3 2207 B15R2.64 O=C(Nc1ccccc1)C2CCCC2 22a_100000106764_100000210718 [1,0,0,1,0,0|1,0,0]=3 2208 B15R2.64 O=C(Nc1ccccc1)C2CCCC2 527a_100000106764_100000210718 [1,0,0,1,0,0|1,0,0]=3 2209 B15R2.64 O=C(Nc1ccccc1)C2CCCS2 11a_100000106764_100012002731 [1,0,0,1,0,0|2,0,0]=4 2210 B15R2.64 O=C(Nc1ccccc1)C2CCCS2 1626a_100000106764_100012002731 [1,0,0,1,0,0|2,0,0]=4 2211 B15R2.64 O=C(Nc1ccccc1)C2CCCS2 22a_100000106764_100012002731 [1,0,0,1,0,0|2,0,0]=4 2212 B15R2.64 O=C(Nc1ccccc1)C2CCCS2 527a_100000106764_100012002731 [1,0,0,1,0,0|2,0,0]=4 2213 B15R2.64 O=C(Nc1ccccc1)C2CCOC2 11a_100000106764_100011219752 [1,0,0,1,0,0|2,0,0]=4 2214 B15R2.64 O=C(Nc1ccccc1)C2CCOC2 1626a_100000106764_100011219752 [1,0,0,1,0,0|2,0,0]=4 2215 B15R2.64 O=C(Nc1ccccc1)C2CCOC2 22a_100000106764_100011219752 [1,0,0,1,0,0|2,0,0]=4 2216 B15R2.64 O=C(Nc1ccccc1)C2CCOC2 527a_100000106764_100011219752 [1,0,0,1,0,0|2,0,0]=4 2217 B15R2.64 O=C(Nc1ccccc1)N2CCCC2 2430a_100000106764_100000188435 [1,0,0,1,0,0|2,0,0]=4 2218 B15R2.64 O=C(Nc1ccccc1)[C@@H]2CCCO2 11a_100000106764_100000686382 [1,0,0,1,0,0|2,0,0]=4 2219 B15R2.64 O=C(Nc1ccccc1)[C@@H]2CCCO2 1626a_100000106764_100000686382 [1,0,0,1,0,0|2,0,0]=4 2220 B15R2.64 O=C(Nc1ccccc1)[C@@H]2CCCO2 22a_100000106764_100000686382 [1,0,0,1,0,0|2,0,0]=4 2221 B15R2.64 O=C(Nc1ccccc1)[C@@H]2CCCO2 527a_100000106764_100000686382 [1,0,0,1,0,0|2,0,0]=4 2222 B15R2.1122 CC1CCN1C(=O)Nc2ccccc2 2430a_100000106764_100000755817 [1,0,0,1,0,0|2,0,0]=4 2223 B15R2.1256 C/C(=C\c1ccccc1)/COC2CC2 34a_200025717232_100000211595 [1,0,0,1,0,0|1,0,1]=4 2224 B15R2.1256 O=C(CCC1CC1)C[n+]2ccccc2 1458a_200000086051_100000694398 [1,0,0,1,0,0|1,0,1]=4 2225 B15R2.1256 O=C(CCC1CC1)Cc2ccccc2 1458a_100000756386_100015291786 [1,0,0,1,0,0|0,0,1]=3 2226 B15R2.1256 O=C(CCC1CC1)Cc2ccccn2 1458a_100000233486_100000694398 [1,0,0,1,0,0|1,0,1]=4 2227 B15R2.1256 O=C(CCC1CC1)Cc2ccccn2 1458a_100000756386_100000721315 [1,0,0,1,0,0|1,0,1]=4 2228 B15R2.1256 O=C(CCC1CC1)Cc2cccnc2 1458a_100000737805_100000694398 [1,0,0,1,0,0|1,0,1]=4 2229 B15R2.1256 O=C(CCC1CC1)Cc2cccnc2 1458a_100000756386_100000733263 [1,0,0,1,0,0|1,0,1]=4 2230 B15R2.1256 O=C(CCC1CC1)Cc2ccncc2 1458a_100000756386_100000705612 [1,0,0,1,0,0|1,0,1]=4 2231 B15R2.1256 O=C(CCC1CC1)Nc2ccccc2 11a_100000106764_100000756386 [1,0,0,1,0,0|1,0,0]=3 2232 B15R2.1256 O=C(CCC1CC1)Nc2ccccc2 1626a_100000106764_100000756386 [1,0,0,1,0,0|1,0,0]=3 2233 B15R2.1256 O=C(CCC1CC1)Nc2ccccc2 22a_100000106764_100000756386 [1,0,0,1,0,0|1,0,0]=3 2234 B15R2.1256 O=C(CCC1CC1)Nc2ccccc2 527a_100000106764_100000756386 [1,0,0,1,0,0|1,0,0]=3 2235 B15R2.1256 O=C(CNC1CC1)Nc2ccccc2 34a_100000212008_100000182850 [1,0,0,1,0,0|2,0,0]=4 2236 B15R2.1256 O=C(CNC1CC1)Oc2ccccc2 34a_100000212008_100009813826 [1,0,0,1,0,0|2,0,0]=4 2237 B15R2.1256 O=C(COC1CC1)Nc2ccccc2 34a_100000246334_100000211595 [1,0,0,1,0,0|2,0,0]=4 2238 B15R2.1256 O=C(CSC1CC1)Cc2ccccc2 62a_100000233483_100000211595 [1,0,0,1,0,0|1,0,1]=4 2239 B15R2.1256 O=C(CSC1CC1)Nc2ccccc2 62a_100012148978_100000211595 [1,0,0,1,0,0|2,0,0]=4 2240 B15R2.1256 O=C(CSC1CC1)Oc2ccccc2 62a_100009813826_100000211595 [1,0,0,1,0,0|2,0,0]=4 2241 B15R2.1256 O=C(NCC1CC1)Nc2ccccc2 2430a_100000106764_100000735609 [1,0,0,1,0,0|2,0,0]=4 2242 B15R2.1435 CCCSC1C(=O)Nc2c1cccc2 62a_100000210303_200009996675 [1,0,0,1,0,0|2,0,0]=4 2243 B15R2.1690 CCC1CC1C(=O)Cc2ccccc2 1458a_200011661523_100015291786 [1,0,0,1,0,0|0,0,1]=3 2244 B15R2.1690 CCC1CC1C(=O)Cc2ccccn2 1458a_200011661523_100000721315 [1,0,0,1,0,0|1,0,1]=4 2245 B15R2.1690 CCC1CC1C(=O)Cc2cccnc2 1458a_200011661523_100000733263 [1,0,0,1,0,0|1,0,1]=4 2246 B15R2.1690 CCC1CC1C(=O)Cc2ccncc2 1458a_200011661523_100000705612 [1,0,0,1,0,0|1,0,1]=4 2247 B15R2.1690 CCC1CC1C(=O)Nc2ccccc2 11a_100000106764_200011661523 [1,0,0,1,0,0|1,0,0]=3 2248 B15R2.1690 CCC1CC1C(=O)Nc2ccccc2 1626a_100000106764_200011661523 [1,0,0,1,0,0|1,0,0]=3 2249 B15R2.1690 CCC1CC1C(=O)Nc2ccccc2 22a_100000106764_200011661523 [1,0,0,1,0,0|1,0,0]=3 2250 B15R2.1690 CCC1CC1C(=O)Nc2ccccc2 527a_100000106764_200011661523 [1,0,0,1,0,0|1,0,0]=3 2251 B15R2.2203 CCCCSc1cc2ccccc2[nH]1 62a_100000210211_100010232065 [1,0,0,1,0,0|2,0,0]=4 2252 B15R2.2203 CCCCSc1cc2ccccc2o1 62a_100000210211_100010159458 [1,0,0,1,0,0|1,0,1]=4 2253 B15R2.2203 CCCCSc1cc2ccccc2s1 62a_100000210211_100009816949 [1,0,0,1,0,0|1,1,0]=4 2254 B15R2.2203 CCCNCc1cc2ccccc2[nH]1 270004a_100020643023_100000051030 [1,0,0,1,0,0|2,0,0]=4 2255 B15R2.2203 CCCNCc1cc2ccccc2o1 207a_100020643023_100000229944 [1,0,0,1,0,0|1,0,1]=4 2256 B15R2.2203 CCCNCc1cc2ccccc2o1 270004a_100020643023_100000229944 [1,0,0,1,0,0|1,0,1]=4 2257 B15R2.2203 CCCNCc1cc2ccccc2s1 207a_100020643023_100000686906 [1,0,0,1,0,0|1,1,0]=4 2258 B15R2.2203 CCCNCc1cc2ccccc2s1 2230a_100015187092_100000210303 [1,0,0,1,0,0|1,1,0]=4 2259 B15R2.2203 CCCNCc1cc2ccccc2s1 270004a_100020643023_100000686906 [1,0,0,1,0,0|1,1,0]=4 2260 B15R2.2203 CCCOCc1cc2ccccc2o1 34a_100000233474_100000210303 [1,0,0,1,0,0|1,0,1]=4 2261 B15R2.2203 CCCOCc1cc2ccccc2o1 7a_100000233474_100000210303 [1,0,0,1,0,0|1,0,1]=4 2262 B15R2.2203 CCOCCc1cc2ccccc2o1 34a_100011996023_100000210202 [1,0,0,1,0,0|1,0,1]=4 2263 B15R2.2203 CCOCCc1cc2ccccc2o1 7a_100011996023_100000210202 [1,0,0,1,0,0|1,0,1]=4 2264 B15R2.16446 O=C(CC1CCC1)C[n+]2ccccc2 1458a_200000086051_100000763275 [1,0,0,1,0,0|1,0,1]=4 2265 B15R2.16446 O=C(CC1CCC1)Nc2ccccc2 11a_100000106764_100000763092 [1,0,0,1,0,0|1,0,0]=3 2266 B15R2.16446 O=C(CC1CCC1)Nc2ccccc2 1626a_100000106764_100000763092 [1,0,0,1,0,0|1,0,0]=3 2267 B15R2.16446 O=C(CC1CCC1)Nc2ccccc2 22a_100000106764_100000763092 [1,0,0,1,0,0|1,0,0]=3 2268 B15R2.16446 O=C(CC1CCC1)Nc2ccccc2 527a_100000106764_100000763092 [1,0,0,1,0,0|1,0,0]=3 2269 B15R2.16446 O=C(CC1COC1)Nc2ccccc2 11a_100000106764_100000687760 [1,0,0,1,0,0|2,0,0]=4 2270 B15R2.16446 O=C(CC1COC1)Nc2ccccc2 1626a_100000106764_100000687760 [1,0,0,1,0,0|2,0,0]=4 2271 B15R2.16446 O=C(CC1COC1)Nc2ccccc2 22a_100000106764_100000687760 [1,0,0,1,0,0|2,0,0]=4 2272 B15R2.16446 O=C(CN1CCC1)Nc2ccccc2 269982a_100000754969_100000182850 [1,0,0,1,0,0|2,0,0]=4 2273 B15R2.16446 O=C(CN1CCC1)Oc2ccccc2 269982a_100000754969_100009813826 [1,0,0,1,0,0|2,0,0]=4 2274 B15R2.16446 O=C(Cc1ccccc1)CC2CCC2 1458a_100000763092_100015291786 [1,0,0,1,0,0|0,0,1]=3 2275 B15R2.16446 O=C(Cc1ccccc1)CC2COC2 1458a_100000687760_100015291786 [1,0,0,1,0,0|1,0,1]=4 2276 B15R2.16446 O=C(Cc1ccccc1)CN2CCC2 269982a_100000754969_100000233483 [1,0,0,1,0,0|1,0,1]=4 2277 B15R2.16446 O=C(Cc1ccccn1)CC2CCC2 1458a_100000233486_100000763275 [1,0,0,1,0,0|1,0,1]=4 2278 B15R2.16446 O=C(Cc1ccccn1)CC2CCC2 1458a_100000763092_100000721315 [1,0,0,1,0,0|1,0,1]=4 2279 B15R2.16446 O=C(Cc1cccnc1)CC2CCC2 1458a_100000737805_100000763275 [1,0,0,1,0,0|1,0,1]=4 2280 B15R2.16446 O=C(Cc1cccnc1)CC2CCC2 1458a_100000763092_100000733263 [1,0,0,1,0,0|1,0,1]=4 2281 B15R2.16446 O=C(Cc1ccncc1)CC2CCC2 1458a_100000763092_100000705612 [1,0,0,1,0,0|1,0,1]=4 2282 B15R2.16446 O=C(Nc1ccccc1)NC2CCC2 2430a_100000106764_100000749019 [1,0,0,1,0,0|2,0,0]=4 2283 B15R2.38 O=C1CCCCC1Nc2ccccc2 34a_100000106764_100000754470 [1,0,0,1,0,0|1,0,1]=4 2284 B15R2.38 O=C1CCCCC1Oc2ccccc2 34a_100000210340_100000754470 [1,0,0,1,0,0|1,0,1]=4 2285 B15R2.38 O=C1CCCCC1Oc2ccccc2 7a_100000210340_100000204591 [1,0,0,1,0,0|1,0,1]=4 2286 B15R2.38 O=C1CCCCC1Sc2ccccc2 62a_100000204591_100000041952 [1,0,0,1,0,0|1,0,1]=4 2287 B15R2.38 O=C1CCCCC1Sc2ccccc2 62a_100000719477_100000204591 [1,0,0,1,0,0|1,0,1]=4 2288 B15R2.89 CCCCc1sc2ccccc2c1C 271570a_100020621405_200010198769 [1,0,0,1,0,0|2,0,0]=4 2289 B15R2.352 CCCCc1cc2ccccc2cn1 271570a_100020621405_100000047361 [1,0,0,1,0,0|2,0,0]=4 2290 B15R2.352 CCCCc1ccc2ccccc2c1 271570a_100020621405_100000233703 [1,0,0,1,0,0|1,0,0]=3 2291 B15R2.352 CCCCc1ccc2ccccc2n1 271570a_100020621405_100011291633 [1,0,0,1,0,0|2,0,0]=4 2292 B15R2.352 CCCCc1ccc2cccnc2c1 271570a_100020621405_100009816655 [1,0,0,1,0,0|2,0,0]=4 2293 B15R2.352 CCCCc1ccc2ccncc2c1 271570a_100020621405_100000686496 [1,0,0,1,0,0|2,0,0]=4 2294 B15R2.352 CCCCc1ccc2cnccc2c1 271570a_100020621405_100009816743 [1,0,0,1,0,0|2,0,0]=4 2295 B15R2.352 CCCCc1ccc2ncccc2c1 271570a_100020621405_100000754243 [1,0,0,1,0,0|2,0,0]=4 2296 B15R2.352 CCCCc1cnc2ccccc2c1 271570a_100020621405_100000737414 [1,0,0,1,0,0|1,0,0]=3 2297 B15R2.352 CCCCc1cnc2ccccc2n1 271570a_100020621405_100000756483 [1,0,0,1,0,0|2,0,0]=4 2298 B15R2.352 CCCCc1cnc2cccnc2c1 271570a_100020621405_100010246316 [1,0,0,1,0,0|2,0,0]=4 2299 B15R2.352 CCCNc1ccc2ccccc2c1 34a_100000211940_100000210303 [1,0,0,1,0,0|2,0,0]=4 2300 B15R2.352 CCCNc1ccc2ccccc2c1 7a_100000211940_100000210303 [1,0,0,1,0,0|2,0,0]=4 2301 B15R2.352 CCCOc1ccc2ccccc2c1 34a_100000185828_100000210303 [1,0,0,1,0,0|2,0,0]=4 2302 B15R2.352 CCCOc1ccc2ccccc2c1 7a_100000185828_100000210303 [1,0,0,1,0,0|2,0,0]=4 2303 B15R2.352 CCCOc1cnc2ccccc2c1 34a_100011934006_100000210303 [1,0,0,1,0,0|2,0,0]=4 2304 B15R2.352 CCCOc1cnc2ccccc2c1 7a_100011934006_100000210303 [1,0,0,1,0,0|2,0,0]=4 2305 B15R2.352 CCCSc1ccc2ccccc2c1 62a_100000210303_100000233703 [1,0,0,1,0,0|2,0,0]=4 2306 B15R2.352 CCCSc1cnc2ccccc2c1 62a_100000210303_100000737414 [1,0,0,1,0,0|2,0,0]=4 2307 B15R2.352 CCNCc1ccc2ccccc2c1 207a_100015525214_100000211584 [1,0,0,1,0,0|2,0,0]=4 2308 B15R2.352 CCNCc1ccc2ccccc2c1 2230a_100000739491_100000210202 [1,0,0,1,0,0|2,0,0]=4 2309 B15R2.352 CCNCc1ccc2ccccc2c1 2230a_100015525214_100011216711 [1,0,0,1,0,0|2,0,0]=4 2310 B15R2.352 CCNCc1ccc2ccccc2c1 270004a_100015525214_100000211584 [1,0,0,1,0,0|2,0,0]=4 2311 B15R2.352 CCNCc1ccc2ccccc2c1 34a_100000739491_100000210202 [1,0,0,1,0,0|2,0,0]=4 2312 B15R2.352 CCNCc1cnc2ccccc2c1 207a_100015525214_100000750898 [1,0,0,1,0,0|2,0,0]=4 2313 B15R2.352 CCNCc1cnc2ccccc2c1 270004a_100015525214_100000750898 [1,0,0,1,0,0|2,0,0]=4 2314 B15R2.352 CCNCc1cnc2ccccc2c1 34a_100000742225_100000210202 [1,0,0,1,0,0|2,0,0]=4 2315 B15R2.352 CCOCc1ccc2ccccc2c1 34a_100011215330_100000210202 [1,0,0,1,0,0|2,0,0]=4 2316 B15R2.352 CCOCc1ccc2ccccc2c1 34a_100121572206_100011216711 [1,0,0,1,0,0|2,0,0]=4 2317 B15R2.352 CCOCc1ccc2ccccc2c1 7a_100011215330_100000210202 [1,0,0,1,0,0|2,0,0]=4 2318 B15R2.352 CCOCc1cnc2ccccc2c1 34a_100011258773_100000210202 [1,0,0,1,0,0|2,0,0]=4 2319 B15R2.352 CCSCc1ccc2ccccc2c1 62a_100000210202_100011216711 [1,0,0,1,0,0|2,0,0]=4 2320 B15R2.352 CCSCc1ccc2ccccc2c1 62a_100011216711_100000210202 [1,0,0,1,0,0|2,0,0]=4 2321 B15R2.352 CNCCc1ccc2ccccc2c1 2230a_100000746582_200000210301 [1,0,0,1,0,0|2,0,0]=4 2322 B15R2.352 CNCCc1ccc2ccccc2c1 34a_100000746582_200000210301 [1,0,0,1,0,0|2,0,0]=4 2323 B15R2.352 COCCc1ccc2ccccc2c1 34a_100000755654_200000210301 [1,0,0,1,0,0|2,0,0]=4 2324 B15R2.352 COCCc1ccc2ccccc2c1 7a_100000755654_200000210301 [1,0,0,1,0,0|2,0,0]=4 2325 B15R2.352 [13CH3]NCCc1ccc2ccccc2c1 2230a_100000746582_200025704644 [1,0,0,1,0,0|2,0,0]=4 2326 B15R2.352 [13CH3]NCCc1ccc2ccccc2c1 34a_100000746582_200025704644 [1,0,0,1,0,0|2,0,0]=4 2327 B15R2.352 [13CH3]OCCc1ccc2ccccc2c1 34a_100000755654_200025704644 [1,0,0,1,0,0|2,0,0]=4 2328 B15R2.352 [13CH3]OCCc1ccc2ccccc2c1 7a_100000755654_200025704644 [1,0,0,1,0,0|2,0,0]=4 2329 B15R2.1 CCC1CC=C(CC1)c2ccccc2 271570a_200010144120_100000210277 [0,0,0,1,1,0|1,0,0]=3 2330 B15R2.1 CCC1CC=C(CC1)c2ccccn2 271570a_200010144120_100011216584 [0,0,0,1,1,0|2,0,0]=4 2331 B15R2.1 CCC1CC=C(CC1)c2cccnc2 271570a_200010144120_100000752921 [0,0,0,1,1,0|2,0,0]=4 2332 B15R2.1 CCC1CC=C(CC1)c2ccncc2 271570a_200010144120_100000035832 [0,0,0,1,1,0|2,0,0]=4 2333 B15R2.1 CCN1CC=C(CC1)c2ccccc2 2230a_100000007107_100000210202 [0,0,0,1,1,0|2,0,0]=4 2334 B15R2.1 CCN1CC=C(CC1)c2ccccc2 269982a_100000007107_100000204670 [0,0,0,1,1,0|2,0,0]=4 2335 B15R2.1 COC1CC=C(CC1)c2ccccc2 271570a_100010144119_100000210277 [0,0,0,1,1,0|2,0,0]=4 2336 B15R2.5 CCCCOc1csc2c1cccc2 34a_100000077758_100000210210 [0,0,0,1,1,0|1,1,0]=4 2337 B15R2.5 CCCCOc1csc2c1cccc2 7a_100000077758_100000210211 [0,0,0,1,1,0|1,1,0]=4 2338 B15R2.5 CCCCSc1coc2c1cccc2 62a_100000210211_100009812202 [0,0,0,1,1,0|1,0,1]=4 2339 B15R2.5 CCCCSc1csc2c1cccc2 62a_100000210211_100009813928 [0,0,0,1,1,0|1,1,0]=4 2340 B15R2.5 CCCNCc1coc2c1cccc2 207a_100020643023_100000688544 [0,0,0,1,1,0|1,0,1]=4 2341 B15R2.5 CCCNCc1coc2c1cccc2 270004a_100020643023_100000688544 [0,0,0,1,1,0|1,0,1]=4 2342 B15R2.5 CCCNCc1csc2c1cccc2 207a_100020643023_100000239721 [0,0,0,1,1,0|1,1,0]=4 2343 B15R2.5 CCCNCc1csc2c1cccc2 270004a_100020643023_100000239721 [0,0,0,1,1,0|1,1,0]=4 2344 B15R2.5 CCCNCc1csc2c1cccc2 34a_100000744611_100000210303 [0,0,0,1,1,0|1,1,0]=4 2345 B15R2.5 CCCOCc1csc2c1cccc2 34a_100000210258_200000742921 [0,0,0,1,1,0|1,1,0]=4 2346 B15R2.5 CCCOCc1csc2c1cccc2 34a_100011219454_100000210303 [0,0,0,1,1,0|1,1,0]=4 2347 B15R2.5 CCCSCc1csc2c1cccc2 62a_100000210303_200000742921 [0,0,0,1,1,0|1,1,0]=4 2348 B15R2.5 CCCSCc1csc2c1cccc2 62a_200000742921_100000210303 [0,0,0,1,1,0|1,1,0]=4 2349 B15R2.5 CCNCCc1c[nH]c2c1cccc2 2230a_100000211132_100000210202 [0,0,0,1,1,0|2,0,0]=4 2350 B15R2.5 CCNCCc1c[nH]c2c1cccc2 2230a_100015525214_100011218569 [0,0,0,1,1,0|2,0,0]=4 2351 B15R2.5 CCNCCc1coc2c1cccc2 2230a_100011934666_100000210202 [0,0,0,1,1,0|1,0,1]=4 2352 B15R2.5 CCNCCc1coc2c1cccc2 34a_100011934666_100000210202 [0,0,0,1,1,0|1,0,1]=4 2353 B15R2.5 CCOCCc1c[nH]c2c1cccc2 34a_100000752351_100000210202 [0,0,0,1,1,0|2,0,0]=4 2354 B15R2.5 CCOCCc1c[nH]c2c1cccc2 34a_100121572206_100011218569 [0,0,0,1,1,0|2,0,0]=4 2355 B15R2.5 CCSCCc1c[nH]c2c1cccc2 62a_100000210202_100011218569 [0,0,0,1,1,0|2,0,0]=4 2356 B15R2.5 COCCCc1c[nH]c2c1cccc2 34a_100102524900_200000210301 [0,0,0,1,1,0|2,0,0]=4 2357 B15R2.5 [13CH3]OCCCc1c[nH]c2c1cccc2 34a_100102524900_200025704644 [0,0,0,1,1,0|2,0,0]=4 2358 B15R2.4808 CNC1CCN(C1=O)c2ccccc2 2230a_106832991635_100000754165 [0,0,0,1,1,0|2,0,0]=4 2359 B15R2.4808 CNC1CCN(C1=O)c2ccccc2 2230a_200000754093_200000210301 [0,0,0,1,1,0|2,0,0]=4 2360 B15R2.4808 CNC1CCN(C1=O)c2ccccc2 34a_100102657272_100000754165 [0,0,0,1,1,0|2,0,0]=4 2361 B15R2.4808 CNC1CCN(C1=O)c2ccccc2 34a_200000754093_200000210301 [0,0,0,1,1,0|2,0,0]=4 2362 B15R2.4808 CNC1CCN(C1=O)c2ccccc2 7a_106832991635_100000754165 [0,0,0,1,1,0|2,0,0]=4 2363 B15R2.4808 COC1CCN(C1=O)c2ccccc2 34a_100138415774_100000754165 [0,0,0,1,1,0|2,0,0]=4 2364 B15R2.4808 CSC1CCN(C1=O)c2ccccc2 62a_100000754165_200000210301 [0,0,0,1,1,0|2,0,0]=4 2365 B15R2.4808 CSC1CCN(C1=O)c2ccccc2 62a_200000210301_100000754165 [0,0,0,1,1,0|2,0,0]=4 2366 B15R2.4808 [13CH3]NC1CCN(C1=O)c2ccccc2 2230a_200000754093_200025704644 [0,0,0,1,1,0|2,0,0]=4 2367 B15R2.4808 [13CH3]NC1CCN(C1=O)c2ccccc2 34a_200000754093_200025704644 [0,0,0,1,1,0|2,0,0]=4 2368 B15R2.4808 [13CH3]SC1CCN(C1=O)c2ccccc2 62a_100000754165_200025704644 [0,0,0,1,1,0|2,0,0]=4 2369 B15R2.4808 [13CH3]SC1CCN(C1=O)c2ccccc2 62a_200025704644_100000754165 [0,0,0,1,1,0|2,0,0]=4 2370 B17R2.268 CCCCCc1nc(no1)c2ccccc2 270196a_100000210280_100000212188 [0,0,0,1,0,1|2,0,0]=4 2371 B17R2.268 CCCCCc1noc(n1)c2ccccc2 270196a_200011207956_100000185807 [0,0,0,1,0,1|1,0,1]=4 2372 B17R2.268 CCCCSc1c[nH]c(n1)c2ccccc2 62a_100000210211_200010210587 [0,0,0,1,0,1|2,0,0]=4 2373 B17R2.268 CCCCSc1c[nH]c(n1)c2ccccc2 62a_200010210587_100000210210 [0,0,0,1,0,1|2,0,0]=4 2374 B17R2.268 CCCCSc1cnc(o1)c2ccccc2 62a_100000210211_100009814072 [0,0,0,1,0,1|2,0,0]=4 2375 B17R2.268 CCCCSc1cnc(s1)c2ccccc2 62a_100000210211_100000726391 [0,0,0,1,0,1|2,0,0]=4 2376 B17R2.268 CCCCSc1cnc(s1)c2ccccc2 62a_100000726391_100000210210 [0,0,0,1,0,1|2,0,0]=4 2377 B17R2.268 CCCCSc1cnn(c1)c2ccccc2 62a_100000210211_100011260827 [0,0,0,1,0,1|2,0,0]=4 2378 B17R2.268 CCCCSc1cnn(c1)c2ccccc2 62a_100011260827_100000210210 [0,0,0,1,0,1|2,0,0]=4 2379 B17R2.268 CCCCSc1coc(n1)c2ccccc2 62a_100000210211_100010163736 [0,0,0,1,0,1|1,0,1]=4 2380 B17R2.268 CCCCSc1coc(n1)c2ccccc2 62a_100010163736_100000210210 [0,0,0,1,0,1|1,0,1]=4 2381 B17R2.268 CCCNCc1c[nH]c(n1)c2ccccc2 207a_100020643023_100000760212 [0,0,0,1,0,1|2,0,0]=4 2382 B17R2.268 CCCNCc1ccc(o1)c2ccccc2 207a_100020643023_100000189002 [0,0,0,1,0,1|2,0,0]=4 2383 B17R2.268 CCCNCc1ccc(o1)c2ccccc2 2230a_100000752522_100000210303 [0,0,0,1,0,1|2,0,0]=4 2384 B17R2.268 CCCNCc1ccc(o1)c2ccccc2 270004a_100020643023_100000189002 [0,0,0,1,0,1|2,0,0]=4 2385 B17R2.268 CCCNCc1ccc(o1)c2ccccc2 34a_100000752522_100000210303 [0,0,0,1,0,1|2,0,0]=4 2386 B17R2.268 CCCNCc1ccc(s1)c2ccccc2 207a_100020643023_100000185246 [0,0,0,1,0,1|2,0,0]=4 2387 B17R2.268 CCCNCc1ccc(s1)c2ccccc2 270004a_100020643023_100000185246 [0,0,0,1,0,1|2,0,0]=4 2388 B17R2.268 CCCNCc1cnc(s1)c2ccccc2 207a_100020643023_100000750469 [0,0,0,1,0,1|2,0,0]=4 2389 B17R2.268 CCCNCc1cnc(s1)c2ccccc2 270004a_100020643023_100000750469 [0,0,0,1,0,1|2,0,0]=4 2390 B17R2.268 CCCNCc1cnn(c1)c2ccccc2 207a_100020643023_100000185356 [0,0,0,1,0,1|2,0,0]=4 2391 B17R2.268 CCCNCc1cnn(c1)c2ccccc2 2230a_100015187568_100000210303 [0,0,0,1,0,1|2,0,0]=4 2392 B17R2.268 CCCNCc1cnn(c1)c2ccccc2 270004a_100020643023_100000185356 [0,0,0,1,0,1|2,0,0]=4 2393 B17R2.268 CCCNCc1cnn(c1)c2ccccc2 34a_100015187568_100000210303 [0,0,0,1,0,1|2,0,0]=4 2394 B17R2.268 CCCNCc1coc(n1)c2ccccc2 207a_100020643023_100000051037 [0,0,0,1,0,1|1,0,1]=4 2395 B17R2.268 CCCNCc1coc(n1)c2ccccc2 270004a_100020643023_100000051037 [0,0,0,1,0,1|1,0,1]=4 2396 B17R2.268 CCCNCc1csc(n1)c2ccccc2 207a_100020643023_100000184810 [0,0,0,1,0,1|1,1,0]=4 2397 B17R2.268 CCCNCc1csc(n1)c2ccccc2 270004a_100020643023_100000184810 [0,0,0,1,0,1|1,1,0]=4 2398 B17R2.268 CCCOCc1cnn(c1)c2ccccc2 34a_100000229881_100000210303 [0,0,0,1,0,1|2,0,0]=4 2399 B17R2.268 CCCOCc1coc(n1)c2ccccc2 34a_100000210258_100000181476 [0,0,0,1,0,1|1,0,1]=4 2400 B17R2.268 CCCSCc1coc(n1)c2ccccc2 62a_100000181476_100000210303 [0,0,0,1,0,1|1,0,1]=4 2401 B17R2.268 CCCSCc1coc(n1)c2ccccc2 62a_100000210303_100000181476 [0,0,0,1,0,1|1,0,1]=4 2402 B17R2.268 CCCSCc1csc(n1)c2ccccc2 62a_100000210303_100000683535 [0,0,0,1,0,1|1,1,0]=4 2403 B17R2.268 CCCSCc1csc(n1)c2ccccc2 62a_100000683535_100000210303 [0,0,0,1,0,1|1,1,0]=4 2404 B17R2.268 CCNCCc1cnn(c1)c2ccccc2 2230a_100015184693_100000210202 [0,0,0,1,0,1|2,0,0]=4 2405 B17R2.268 CCNCCc1cnn(c1)c2ccccc2 34a_100015184693_100000210202 [0,0,0,1,0,1|2,0,0]=4 2406 B17R2.2708 CCCC=Cc1c[nH]c2ccccc2c1=O 271570a_100016258520_100012339567 [0,0,0,1,0,1|0,0,2]=4 2407 B17R2.2708 CCCC=Cc1coc2ccccc2c1=O 271570a_100016258520_100009813851 [0,0,0,1,0,1|0,0,2]=4 2408 B17R2.2708 CCCCNc1ccc2ccccc2c1Br 34a_100000705303_100000210210 [0,0,0,1,0,1|2,0,0]=4 2409 B17R2.2708 CCCCNc1ccc2ccccc2c1Cl 34a_100000075557_100000210210 [0,0,0,1,0,1|2,0,0]=4 2410 B17R2.2708 CCCCNc1ccc2ccccc2c1O 34a_100000007060_100000210210 [0,0,0,1,0,1|1,0,1]=4 2411 B17R2.2708 CCCCOc1ccc2ccccc2c1Br 34a_100000183829_100000210210 [0,0,0,1,0,1|2,0,0]=4 2412 B17R2.2708 CCCCOc1ccc2ccccc2c1Br 7a_100000183829_100000210211 [0,0,0,1,0,1|2,0,0]=4 2413 B17R2.2708 CCCCOc1ccc2ccccc2c1C 34a_100009830054_100000210210 [0,0,0,1,0,1|2,0,0]=4 2414 B17R2.2708 CCCCOc1ccc2ccccc2c1C 7a_100009830054_100000210211 [0,0,0,1,0,1|2,0,0]=4 2415 B17R2.2708 CCCCOc1ccc2ccccc2c1Cl 34a_100000029778_100000210210 [0,0,0,1,0,1|2,0,0]=4 2416 B17R2.2708 CCCCOc1ccc2ccccc2c1Cl 7a_100000029778_100000210211 [0,0,0,1,0,1|2,0,0]=4 2417 B17R2.2708 CCCCOc1ccc2ccccc2c1I 34a_100000041551_100000210210 [0,0,0,1,0,1|2,0,0]=4 2418 B17R2.2708 CCCCOc1ccc2ccccc2c1I 7a_100000041551_100000210211 [0,0,0,1,0,1|2,0,0]=4 2419 B17R2.2708 CCCCOc1ccc2ccccc2c1N 34a_100000007056_100000210210 [0,0,0,1,0,1|2,0,0]=4 2420 B17R2.2708 CCCCOc1ccc2ccccc2c1N 7a_100000007056_100000210211 [0,0,0,1,0,1|2,0,0]=4 2421 B17R2.2708 CCCCSc1c[nH]c2ccccc2c1=O 62a_100000210211_100012348052 [0,0,0,1,0,1|1,0,0]=3 2422 B17R2.2708 CCCCSc1ccc2ccccc2c1F 62a_100000210211_100009832041 [0,0,0,1,0,1|2,0,0]=4 2423 B17R2.2708 CCCCSc1ccc2ccccc2c1F 62a_100009832041_100000210210 [0,0,0,1,0,1|2,0,0]=4 2424 B17R2.2708 CCCCSc1ccc2ccccc2c1N 62a_100009817101_100000210210 [0,0,0,1,0,1|2,0,0]=4 2425 B17R2.2708 CCCCSc1ccc2ccccc2c1O 62a_100000210211_100009996032 [0,0,0,1,0,1|1,0,1]=4 2426 B17R2.2708 CCCCSc1cnc2ccccc2c1Cl 62a_100000210211_100012352519 [0,0,0,1,0,1|2,0,0]=4 2427 B17R2.2708 CCCCSc1cnc2ccccc2c1N 62a_100000210211_100009995562 [0,0,0,1,0,1|2,0,0]=4 2428 B17R2.2708 CCCCSc1cnc2ccccc2c1N 62a_100009995562_100000210210 [0,0,0,1,0,1|2,0,0]=4 2429 B17R2.2708 CCCCSc1coc2ccccc2c1=O 62a_100000210211_100009813851 [0,0,0,1,0,1|1,0,0]=3 2430 B17R2.2708 CCCCSc1ncc2ccccc2c1N 62a_100000210211_100000087573 [0,0,0,1,0,1|2,0,0]=4 2431 B17R2.2708 CCCCSc1ncc2ccccc2c1N 62a_100009995564_100000210210 [0,0,0,1,0,1|2,0,0]=4 2432 B17R2.2708 CCCNCc1ccc2ccccc2c1Br 207a_100020643023_100009813496 [0,0,0,1,0,1|2,0,0]=4 2433 B17R2.2708 CCCNCc1ccc2ccccc2c1Br 270004a_100020643023_100009813496 [0,0,0,1,0,1|2,0,0]=4 2434 B17R2.2708 CCCNCc1cnc2ccccc2c1Cl 270004a_100020643023_100000037458 [0,0,0,1,0,1|2,0,0]=4 2435 B17R2.2708 CCCNCc1coc2ccccc2c1=O 270004a_100020643023_100000195500 [0,0,0,1,0,1|1,0,0]=3 2436 B17R2.2708 CCCOCc1ccc2ccccc2c1Br 34a_100000210258_100009813938 [0,0,0,1,0,1|2,0,0]=4 2437 B17R2.2708 CCNCCn1cnc2ccccc2c1=O 2230a_100015525214_200000757059 [0,0,0,1,0,1|2,0,0]=4 2438 B17R2.2708 CCNCCn1ncc2ccccc2c1=O 2230a_100000756700_100000210202 [0,0,0,1,0,1|2,0,0]=4 2439 B17R2.2708 CCOCCn1cnc2ccccc2c1=O 34a_100121572206_200000757059 [0,0,0,1,0,1|2,0,0]=4 2440 B17R2.2708 CCOCCn1ncc2ccccc2c1=O 34a_100000190999_100000210202 [0,0,0,1,0,1|2,0,0]=4 2441 B17R2.2708 CCOCSc1c[nH]c2ccccc2c1=O 62a_100000739092_100012348052 [0,0,0,1,0,1|2,0,0]=4 2442 B17R2.2708 CCOCSc1coc2ccccc2c1=O 62a_100000739092_100009813851 [0,0,0,1,0,1|2,0,0]=4 2443 B17R2.2708 CCSCCn1cnc2ccccc2c1=O 62a_100000210202_200000757059 [0,0,0,1,0,1|2,0,0]=4 2444 B17R2.2708 CCSCCn1cnc2ccccc2c1=O 62a_200000757059_100000210202 [0,0,0,1,0,1|2,0,0]=4 2445 B17R2.2708 COCCSc1c[nH]c2ccccc2c1=O 62a_100000233755_100012348052 [0,0,0,1,0,1|2,0,0]=4 2446 B17R2.2708 COCCSc1coc2ccccc2c1=O 62a_100000233755_100009813851 [0,0,0,1,0,1|2,0,0]=4 2447 B17R2.2708 CSCCSc1c[nH]c2ccccc2c1=O 62a_100000212216_100012348052 [0,0,0,1,0,1|2,0,0]=4 2448 B17R2.2708 CSCCSc1coc2ccccc2c1=O 62a_100000212216_100009813851 [0,0,0,1,0,1|2,0,0]=4 2449 B17R2.2708 O=c1c(c[nH]c2c1cccc2)SCCCF 62a_100011934791_100012348052 [0,0,0,1,0,1|2,0,0]=4 2450 B17R2.2708 O=c1c(c[nH]c2c1cccc2)SCCCO 62a_100011215043_100012348052 [0,0,0,1,0,1|2,0,0]=4 2451 B17R2.2708 O=c1c(coc2c1cccc2)CNCCO 270004a_100000210304_100000195500 [0,0,0,1,0,1|2,0,0]=4 2452 B17R2.2708 O=c1c(coc2c1cccc2)SCCCF 62a_100011934791_100009813851 [0,0,0,1,0,1|2,0,0]=4 2453 B17R2.2708 O=c1c(coc2c1cccc2)SCCCO 62a_100011215043_100009813851 [0,0,0,1,0,1|2,0,0]=4 2454 B17R2.3395 O=C1CCCCCC1OCc2ccccc2 7a_100000210790_100000243696 [0,0,0,1,0,1|0,0,2]=4 2455 B17R2.3395 O=C1CCCCCC1SCc2ccccc2 62a_100000211182_100000243696 [0,0,0,1,0,1|0,0,2]=4 2456 B17R2.3395 O=C1CCCCCC1SCc2ccccc2 62a_100000243696_100015291786 [0,0,0,1,0,1|0,0,2]=4 2457 B17R2.330382 CCCCc1c(ccc2c1cccc2)C=O 271570a_100020621405_100009813496 [0,0,0,1,0,1|0,0,1]=3 2458 B17R2.330382 CCCSc1c(ccc2c1cccc2)C=O 62a_100000210303_100009813496 [0,0,0,1,0,1|1,0,1]=4 2459 B17R2.330382 CCCSc1c(ccc2c1cccc2)C=O 62a_100009813496_100000210303 [0,0,0,1,0,1|1,0,1]=4 2460 B17R2.330382 CCCSc1c(cnc2c1cccc2)C=O 62a_100000210303_100000037458 [0,0,0,1,0,1|1,0,1]=4 2461 B17R2.190 CCCCc1nc2ccccc2cc1C=O 271570a_100020621405_100000183649 [0,1,0,1,0,0|0,0,1]=3 2462 B17R2.190 CCCSc1nc2ccccc2cc1C=O 62a_100000210303_100000183649 [0,1,0,1,0,0|1,0,1]=4 2463 B17R2.2104 CCCCC(=O)c1ccc2ccccc2c1 1458a_100000210637_100000210211 [0,1,0,1,0,0|1,0,1]=4 2464 B17R2.2104 CCCCN(C)c1ccc2ccccc2c1 2230a_100000181211_100000210211 [0,1,0,1,0,0|2,0,0]=4 2465 B17R2.2104 CCCCN(C)c1ccc2ccccc2c1 269982a_100000181211_100000210211 [0,1,0,1,0,0|2,0,0]=4 2466 B17R2.2104 CCCCN(C)c1ccc2ccccc2c1 34a_100000181211_100000210210 [0,1,0,1,0,0|2,0,0]=4 2467 B17R2.2104 CCCNC(C)c1ccc2ccccc2c1 2230a_100000737073_100000210303 [0,1,0,1,0,0|2,0,0]=4 2468 B17R2.2104 CCCNC(C)c1ccc2ccccc2c1 269862a_100020643023_100000210793 [0,1,0,1,0,0|2,0,0]=4 2469 B17R2.2104 CCCNC(C)c1cnc2ccccc2c1 269862a_100020643023_100011376191 [0,1,0,1,0,0|2,0,0]=4 2470 B17R2.2104 CCCOC(C)c1ccc2ccccc2c1 34a_100011215343_100000210303 [0,1,0,1,0,0|2,0,0]=4 2471 B17R2.2104 CCCOC(C)c1ccc2ccccc2c1 7a_100011215343_100000210303 [0,1,0,1,0,0|2,0,0]=4 2472 B17R2.2104 CCNCC(O)c1ccc2ccccc2c1 2230a_100000754022_100000210202 [0,1,0,1,0,0|2,0,0]=4 2473 B17R2.2104 CCNCC(O)c1ccc2ccccc2c1 34a_100000754022_100000210202 [0,1,0,1,0,0|2,0,0]=4 2474 B17R2.4563 CCNC1CCN(C1=O)Cc2ccccc2 2230a_100015525214_100011875758 [0,1,0,1,0,0|1,0,1]=4 2475 B17R2.4563 CCOC1CCN(C1=O)Cc2ccccc2 34a_100121572206_100011875758 [0,1,0,1,0,0|1,0,1]=4 2476 B17R2.4563 CCSC1CCN(C1=O)Cc2ccccc2 62a_100000210202_100011875758 [0,1,0,1,0,0|1,0,1]=4 2477 B17R2.4563 CCSC1CCN(C1=O)Cc2ccccc2 62a_100011875758_100000210202 [0,1,0,1,0,0|1,0,1]=4 2478 B17R2.2159 CCCC(=O)Cc1ccc2ccccc2c1 1458a_100000181716_100000210303 [0,1,0,1,0,0|1,0,1]=4 2479 B17R2.2159 CCCC(=O)Cc1ccc2ccccc2c1 1458a_100000211992_100011216711 [0,1,0,1,0,0|1,0,1]=4 2480 B17R2.2159 CCCC(C)Nc1ccc2ccccc2c1 34a_100000211940_100000766640 [0,1,0,1,0,0|2,0,0]=4 2481 B17R2.2159 CCCC(C)Nc1ccc2ccccc2c1 7a_100000211940_100000766640 [0,1,0,1,0,0|2,0,0]=4 2482 B17R2.2159 CCCC(C)Oc1ccc2ccccc2c1 34a_100000185828_100000766640 [0,1,0,1,0,0|2,0,0]=4 2483 B17R2.2159 CCCC(C)Oc1ccc2ccccc2c1 7a_100000185828_100000766640 [0,1,0,1,0,0|2,0,0]=4 2484 B17R2.2159 CCCC(C)Oc1cnc2ccccc2c1 34a_100011934006_100000766640 [0,1,0,1,0,0|2,0,0]=4 2485 B17R2.2159 CCCC(C)Oc1cnc2ccccc2c1 7a_100011934006_100000766640 [0,1,0,1,0,0|2,0,0]=4 2486 B17R2.2159 CCCC(C)Sc1cnc2ccccc2c1 62a_100000766640_100000737414 [0,1,0,1,0,0|2,0,0]=4 2487 B17R2.2159 CCCN(C)Cc1ccc2ccccc2c1 2230a_100000185194_100000210303 [0,1,0,1,0,0|2,0,0]=4 2488 B17R2.2159 CCCN(C)Cc1ccc2ccccc2c1 2230a_100000747261_100011216711 [0,1,0,1,0,0|2,0,0]=4 2489 B17R2.2159 CCCN(C)Cc1ccc2ccccc2c1 269982a_100000185194_100000210303 [0,1,0,1,0,0|2,0,0]=4 2490 B17R2.2159 CCCN(C)Cc1ccc2ccccc2c1 269982a_100000747261_100011216711 [0,1,0,1,0,0|2,0,0]=4 2491 B17R2.2159 CCCN(C)Cc1ccc2ccccc2c1 270004a_100000747261_100000211584 [0,1,0,1,0,0|2,0,0]=4 2492 B17R2.2159 CCCN(C)Cc1cnc2ccccc2c1 2230a_100011875994_100000210303 [0,1,0,1,0,0|2,0,0]=4 2493 B17R2.2159 CCCN(C)Cc1cnc2ccccc2c1 269982a_100011875994_100000210303 [0,1,0,1,0,0|2,0,0]=4 2494 B17R2.2159 CCCN(C)Cc1cnc2ccccc2c1 270004a_100000747261_100000750898 [0,1,0,1,0,0|2,0,0]=4 2495 B17R2.6041 N#CC(=Cc1ccc(cc1)Br)C2CCCC2 6a_100000186029_100011459498 [0,1,0,1,0,0|1,0,1]=4 2496 B17R2.6041 N#CC(=Cc1ccc(cc1)F)C2CCCC2 6a_100000210084_100011459498 [0,1,0,1,0,0|1,0,1]=4 2497 B17R2.6041 N#CC(=Cc1ccc(cc1)I)C2CCCC2 6a_100000188517_100011459498 [0,1,0,1,0,0|1,0,1]=4 2498 B17R2.56966 Cc1ccc(cc1)OC2CCCCCC2=O 7a_100000210336_100000243696 [0,1,0,1,0,0|1,0,1]=4 2499 B17R2.56966 Cc1ccc(cc1)SC2CCCCCC2=O 62a_100000186775_100000243696 [0,1,0,1,0,0|1,0,1]=4 2500 B17R2.56966 Cc1ccc(cc1)SC2CCCCCC2=O 62a_100000243696_100000186775 [0,1,0,1,0,0|1,0,1]=4 2501 B17R2.56966 Nc1ccc(cc1)SC2CCCCCC2=O 62a_100000185761_100000243696 [0,1,0,1,0,0|1,0,1]=4 2502 B17R2.56966 Nc1ccc(cc1)SC2CCCCCC2=O 62a_100000243696_100000185761 [0,1,0,1,0,0|1,0,1]=4 2503 B17R2.56966 O=C1CCCCCC1Oc2ccc(cc2)Br 7a_100000185759_100000243696 [0,1,0,1,0,0|1,0,1]=4 2504 B17R2.56966 O=C1CCCCCC1Oc2ccc(cc2)Cl 7a_100000210216_100000243696 [0,1,0,1,0,0|1,0,1]=4 2505 B17R2.56966 O=C1CCCCCC1Oc2ccc(cc2)I 7a_100000212066_100000243696 [0,1,0,1,0,0|1,0,1]=4 2506 B17R2.56966 O=C1CCCCCC1Sc2ccc(cc2)Br 62a_100000243696_100000752885 [0,1,0,1,0,0|1,0,1]=4 2507 B17R2.56966 O=C1CCCCCC1Sc2ccc(cc2)Br 62a_100000752885_100000243696 [0,1,0,1,0,0|1,0,1]=4 2508 B17R2.56966 O=C1CCCCCC1Sc2ccc(cc2)Cl 62a_100000243696_100000755918 [0,1,0,1,0,0|1,0,1]=4 2509 B17R2.56966 O=C1CCCCCC1Sc2ccc(cc2)Cl 62a_100000755918_100000243696 [0,1,0,1,0,0|1,0,1]=4 2510 B17R2.56966 O=C1CCCCCC1Sc2ccc(cc2)F 62a_100000211213_100000243696 [0,1,0,1,0,0|1,0,1]=4 2511 B17R2.56966 O=C1CCCCCC1Sc2ccc(cc2)F 62a_100000243696_100000211213 [0,1,0,1,0,0|1,0,1]=4 2512 B17R2.56966 O=C1CCCCCC1Sc2ccc(cc2)O 62a_100000243696_100000185759 [0,1,0,1,0,0|1,0,1]=4 2513 B17R2.73925 CCCCNc1ccc2cc(ccc2c1)Br 34a_100000185457_100000210210 [0,1,0,1,0,0|2,0,0]=4 2514 B17R2.73925 CCCCNc1ccc2cc(ccc2c1)Br 7a_100000185457_100000210211 [0,1,0,1,0,0|2,0,0]=4 2515 B17R2.73925 CCCCOc1ccc2cc(ccc2c1)Br 34a_100000185455_100000210210 [0,1,0,1,0,0|2,0,0]=4 2516 B17R2.73925 CCCCOc1ccc2cc(ccc2c1)Br 7a_100000185455_100000210211 [0,1,0,1,0,0|2,0,0]=4 2517 B17R2.73925 CCCCOc1ccc2cc(ccc2c1)C 34a_100000074090_100000210210 [0,1,0,1,0,0|2,0,0]=4 2518 B17R2.73925 CCCCOc1ccc2cc(ccc2c1)C 7a_100000074090_100000210211 [0,1,0,1,0,0|2,0,0]=4 2519 B17R2.73925 CCCCOc1ccc2cc(ccc2c1)Cl 34a_100000074905_100000210210 [0,1,0,1,0,0|2,0,0]=4 2520 B17R2.73925 CCCCOc1ccc2cc(ccc2c1)Cl 7a_100000074905_100000210211 [0,1,0,1,0,0|2,0,0]=4 2521 B17R2.73925 CCCCOc1ccc2cc(ccc2c1)F 34a_100009847029_100000210210 [0,1,0,1,0,0|2,0,0]=4 2522 B17R2.73925 CCCCOc1ccc2cc(ccc2c1)F 7a_100009847029_100000210211 [0,1,0,1,0,0|2,0,0]=4 2523 B17R2.73925 CCCCOc1ccc2cc(ccc2c1)O 271570a_203496583355_200011205783 [0,1,0,1,0,0|2,0,0]=4 2524 B17R2.73925 CCCCOc1cnc2cc(ccc2c1)F 34a_100012184162_100000210210 [0,1,0,1,0,0|2,0,0]=4 2525 B17R2.73925 CCCCOc1cnc2cc(ccc2c1)F 7a_100012184162_100000210211 [0,1,0,1,0,0|2,0,0]=4 2526 B17R2.73925 CCCCSc1ccc2cc(ccc2c1)F 62a_100000210211_100009817052 [0,1,0,1,0,0|2,0,0]=4 2527 B17R2.73925 CCCCSc1ccc2cc(ccc2c1)F 62a_100009817052_100000210210 [0,1,0,1,0,0|2,0,0]=4 2528 B17R2.73925 CCCCSc1ccc2cc(ccc2c1)N 62a_100000185457_100000210210 [0,1,0,1,0,0|2,0,0]=4 2529 B17R2.73925 CCCCSc1ccc2cc(ccc2c1)N 62a_100000210211_100000185457 [0,1,0,1,0,0|2,0,0]=4 2530 B17R2.73925 CCCCSc1ccc2cc(ccc2c1)O 62a_100000210211_100000185455 [0,1,0,1,0,0|2,0,0]=4 2531 B17R2.73925 CCCCSc1cnc2cc(ccc2c1)Cl 62a_100000210211_100015716233 [0,1,0,1,0,0|2,0,0]=4 2532 B17R2.73925 CCCCSc1cnc2cc(ccc2c1)Cl 62a_100015716233_100000210210 [0,1,0,1,0,0|2,0,0]=4 2533 B17R2.73925 CCCCSc1cnc2cc(ccc2c1)N 62a_100000210211_200010264087 [0,1,0,1,0,0|2,0,0]=4 2534 B17R2.73925 CCCCSc1cnc2cc(ccc2c1)N 62a_200010264087_100000210210 [0,1,0,1,0,0|2,0,0]=4 2535 B17R2.73925 CCCCSc1cnc2cc(ccc2c1)O 62a_100000210211_200010153753 [0,1,0,1,0,0|2,0,0]=4 2536 B17R2.73925 CCCNCc1ccc2cc(ccc2c1)Br 207a_100020643023_100012356508 [0,1,0,1,0,0|2,0,0]=4 2537 B17R2.73925 CCCNCc1ccc2cc(ccc2c1)Br 270004a_100020643023_100012356508 [0,1,0,1,0,0|2,0,0]=4 2538 B17R2.73925 CCCNCc1ccc2cc(ccc2c1)O 207a_100020643023_100000067190 [0,1,0,1,0,0|2,0,0]=4 2539 B17R2.73925 CCCNCc1ccc2cc(ccc2c1)O 270004a_100020643023_100000067190 [0,1,0,1,0,0|2,0,0]=4 2540 B17R2.73925 CCCNCc1ccc2cc(ccc2c1)O 34a_200000083168_100000210303 [0,1,0,1,0,0|2,0,0]=4 2541 B17R2.73925 CCCOCc1ccc2cc(ccc2c1)Br 34a_100000210258_100012356510 [0,1,0,1,0,0|2,0,0]=4 2542 B17R2.73925 CCCOCc1ccc2cc(ccc2c1)Br 34a_100012356509_100000210303 [0,1,0,1,0,0|2,0,0]=4 2543 B17R2.73925 CCCOCc1ccc2cc(ccc2c1)Br 7a_100012356509_100000210303 [0,1,0,1,0,0|2,0,0]=4 2544 B17R2.2015 CCCCNc1ccc2ccc(cc2c1)Br 34a_100010090036_100000210210 [0,1,0,1,0,0|2,0,0]=4 2545 B17R2.2015 CCCCNc1ccc2ccc(cc2c1)Br 7a_100010090036_100000210211 [0,1,0,1,0,0|2,0,0]=4 2546 B17R2.2015 CCCCNc1ccc2ccc(cc2c1)O 34a_100015378740_100000210210 [0,1,0,1,0,0|2,0,0]=4 2547 B17R2.2015 CCCCNc1ccc2ccc(cc2c1)O 7a_100015378740_100000210211 [0,1,0,1,0,0|2,0,0]=4 2548 B17R2.2015 CCCCOc1ccc2ccc(cc2c1)Br 34a_100009816537_100000210210 [0,1,0,1,0,0|2,0,0]=4 2549 B17R2.2015 CCCCOc1ccc2ccc(cc2c1)Br 7a_100009816537_100000210211 [0,1,0,1,0,0|2,0,0]=4 2550 B17R2.2015 CCCCOc1ccc2ccc(cc2c1)C 34a_100000091598_100000210210 [0,1,0,1,0,0|2,0,0]=4 2551 B17R2.2015 CCCCOc1ccc2ccc(cc2c1)C 7a_100000091598_100000210211 [0,1,0,1,0,0|2,0,0]=4 2552 B17R2.2015 CCCCOc1ccc2ccc(cc2c1)N 34a_100015378740_100000210210 [0,1,0,1,0,0|2,0,0]=4 2553 B17R2.2015 CCCCOc1ccc2ccc(cc2c1)N 7a_100015378740_100000210211 [0,1,0,1,0,0|2,0,0]=4 2554 B17R2.2015 CCCCOc1cnc2ccc(cc2c1)Br 34a_100000703654_100000210210 [0,1,0,1,0,0|2,0,0]=4 2555 B17R2.2015 CCCCOc1cnc2ccc(cc2c1)Br 7a_100000703654_100000210211 [0,1,0,1,0,0|2,0,0]=4 2556 B17R2.2015 CCCCSc1ccc2ccc(cc2c1)N 62a_100000210211_100010090036 [0,1,0,1,0,0|2,0,0]=4 2557 B17R2.2015 CCCCSc1ccc2ccc(cc2c1)N 62a_100010090036_100000210210 [0,1,0,1,0,0|2,0,0]=4 2558 B17R2.2015 CCCCSc1ccc2ccc(cc2c1)O 62a_100000210211_100009816537 [0,1,0,1,0,0|2,0,0]=4 2559 B17R2.2015 CCCCSc1cnc2ccc(cc2c1)Br 62a_100000210211_100010740133 [0,1,0,1,0,0|2,0,0]=4 2560 B17R2.2015 CCCCSc1cnc2ccc(cc2c1)Br 62a_100010740133_100000210210 [0,1,0,1,0,0|2,0,0]=4 2561 B17R2.2015 CCCCSc1cnc2ccc(cc2c1)C 62a_100000210211_100015841224 [0,1,0,1,0,0|2,0,0]=4 2562 B17R2.2015 CCCCSc1cnc2ccc(cc2c1)Cl 62a_100000210211_100015929906 [0,1,0,1,0,0|2,0,0]=4 2563 B17R2.2015 CCCCSc1cnc2ccc(cc2c1)Cl 62a_100015929906_100000210210 [0,1,0,1,0,0|2,0,0]=4 2564 B17R2.2015 CCCCSc1cnc2ccc(cc2c1)N 62a_100000210211_100009888932 [0,1,0,1,0,0|2,0,0]=4 2565 B17R2.2015 CCCCSc1cnc2ccc(cc2c1)N 62a_100009888932_100000210210 [0,1,0,1,0,0|2,0,0]=4 2566 B17R2.2015 CCCCSc1cnc2ccc(cc2c1)O 62a_100000210211_100010137430 [0,1,0,1,0,0|2,0,0]=4 2567 B17R2.2015 CCCNCc1ccc2ccc(cc2c1)Br 207a_100020643023_100010200085 [0,1,0,1,0,0|2,0,0]=4 2568 B17R2.2015 CCCNCc1ccc2ccc(cc2c1)Br 270004a_100020643023_100010200085 [0,1,0,1,0,0|2,0,0]=4 2569 B17R2.2015 CCCNCc1cnc2ccc(cc2c1)Br 207a_100020643023_100010174008 [0,1,0,1,0,0|2,0,0]=4 2570 B17R2.2015 CCCNCc1cnc2ccc(cc2c1)Br 270004a_100020643023_100010174008 [0,1,0,1,0,0|2,0,0]=4 2571 B17R2.2015 CCCNCc1cnc2ccc(cc2c1)Cl 207a_100020643023_200000110299 [0,1,0,1,0,0|2,0,0]=4 2572 B17R2.2015 CCCNCc1cnc2ccc(cc2c1)Cl 270004a_100020643023_200000110299 [0,1,0,1,0,0|2,0,0]=4 2573 B17R2.6045 N#CC(=Cc1cccc(c1)Br)C2CCCC2 6a_100000210085_100011459498 [0,1,0,1,0,0|1,0,1]=4 2574 B17R2.6045 N#CC(=Cc1cccc(c1)F)C2CCCC2 6a_100000210812_100011459498 [0,1,0,1,0,0|1,0,1]=4 2575 B17R2.6045 N#CC(=Cc1cccc(c1)I)C2CCCC2 6a_100000014684_100011459498 [0,1,0,1,0,0|1,0,1]=4 2576 B17R2.19628 Cc1cccc(c1)OC2CCCCCC2=O 7a_100000210337_100000243696 [0,1,0,1,0,0|1,0,1]=4 2577 B17R2.19628 Cc1cccc(c1)SC2CCCCCC2=O 62a_100000243696_100011215228 [0,1,0,1,0,0|1,0,1]=4 2578 B17R2.19628 Cc1cccc(c1)SC2CCCCCC2=O 62a_100011215228_100000243696 [0,1,0,1,0,0|1,0,1]=4 2579 B17R2.19628 Nc1cccc(c1)SC2CCCCCC2=O 62a_100000210019_100000243696 [0,1,0,1,0,0|1,0,1]=4 2580 B17R2.19628 Nc1cccc(c1)SC2CCCCCC2=O 62a_100000243696_100000210019 [0,1,0,1,0,0|1,0,1]=4 2581 B17R2.19628 O=C1CCCCCC1Oc2cccc(c2)Br 7a_100000210342_100000243696 [0,1,0,1,0,0|1,0,1]=4 2582 B17R2.19628 O=C1CCCCCC1Oc2cccc(c2)Cl 7a_100000210295_100000243696 [0,1,0,1,0,0|1,0,1]=4 2583 B17R2.19628 O=C1CCCCCC1Oc2cccc(c2)F 7a_100000210426_100000243696 [0,1,0,1,0,0|1,0,1]=4 2584 B17R2.19628 O=C1CCCCCC1Oc2cccc(c2)I 7a_100000211634_100000243696 [0,1,0,1,0,0|1,0,1]=4 2585 B17R2.19628 O=C1CCCCCC1Sc2cccc(c2)Br 62a_100000243696_100000691529 [0,1,0,1,0,0|1,0,1]=4 2586 B17R2.19628 O=C1CCCCCC1Sc2cccc(c2)Br 62a_100000691529_100000243696 [0,1,0,1,0,0|1,0,1]=4 2587 B17R2.19628 O=C1CCCCCC1Sc2cccc(c2)Cl 62a_100000243696_100000699651 [0,1,0,1,0,0|1,0,1]=4 2588 B17R2.19628 O=C1CCCCCC1Sc2cccc(c2)Cl 62a_100000699651_100000243696 [0,1,0,1,0,0|1,0,1]=4 2589 B17R2.19628 O=C1CCCCCC1Sc2cccc(c2)F 62a_100000243696_100000685547 [0,1,0,1,0,0|1,0,1]=4 2590 B17R2.19628 O=C1CCCCCC1Sc2cccc(c2)F 62a_100000685547_100000243696 [0,1,0,1,0,0|1,0,1]=4 2591 B17R2.19628 O=C1CCCCCC1Sc2cccc(c2)O 62a_100000243696_100000211634 [0,1,0,1,0,0|1,0,1]=4 2592 B17R2.19628 O=C1CCCCCC1Sc2cccc(c2)[S] 62a_100000243696_114929384022 [0,1,0,1,0,0|1,0,1]=4 2593 B17R2.19628 O=C1CCCCCC1Sc2cccc(c2)[S] 62a_114929384022_100000243696 [0,1,0,1,0,0|1,0,1]=4 2594 B17R2.103529 CCCCNc1ccc2c(cccc2c1)O 34a_100000035793_100000210210 [0,1,0,1,0,0|2,0,0]=4 2595 B17R2.103529 CCCCNc1ccc2c(cccc2c1)O 7a_100000035793_100000210211 [0,1,0,1,0,0|2,0,0]=4 2596 B17R2.103529 CCCCOc1ccc2c(cccc2c1)N 34a_100000034668_100000210210 [0,1,0,1,0,0|2,0,0]=4 2597 B17R2.103529 CCCCOc1ccc2c(cccc2c1)N 7a_100000034668_100000210211 [0,1,0,1,0,0|2,0,0]=4 2598 B17R2.103529 CCCCOc1cnc2c(cccc2c1)F 34a_100012184956_100000210210 [0,1,0,1,0,0|2,0,0]=4 2599 B17R2.103529 CCCCOc1cnc2c(cccc2c1)F 7a_100012184956_100000210211 [0,1,0,1,0,0|2,0,0]=4 2600 B17R2.103529 CCCCSc1ccc2c(cccc2c1)N 62a_100000210211_100010090037 [0,1,0,1,0,0|2,0,0]=4 2601 B17R2.103529 CCCCSc1ccc2c(cccc2c1)N 62a_100010090037_100000210210 [0,1,0,1,0,0|2,0,0]=4 2602 B17R2.103529 CCCCSc1ccc2c(cccc2c1)O 62a_100000210211_100010202202 [0,1,0,1,0,0|2,0,0]=4 2603 B17R2.103529 CCCCSc1cnc2c(cccc2c1)Br 62a_100000210211_100010204298 [0,1,0,1,0,0|2,0,0]=4 2604 B17R2.103529 CCCCSc1cnc2c(cccc2c1)Br 62a_100010204298_100000210210 [0,1,0,1,0,0|2,0,0]=4 2605 B17R2.103529 CCCCSc1cnc2c(cccc2c1)C 62a_100000210211_100009829671 [0,1,0,1,0,0|2,0,0]=4 2606 B17R2.103529 CCCCSc1cnc2c(cccc2c1)Cl 62a_100000210211_100000759377 [0,1,0,1,0,0|2,0,0]=4 2607 B17R2.103529 CCCCSc1cnc2c(cccc2c1)F 62a_100000049890_100000210210 [0,1,0,1,0,0|2,0,0]=4 2608 B17R2.103529 CCCCSc1cnc2c(cccc2c1)F 62a_100000210211_100000049890 [0,1,0,1,0,0|2,0,0]=4 2609 B17R2.103529 CCCCSc1cnc2c(cccc2c1)N 62a_100000210211_100000702407 [0,1,0,1,0,0|2,0,0]=4 2610 B17R2.3299 CCCCCOc1cc2ccccc2n1C 34a_100000066695_100000718602 [0,1,0,1,0,0|2,0,0]=4 2611 B17R2.3299 CCCCCSC1Cc2ccccc2C1=O 62a_100000210326_100011218503 [0,1,0,1,0,0|0,0,2]=4 2612 B17R2.3299 CCCCCSC1Cc2ccccc2C1=O 62a_100011218503_100000210326 [0,1,0,1,0,0|0,0,2]=4 2613 B17R2.3299 CCCCNCc1[nH]c2ccccc2c1C 270004a_100000102301_100000066550 [0,1,0,1,0,0|2,0,0]=4 2614 B17R2.3299 CCCCNCc1[nH]c2ccccc2c1Cl 270004a_100000102301_100000050720 [0,1,0,1,0,0|2,0,0]=4 2615 B17R2.3299 CCCCNCc1cc2ccccc2n1C 270004a_100000102301_100000033373 [0,1,0,1,0,0|2,0,0]=4 2616 B17R2.3299 CCCCNCc1oc2ccccc2c1C 207a_100000102301_100000077534 [0,1,0,1,0,0|2,0,0]=4 2617 B17R2.3299 CCCCNCc1oc2ccccc2c1C 2230a_100153394726_100000210211 [0,1,0,1,0,0|2,0,0]=4 2618 B17R2.3299 CCCCNCc1oc2ccccc2c1C 270004a_100000102301_100000077534 [0,1,0,1,0,0|2,0,0]=4 2619 B17R2.3299 CCCCNCc1oc2ccccc2c1C 34a_100153394726_100000210210 [0,1,0,1,0,0|2,0,0]=4 2620 B17R2.3299 CCCCNCc1sc2ccccc2c1Br 207a_100000102301_100009816528 [0,1,0,1,0,0|2,0,0]=4 2621 B17R2.3299 CCCCNCc1sc2ccccc2c1C 207a_100000102301_100000038699 [0,1,0,1,0,0|2,0,0]=4 2622 B17R2.3299 CCCCNCc1sc2ccccc2c1C 270004a_100000102301_100000038699 [0,1,0,1,0,0|2,0,0]=4 2623 B17R2.3299 CCCCNCc1sc2ccccc2c1Cl 207a_100000102301_100000017830 [0,1,0,1,0,0|2,0,0]=4 2624 B17R2.3299 CCCCNCc1sc2ccccc2c1Cl 2230a_100000102301_100000021718 [0,1,0,1,0,0|2,0,0]=4 2625 B17R2.3299 CCCCNCc1sc2ccccc2c1Cl 2230a_200015185765_100000210211 [0,1,0,1,0,0|2,0,0]=4 2626 B17R2.3299 CCCCNCc1sc2ccccc2c1Cl 270004a_100000102301_100000017830 [0,1,0,1,0,0|2,0,0]=4 2627 B17R2.3299 CCCCNCc1sc2ccccc2c1Cl 7a_106832991798_100000021718 [0,1,0,1,0,0|2,0,0]=4 2628 B17R2.3299 CCCCOCc1cc2ccccc2n1C 34a_100000081300_100000210210 [0,1,0,1,0,0|2,0,0]=4 2629 B17R2.3299 CCCCOCc1sc2ccccc2c1Cl 34a_100000210227_100000021718 [0,1,0,1,0,0|2,0,0]=4 2630 B17R2.3299 CCCCOCc1sc2ccccc2c1Cl 7a_100000210227_100000021718 [0,1,0,1,0,0|2,0,0]=4 2631 B17R2.5879 BrCCCOCc1ccc2ccccc2c1 34a_100011217188_100011216711 [0,1,0,1,0,0|2,0,0]=4 2632 B17R2.5879 CCCCC=Cc1cnc2ccccc2c1 271570a_100016275911_100000737414 [0,1,0,1,0,0|1,0,1]=4 2633 B17R2.5879 CCCCCNc1ccc2ccccc2c1 34a_100000211940_100000718602 [0,1,0,1,0,0|1,0,0]=3 2634 B17R2.5879 CCCCCNc1ccc2ccccc2c1 7a_100000211940_100000210326 [0,1,0,1,0,0|1,0,0]=3 2635 B17R2.5879 CCCCCNc1ccc2ccccc2n1 27a_100000209983_100011291633 [0,1,0,1,0,0|2,0,0]=4 2636 B17R2.5879 CCCCCNc1ccc2cccnc2c1 34a_100102887122_100000718602 [0,1,0,1,0,0|2,0,0]=4 2637 B17R2.5879 CCCCCNc1ccc2cnccc2c1 34a_100000039641_100000718602 [0,1,0,1,0,0|2,0,0]=4 2638 B17R2.5879 CCCCCNc1ccc2ncccc2c1 34a_100011198106_100000718602 [0,1,0,1,0,0|2,0,0]=4 2639 B17R2.5879 CCCCCNc1cnc2ccccc2n1 27a_100000209983_100000756483 [0,1,0,1,0,0|2,0,0]=4 2640 B17R2.5879 CCCCCOc1ccc2ccccc2c1 34a_100000185828_100000718602 [0,1,0,1,0,0|1,0,0]=3 2641 B17R2.5879 CCCCCOc1ccc2ccccc2c1 7a_100000185828_100000210326 [0,1,0,1,0,0|1,0,0]=3 2642 B17R2.5879 CCCCCOc1ccc2cccnc2c1 34a_100011216045_100000718602 [0,1,0,1,0,0|2,0,0]=4 2643 B17R2.5879 CCCCCOc1ccc2ccncc2c1 7a_100000752006_100000210326 [0,1,0,1,0,0|2,0,0]=4 2644 B17R2.5879 CCCCCOc1ccc2cnccc2c1 34a_100000046372_100000718602 [0,1,0,1,0,0|2,0,0]=4 2645 B17R2.5879 CCCCCOc1ccc2cnccc2c1 7a_100000046372_100000210326 [0,1,0,1,0,0|2,0,0]=4 2646 B17R2.5879 CCCCCOc1ccc2ncccc2c1 34a_100011215586_100000718602 [0,1,0,1,0,0|2,0,0]=4 2647 B17R2.5879 CCCCCOc1ccc2ncccc2c1 7a_100011215586_100000210326 [0,1,0,1,0,0|2,0,0]=4 2648 B17R2.5879 CCCCCOc1cnc2ccccc2c1 34a_100011934006_100000718602 [0,1,0,1,0,0|1,0,0]=3 2649 B17R2.5879 CCCCCOc1cnc2ccccc2c1 7a_100011934006_100000210326 [0,1,0,1,0,0|1,0,0]=3 2650 B17R2.5879 CCCCCSc1cc2ccccc2cn1 62a_100000210326_100000047361 [0,1,0,1,0,0|2,0,0]=4 2651 B17R2.5879 CCCCCSc1cc2ccccc2cn1 62a_100009816522_100000210326 [0,1,0,1,0,0|2,0,0]=4 2652 B17R2.5879 CCCCCSc1ccc2ccccc2n1 62a_100000210326_100011291633 [0,1,0,1,0,0|2,0,0]=4 2653 B17R2.5879 CCCCCSc1ccc2ccccc2n1 62a_100011291633_100000210326 [0,1,0,1,0,0|2,0,0]=4 2654 B17R2.5879 CCCCCSc1ccc2cccnc2c1 62a_100000210326_100009816655 [0,1,0,1,0,0|2,0,0]=4 2655 B17R2.5879 CCCCCSc1ccc2ccncc2c1 62a_100000210326_100000686496 [0,1,0,1,0,0|2,0,0]=4 2656 B17R2.5879 CCCCCSc1ccc2ccncc2c1 62a_100000686496_100000210326 [0,1,0,1,0,0|2,0,0]=4 2657 B17R2.5879 CCCCCSc1ccc2cnccc2c1 62a_100000210326_100009816743 [0,1,0,1,0,0|2,0,0]=4 2658 B17R2.5879 CCCCCSc1ccc2cnccc2c1 62a_100009816743_100000210326 [0,1,0,1,0,0|2,0,0]=4 2659 B17R2.5879 CCCCCSc1ccc2ncccc2c1 62a_100000210326_100011215947 [0,1,0,1,0,0|2,0,0]=4 2660 B17R2.5879 CCCCCSc1ccc2ncccc2c1 62a_100011215947_100000210326 [0,1,0,1,0,0|2,0,0]=4 2661 B17R2.5879 CCCCCSc1cnc2ccccc2c1 62a_100000210326_100000737414 [0,1,0,1,0,0|1,0,0]=3 2662 B17R2.5879 CCCCCSc1cnc2ccccc2n1 62a_100000210326_100000756483 [0,1,0,1,0,0|2,0,0]=4 2663 B17R2.5879 CCCCCSc1cnc2ccccc2n1 62a_100000756483_100000210326 [0,1,0,1,0,0|2,0,0]=4 2664 B17R2.5879 CCCCCSc1cnc2cccnc2c1 62a_100000210326_100010246316 [0,1,0,1,0,0|2,0,0]=4 2665 B17R2.5879 CCCCCSc1cnc2cccnc2c1 62a_100010246316_100000210326 [0,1,0,1,0,0|2,0,0]=4 2666 B17R2.5879 CCCCNCC1=Cc2ccccc2OC1 270004a_100000102301_100000013085 [0,1,0,1,0,0|0,0,2]=4 2667 B17R2.5879 CCCCNCc1cc2ccccc2cn1 207a_100000102301_100000059776 [0,1,0,1,0,0|2,0,0]=4 2668 B17R2.5879 CCCCNCc1cc2ccccc2cn1 2230a_100000102301_100009869231 [0,1,0,1,0,0|2,0,0]=4 2669 B17R2.5879 CCCCNCc1cc2ccccc2cn1 270004a_100000102301_100000059776 [0,1,0,1,0,0|2,0,0]=4 2670 B17R2.5879 CCCCNCc1cc2ccccc2cn1 7a_106832991798_100009869231 [0,1,0,1,0,0|2,0,0]=4 2671 B17R2.5879 CCCCNCc1ccc2ccccc2c1 207a_100000102301_100000211584 [0,1,0,1,0,0|1,0,0]=3 2672 B17R2.5879 CCCCNCc1ccc2ccccc2c1 2230a_100000102301_100011216711 [0,1,0,1,0,0|1,0,0]=3 2673 B17R2.5879 CCCCNCc1ccc2ccccc2c1 2230a_100000739491_100000210211 [0,1,0,1,0,0|1,0,0]=3 2674 B17R2.5879 CCCCNCc1ccc2ccccc2c1 270004a_100000102301_100000211584 [0,1,0,1,0,0|1,0,0]=3 2675 B17R2.5879 CCCCNCc1ccc2ccccc2c1 34a_100000739491_100000210210 [0,1,0,1,0,0|1,0,0]=3 2676 B17R2.5879 CCCCNCc1ccc2ccccc2c1 7a_106832991798_100011216711 [0,1,0,1,0,0|1,0,0]=3 2677 B17R2.5879 CCCCNCc1ccc2ccccc2n1 207a_100000102301_100000759686 [0,1,0,1,0,0|2,0,0]=4 2678 B17R2.5879 CCCCNCc1ccc2ccccc2n1 2230a_100000102301_100000737579 [0,1,0,1,0,0|2,0,0]=4 2679 B17R2.5879 CCCCNCc1ccc2ccccc2n1 270004a_100000102301_100000759686 [0,1,0,1,0,0|2,0,0]=4 2680 B17R2.5879 CCCCNCc1ccc2ccccc2n1 7a_106832991798_100000737579 [0,1,0,1,0,0|2,0,0]=4 2681 B17R2.5879 CCCCNCc1ccc2cccnc2c1 207a_100000102301_100011784159 [0,1,0,1,0,0|2,0,0]=4 2682 B17R2.5879 CCCCNCc1ccc2cccnc2c1 270004a_100000102301_100011784159 [0,1,0,1,0,0|2,0,0]=4 2683 B17R2.5879 CCCCNCc1ccc2cnccc2c1 207a_100000102301_100000068276 [0,1,0,1,0,0|2,0,0]=4 2684 B17R2.5879 CCCCNCc1ccc2cnccc2c1 2230a_100000102301_100020605334 [0,1,0,1,0,0|2,0,0]=4 2685 B17R2.5879 CCCCNCc1ccc2cnccc2c1 270004a_100000102301_100000068276 [0,1,0,1,0,0|2,0,0]=4 2686 B17R2.5879 CCCCNCc1ccc2cnccc2c1 7a_106832991798_100020605334 [0,1,0,1,0,0|2,0,0]=4 2687 B17R2.5879 CCCCNCc1ccc2ncccc2c1 207a_100000102301_100000211315 [0,1,0,1,0,0|2,0,0]=4 2688 B17R2.5879 CCCCNCc1ccc2ncccc2c1 2230a_100000102301_100000703657 [0,1,0,1,0,0|2,0,0]=4 2689 B17R2.5879 CCCCNCc1ccc2ncccc2c1 270004a_100000102301_100000211315 [0,1,0,1,0,0|2,0,0]=4 2690 B17R2.5879 CCCCNCc1ccc2ncccc2c1 34a_100000238500_100000210210 [0,1,0,1,0,0|2,0,0]=4 2691 B17R2.5879 CCCCNCc1ccc2ncccc2c1 7a_106832991798_100000703657 [0,1,0,1,0,0|2,0,0]=4 2692 B17R2.5879 CCCCNCc1cnc2ccccc2c1 207a_100000102301_100000750898 [0,1,0,1,0,0|1,0,0]=3 2693 B17R2.5879 CCCCNCc1cnc2ccccc2c1 270004a_100000102301_100000750898 [0,1,0,1,0,0|1,0,0]=3 2694 B17R2.5879 CCCCNCc1cnc2ccccc2c1 34a_100000742225_100000210210 [0,1,0,1,0,0|1,0,0]=3 2695 B17R2.5879 CCCCNCc1cnc2ccccc2n1 270004a_100000102301_100000204677 [0,1,0,1,0,0|2,0,0]=4 2696 B17R2.5879 CCCCNCc1cnc2ccccc2n1 7a_106832991798_200000751123 [0,1,0,1,0,0|2,0,0]=4 2697 B17R2.5879 CCCCOCc1cc2ccccc2cn1 34a_100000210227_100009869231 [0,1,0,1,0,0|2,0,0]=4 2698 B17R2.5879 CCCCOCc1cc2ccccc2cn1 7a_100000210227_100009869231 [0,1,0,1,0,0|2,0,0]=4 2699 B17R2.5879 CCCCOCc1ccc2ccccc2c1 34a_100000210227_100011216711 [0,1,0,1,0,0|1,0,0]=3 2700 B17R2.5879 CCCCOCc1ccc2ccccc2c1 34a_100011215330_100000210210 [0,1,0,1,0,0|1,0,0]=3 2701 B17R2.5879 CCCCOCc1ccc2ccccc2c1 7a_100000210227_100011216711 [0,1,0,1,0,0|1,0,0]=3 2702 B17R2.5879 CCCCOCc1ccc2ccccc2c1 7a_100011215330_100000210211 [0,1,0,1,0,0|1,0,0]=3 2703 B17R2.5879 CCCCOCc1ccc2ccccc2n1 34a_100000210227_100000737579 [0,1,0,1,0,0|2,0,0]=4 2704 B17R2.5879 CCCCOCc1ccc2ccccc2n1 7a_100000210227_100000737579 [0,1,0,1,0,0|2,0,0]=4 2705 B17R2.5879 CCCCOCc1ccc2cnccc2c1 34a_100000210227_100020605334 [0,1,0,1,0,0|2,0,0]=4 2706 B17R2.5879 CCCCOCc1ccc2cnccc2c1 7a_100000210227_100020605334 [0,1,0,1,0,0|2,0,0]=4 2707 B17R2.5879 CCCCOCc1ccc2ncccc2c1 34a_100000210227_100000703657 [0,1,0,1,0,0|2,0,0]=4 2708 B17R2.5879 CCCCOCc1ccc2ncccc2c1 34a_100011315636_100000210210 [0,1,0,1,0,0|2,0,0]=4 2709 B17R2.5879 CCCCOCc1ccc2ncccc2c1 7a_100000210227_100000703657 [0,1,0,1,0,0|2,0,0]=4 2710 B17R2.5879 CCCCOCc1cnc2ccccc2c1 34a_100011258773_100000210210 [0,1,0,1,0,0|1,0,0]=3 2711 B17R2.5879 CCCCOCc1cnc2ccccc2n1 7a_100000210227_200000751123 [0,1,0,1,0,0|2,0,0]=4 2712 B17R2.5879 CCCCSCc1cc2ccccc2cn1 62a_100000210211_100009869231 [0,1,0,1,0,0|2,0,0]=4 2713 B17R2.5879 CCCCSCc1cc2ccccc2cn1 62a_100009869231_100000210210 [0,1,0,1,0,0|2,0,0]=4 2714 B17R2.5879 CCCCSCc1ccc2ccccc2c1 62a_100000210211_100011216711 [0,1,0,1,0,0|1,0,0]=3 2715 B17R2.5879 CCCCSCc1ccc2ccccc2c1 62a_100011216711_100000210210 [0,1,0,1,0,0|1,0,0]=3 2716 B17R2.5879 CCCCSCc1ccc2ccccc2n1 62a_100000210211_100000737579 [0,1,0,1,0,0|2,0,0]=4 2717 B17R2.5879 CCCCSCc1ccc2ccccc2n1 62a_100000737579_100000210210 [0,1,0,1,0,0|2,0,0]=4 2718 B17R2.5879 CCCCSCc1ccc2cnccc2c1 62a_100000210211_100020605334 [0,1,0,1,0,0|2,0,0]=4 2719 B17R2.5879 CCCCSCc1ccc2cnccc2c1 62a_100020605334_100000210210 [0,1,0,1,0,0|2,0,0]=4 2720 B17R2.5879 CCCCSCc1ccc2ncccc2c1 62a_100000210211_100000703657 [0,1,0,1,0,0|2,0,0]=4 2721 B17R2.5879 CCCCSCc1ccc2ncccc2c1 62a_100000703657_100000210210 [0,1,0,1,0,0|2,0,0]=4 2722 B17R2.5879 CCCCSCc1cnc2ccccc2n1 62a_100000210211_200000751123 [0,1,0,1,0,0|2,0,0]=4 2723 B17R2.5879 CCCCSCc1cnc2ccccc2n1 62a_200000751123_100000210210 [0,1,0,1,0,0|2,0,0]=4 2724 B17R2.5879 CCCNCCc1ccc2ccccc2c1 2230a_100000746582_100000210303 [0,1,0,1,0,0|1,0,0]=3 2725 B17R2.5879 CCCNCCc1ccc2ccccc2c1 34a_100000746582_100000210303 [0,1,0,1,0,0|1,0,0]=3 2726 B17R2.5879 CCCOCCc1ccc2ccccc2c1 34a_100000755654_100000210303 [0,1,0,1,0,0|1,0,0]=3 2727 B17R2.5879 CCCOCCc1ccc2ccccc2c1 7a_100000755654_100000210303 [0,1,0,1,0,0|1,0,0]=3 2728 B17R2.5879 CCCOCCc1ccc2ccccc2n1 34a_100011996444_100000210303 [0,1,0,1,0,0|2,0,0]=4 2729 B17R2.5879 CCOCCNc1ccc2ccccc2c1 34a_100000211940_100000210147 [0,1,0,1,0,0|2,0,0]=4 2730 B17R2.5879 CCOCCNc1ccc2ccccc2c1 7a_100000211940_100011215890 [0,1,0,1,0,0|2,0,0]=4 2731 B17R2.5879 CCOCCOc1ccc2ccccc2c1 34a_100000185828_100000210147 [0,1,0,1,0,0|2,0,0]=4 2732 B17R2.5879 CCOCCOc1ccc2ccccc2c1 34a_200011219602_100000210202 [0,1,0,1,0,0|2,0,0]=4 2733 B17R2.5879 CCOCCOc1ccc2ccccc2c1 7a_100000185828_100011215890 [0,1,0,1,0,0|2,0,0]=4 2734 B17R2.5879 CCOCCOc1ccc2ccccc2c1 7a_200011219602_100000210202 [0,1,0,1,0,0|2,0,0]=4 2735 B17R2.5879 CCOCCOc1cnc2ccccc2c1 34a_100011934006_100000210147 [0,1,0,1,0,0|2,0,0]=4 2736 B17R2.5879 CCOCCOc1cnc2ccccc2c1 7a_100011934006_100011215890 [0,1,0,1,0,0|2,0,0]=4 2737 B17R2.5879 CCOCCSc1ccc2ccccc2c1 62a_100000210147_100000233703 [0,1,0,1,0,0|2,0,0]=4 2738 B17R2.5879 CCOCCSc1cnc2ccccc2c1 62a_100000210147_100000737414 [0,1,0,1,0,0|2,0,0]=4 2739 B17R2.5879 CCOCSCc1ccc2ccccc2c1 62a_100000739092_100011216711 [0,1,0,1,0,0|2,0,0]=4 2740 B17R2.5879 CCOCSCc1ccc2ccccc2c1 62a_100011216711_100000739092 [0,1,0,1,0,0|2,0,0]=4 2741 B17R2.5879 CCSCCNc1ccc2ccccc2c1 34a_100000211940_100000757381 [0,1,0,1,0,0|2,0,0]=4 2742 B17R2.5879 CCSCCNc1ccc2ccccc2c1 7a_100000211940_100000757381 [0,1,0,1,0,0|2,0,0]=4 2743 B17R2.5879 CCSCCOc1ccc2ccccc2c1 34a_100000185828_100000757381 [0,1,0,1,0,0|2,0,0]=4 2744 B17R2.5879 CCSCCOc1ccc2ccccc2c1 7a_100000185828_100000757381 [0,1,0,1,0,0|2,0,0]=4 2745 B17R2.5879 CCSCCOc1cnc2ccccc2c1 34a_100011934006_100000757381 [0,1,0,1,0,0|2,0,0]=4 2746 B17R2.5879 CCSCCOc1cnc2ccccc2c1 7a_100011934006_100000757381 [0,1,0,1,0,0|2,0,0]=4 2747 B17R2.5879 CCSCCSc1ccc2ccccc2c1 62a_100000757381_100000233703 [0,1,0,1,0,0|2,0,0]=4 2748 B17R2.5879 CCSCCSc1cnc2ccccc2c1 62a_100000757381_100000737414 [0,1,0,1,0,0|2,0,0]=4 2749 B17R2.5879 CNCCCOc1ccc2ccccc2c1 2230a_106832991635_100000750887 [0,1,0,1,0,0|2,0,0]=4 2750 B17R2.5879 CNCCCOc1ccc2ccccc2c1 34a_100102657272_100000750887 [0,1,0,1,0,0|2,0,0]=4 2751 B17R2.5879 CNCCCOc1ccc2ccccc2c1 7a_106832991635_100000750887 [0,1,0,1,0,0|2,0,0]=4 2752 B17R2.5879 COCCCNc1ccc2ccccc2c1 34a_100000211940_100000740836 [0,1,0,1,0,0|2,0,0]=4 2753 B17R2.5879 COCCCNc1ccc2ccccc2c1 7a_100000211940_100000740836 [0,1,0,1,0,0|2,0,0]=4 2754 B17R2.5879 COCCCOc1ccc2ccccc2c1 34a_100000185828_100000740836 [0,1,0,1,0,0|2,0,0]=4 2755 B17R2.5879 COCCCOc1ccc2ccccc2c1 34a_100138415774_100000750887 [0,1,0,1,0,0|2,0,0]=4 2756 B17R2.5879 COCCCOc1ccc2ccccc2c1 7a_100000185828_100000740836 [0,1,0,1,0,0|2,0,0]=4 2757 B17R2.5879 COCCCOc1cnc2ccccc2c1 34a_100011934006_100000740836 [0,1,0,1,0,0|2,0,0]=4 2758 B17R2.5879 COCCCOc1cnc2ccccc2c1 7a_100011934006_100000740836 [0,1,0,1,0,0|2,0,0]=4 2759 B17R2.5879 COCCCSc1ccc2ccccc2c1 62a_100000709357_100000233703 [0,1,0,1,0,0|2,0,0]=4 2760 B17R2.5879 COCCCSc1cnc2ccccc2c1 62a_100000709357_100000737414 [0,1,0,1,0,0|2,0,0]=4 2761 B17R2.5879 COCCNCc1ccc2ccccc2c1 207a_100000209980_100000211584 [0,1,0,1,0,0|2,0,0]=4 2762 B17R2.5879 COCCNCc1ccc2ccccc2c1 2230a_100000209980_100011216711 [0,1,0,1,0,0|2,0,0]=4 2763 B17R2.5879 COCCNCc1ccc2ccccc2c1 2230a_100000739491_100011201679 [0,1,0,1,0,0|2,0,0]=4 2764 B17R2.5879 COCCNCc1ccc2ccccc2c1 270004a_100000209980_100000211584 [0,1,0,1,0,0|2,0,0]=4 2765 B17R2.5879 COCCNCc1ccc2ccccc2c1 34a_100000739491_100011201679 [0,1,0,1,0,0|2,0,0]=4 2766 B17R2.5879 COCCNCc1cnc2ccccc2c1 207a_100000209980_100000750898 [0,1,0,1,0,0|2,0,0]=4 2767 B17R2.5879 COCCNCc1cnc2ccccc2c1 270004a_100000209980_100000750898 [0,1,0,1,0,0|2,0,0]=4 2768 B17R2.5879 COCCNCc1cnc2ccccc2c1 34a_100000742225_100011201679 [0,1,0,1,0,0|2,0,0]=4 2769 B17R2.5879 COCCOCc1ccc2ccccc2c1 34a_100000210237_100011216711 [0,1,0,1,0,0|2,0,0]=4 2770 B17R2.5879 COCCOCc1ccc2ccccc2c1 34a_100011215330_100011201679 [0,1,0,1,0,0|2,0,0]=4 2771 B17R2.5879 COCCOCc1ccc2ccccc2c1 7a_100011215330_100000233755 [0,1,0,1,0,0|2,0,0]=4 2772 B17R2.5879 COCCOCc1cnc2ccccc2c1 34a_100011258773_100011201679 [0,1,0,1,0,0|2,0,0]=4 2773 B17R2.5879 COCCSCc1ccc2ccccc2c1 62a_100000233755_100011216711 [0,1,0,1,0,0|2,0,0]=4 2774 B17R2.5879 COCCSCc1ccc2ccccc2c1 62a_100011216711_100000233755 [0,1,0,1,0,0|2,0,0]=4 2775 B17R2.5879 COCNCCc1ccc2ccccc2c1 2230a_100000746582_100000766300 [0,1,0,1,0,0|2,0,0]=4 2776 B17R2.5879 CSCCCOc1ccc2ccccc2c1 62a_100000750887_200000210301 [0,1,0,1,0,0|2,0,0]=4 2777 B17R2.5879 CSCCCOc1ccc2ccccc2c1 62a_200000210301_100000750887 [0,1,0,1,0,0|2,0,0]=4 2778 B17R2.5879 CSCCNCc1ccc2ccccc2c1 207a_100020590264_100000211584 [0,1,0,1,0,0|2,0,0]=4 2779 B17R2.5879 CSCCNCc1ccc2ccccc2c1 2230a_100000739491_100000751147 [0,1,0,1,0,0|2,0,0]=4 2780 B17R2.5879 CSCCNCc1ccc2ccccc2c1 2230a_100020590264_100011216711 [0,1,0,1,0,0|2,0,0]=4 2781 B17R2.5879 CSCCNCc1ccc2ccccc2c1 270004a_100020590264_100000211584 [0,1,0,1,0,0|2,0,0]=4 2782 B17R2.5879 CSCCNCc1ccc2ccccc2c1 34a_100000739491_100000212216 [0,1,0,1,0,0|2,0,0]=4 2783 B17R2.5879 CSCCNCc1cnc2ccccc2c1 207a_100020590264_100000750898 [0,1,0,1,0,0|2,0,0]=4 2784 B17R2.5879 CSCCNCc1cnc2ccccc2c1 270004a_100020590264_100000750898 [0,1,0,1,0,0|2,0,0]=4 2785 B17R2.5879 CSCCNCc1cnc2ccccc2c1 34a_100000742225_100000212216 [0,1,0,1,0,0|2,0,0]=4 2786 B17R2.5879 CSCCOCc1ccc2ccccc2c1 34a_100000230434_100011216711 [0,1,0,1,0,0|2,0,0]=4 2787 B17R2.5879 CSCCOCc1ccc2ccccc2c1 34a_100011215330_100000212216 [0,1,0,1,0,0|2,0,0]=4 2788 B17R2.5879 CSCCOCc1ccc2ccccc2c1 7a_100000230434_100011216711 [0,1,0,1,0,0|2,0,0]=4 2789 B17R2.5879 CSCCOCc1ccc2ccccc2c1 7a_100011215330_100000212216 [0,1,0,1,0,0|2,0,0]=4 2790 B17R2.5879 CSCCOCc1cnc2ccccc2c1 34a_100011258773_100000212216 [0,1,0,1,0,0|2,0,0]=4 2791 B17R2.5879 CSCCSCc1ccc2ccccc2c1 62a_100000212216_100011216711 [0,1,0,1,0,0|2,0,0]=4 2792 B17R2.5879 CSCCSCc1ccc2ccccc2c1 62a_100011216711_100000751147 [0,1,0,1,0,0|2,0,0]=4 2793 B17R2.5879 CSCNCCc1ccc2ccccc2c1 2230a_100000746582_100011218213 [0,1,0,1,0,0|2,0,0]=4 2794 B17R2.5879 CSCNCCc1ccc2ccccc2c1 34a_100000746582_100011218213 [0,1,0,1,0,0|2,0,0]=4 2795 B17R2.5879 CSCOCCc1ccc2ccccc2c1 34a_100000755654_100011218213 [0,1,0,1,0,0|2,0,0]=4 2796 B17R2.5879 ClCCCOCc1ccc2ccccc2c1 34a_100000230001_100011216711 [0,1,0,1,0,0|2,0,0]=4 2797 B17R2.5879 FCCCCNc1ccc2ccccc2c1 34a_100000211940_100000729493 [0,1,0,1,0,0|2,0,0]=4 2798 B17R2.5879 FCCCCNc1ccc2ccccc2c1 7a_100000211940_100000729493 [0,1,0,1,0,0|2,0,0]=4 2799 B17R2.5879 FCCCCOc1ccc2ccccc2c1 34a_100000185828_100000729493 [0,1,0,1,0,0|2,0,0]=4 2800 B17R2.5879 FCCCCOc1ccc2ccccc2c1 7a_100000185828_100000729493 [0,1,0,1,0,0|2,0,0]=4 2801 B17R2.5879 FCCCCOc1cnc2ccccc2c1 34a_100011934006_100000729493 [0,1,0,1,0,0|2,0,0]=4 2802 B17R2.5879 FCCCCOc1cnc2ccccc2c1 7a_100011934006_100000729493 [0,1,0,1,0,0|2,0,0]=4 2803 B17R2.5879 FCCCCSc1ccc2ccccc2c1 62a_100000729493_100000233703 [0,1,0,1,0,0|2,0,0]=4 2804 B17R2.5879 FCCCCSc1cnc2ccccc2c1 62a_100000729493_100000737414 [0,1,0,1,0,0|2,0,0]=4 2805 B17R2.5879 FCCCNCc1ccc2ccccc2c1 207a_100015189416_100000211584 [0,1,0,1,0,0|2,0,0]=4 2806 B17R2.5879 FCCCNCc1ccc2ccccc2c1 2230a_100000739491_100011934791 [0,1,0,1,0,0|2,0,0]=4 2807 B17R2.5879 FCCCNCc1ccc2ccccc2c1 2230a_100015189416_100011216711 [0,1,0,1,0,0|2,0,0]=4 2808 B17R2.5879 FCCCNCc1ccc2ccccc2c1 270004a_100015189416_100000211584 [0,1,0,1,0,0|2,0,0]=4 2809 B17R2.5879 FCCCNCc1ccc2ccccc2c1 34a_100000739491_100011934791 [0,1,0,1,0,0|2,0,0]=4 2810 B17R2.5879 FCCCNCc1ccc2ccccc2c1 34a_100015189416_100011216711 [0,1,0,1,0,0|2,0,0]=4 2811 B17R2.5879 FCCCNCc1cnc2ccccc2c1 207a_100015189416_100000750898 [0,1,0,1,0,0|2,0,0]=4 2812 B17R2.5879 FCCCNCc1cnc2ccccc2c1 270004a_100015189416_100000750898 [0,1,0,1,0,0|2,0,0]=4 2813 B17R2.5879 FCCCNCc1cnc2ccccc2c1 34a_100000742225_100011934791 [0,1,0,1,0,0|2,0,0]=4 2814 B17R2.5879 FCCCOCc1ccc2ccccc2c1 34a_100000759539_100011216711 [0,1,0,1,0,0|2,0,0]=4 2815 B17R2.5879 FCCCOCc1ccc2ccccc2c1 34a_100011215330_100011934791 [0,1,0,1,0,0|2,0,0]=4 2816 B17R2.5879 FCCCOCc1ccc2ccccc2c1 7a_100011215330_100011934791 [0,1,0,1,0,0|2,0,0]=4 2817 B17R2.5879 FCCCOCc1cnc2ccccc2c1 34a_100011258773_100011934791 [0,1,0,1,0,0|2,0,0]=4 2818 B17R2.5879 FCCCSCc1ccc2ccccc2c1 62a_100011216711_100011934791 [0,1,0,1,0,0|2,0,0]=4 2819 B17R2.5879 FCCCSCc1ccc2ccccc2c1 62a_100011934791_100011216711 [0,1,0,1,0,0|2,0,0]=4 2820 B17R2.5879 FCCNCCc1ccc2ccccc2c1 2230a_100000746582_100011217306 [0,1,0,1,0,0|2,0,0]=4 2821 B17R2.5879 FCCNCCc1ccc2ccccc2c1 34a_100000746582_100011217306 [0,1,0,1,0,0|2,0,0]=4 2822 B17R2.5879 FCCOCCc1ccc2ccccc2c1 34a_100000755654_100011217306 [0,1,0,1,0,0|2,0,0]=4 2823 B17R2.5879 FCCOCCc1ccc2ccccc2c1 7a_100000755654_100011217306 [0,1,0,1,0,0|2,0,0]=4 2824 B17R2.5879 NCCCOCc1ccc2ccccc2c1 34a_100000182051_100011216711 [0,1,0,1,0,0|2,0,0]=4 2825 B17R2.5879 OCCCCNc1ccc2ccccc2c1 34a_100000211940_100011216708 [0,1,0,1,0,0|2,0,0]=4 2826 B17R2.5879 OCCCCNc1ccc2ccccc2c1 7a_100000211940_100000210776 [0,1,0,1,0,0|2,0,0]=4 2827 B17R2.5879 OCCCCOc1ccc2ccccc2c1 34a_100000185828_100011216708 [0,1,0,1,0,0|2,0,0]=4 2828 B17R2.5879 OCCCCOc1ccc2ccccc2c1 7a_100000185828_100000210776 [0,1,0,1,0,0|2,0,0]=4 2829 B17R2.5879 OCCCCOc1cnc2ccccc2c1 34a_100011934006_100011216708 [0,1,0,1,0,0|2,0,0]=4 2830 B17R2.5879 OCCCCOc1cnc2ccccc2c1 7a_100011934006_100000210776 [0,1,0,1,0,0|2,0,0]=4 2831 B17R2.5879 OCCCCSc1ccc2ccccc2c1 62a_100000210776_100000233703 [0,1,0,1,0,0|2,0,0]=4 2832 B17R2.5879 OCCCCSc1cnc2ccccc2c1 62a_100000210776_100000737414 [0,1,0,1,0,0|2,0,0]=4 2833 B17R2.5879 OCCCNCc1ccc2ccccc2c1 207a_100000182051_100000211584 [0,1,0,1,0,0|2,0,0]=4 2834 B17R2.5879 OCCCNCc1ccc2ccccc2c1 2230a_100000739491_100000230001 [0,1,0,1,0,0|2,0,0]=4 2835 B17R2.5879 OCCCNCc1ccc2ccccc2c1 270004a_100000182051_100000211584 [0,1,0,1,0,0|2,0,0]=4 2836 B17R2.5879 OCCCNCc1ccc2ccccc2c1 34a_100000739491_100000230001 [0,1,0,1,0,0|2,0,0]=4 2837 B17R2.5879 OCCCNCc1cnc2ccccc2c1 207a_100000182051_100000750898 [0,1,0,1,0,0|2,0,0]=4 2838 B17R2.5879 OCCCNCc1cnc2ccccc2c1 270004a_100000182051_100000750898 [0,1,0,1,0,0|2,0,0]=4 2839 B17R2.5879 OCCCNCc1cnc2ccccc2c1 34a_100000742225_100000230001 [0,1,0,1,0,0|2,0,0]=4 2840 B17R2.5879 OCCCOCc1ccc2ccccc2c1 34a_100011215330_100000230001 [0,1,0,1,0,0|2,0,0]=4 2841 B17R2.5879 OCCCOCc1ccc2ccccc2c1 7a_100011215330_100011215043 [0,1,0,1,0,0|2,0,0]=4 2842 B17R2.5879 OCCCOCc1cnc2ccccc2c1 34a_100011258773_100000230001 [0,1,0,1,0,0|2,0,0]=4 2843 B17R2.5879 OCCCSCc1ccc2ccccc2c1 62a_100011215043_100011216711 [0,1,0,1,0,0|2,0,0]=4 2844 B17R2.5879 OCCCSCc1ccc2ccccc2c1 62a_100011216711_100011215043 [0,1,0,1,0,0|2,0,0]=4 2845 B17R2.5879 OCCNCCc1ccc2ccccc2c1 2230a_100000746582_100000211926 [0,1,0,1,0,0|2,0,0]=4 2846 B17R2.5879 OCCNCCc1ccc2ccccc2c1 34a_100000746582_100000211926 [0,1,0,1,0,0|2,0,0]=4 2847 B17R2.5879 OCCOCCc1ccc2ccccc2c1 34a_100000755654_100000211926 [0,1,0,1,0,0|2,0,0]=4 2848 B17R2.5879 OCCOCCc1ccc2ccccc2c1 7a_100000755654_100000211926 [0,1,0,1,0,0|2,0,0]=4 2849 B17R2.5879 [13CH3]SCCCOc1ccc2ccccc2c1 62a_100000750887_200025704644 [0,1,0,1,0,0|2,0,0]=4 2850 B17R2.5879 [13CH3]SCCCOc1ccc2ccccc2c1 62a_200025704644_100000750887 [0,1,0,1,0,0|2,0,0]=4 2851 B17R2.274 CCCCSc1c[nH]nc1c2ccccc2 62a_100000210211_100011471533 [0,1,0,1,0,0|2,0,0]=4 2852 B17R2.274 CCCCSc1c[nH]nc1c2ccccc2 62a_100011471533_100000210210 [0,1,0,1,0,0|2,0,0]=4 2853 B17R2.274 CCCNCc1cn[nH]c1c2ccccc2 207a_100020643023_100000182173 [0,1,0,1,0,0|2,0,0]=4 2854 B17R2.274 CCCNCc1cn[nH]c1c2ccccc2 270004a_100020643023_100000182173 [0,1,0,1,0,0|2,0,0]=4 2855 B17R2.4993 CN(c1ccccc1)C2CCCCCC2=O 269982a_100000210012_100000243696 [0,1,0,1,0,0|1,0,1]=4 2856 B17R2.4993 O=C1CCCCCC1C(=O)c2ccccc2 1458a_100000185807_100000243696 [0,1,0,1,0,0|0,0,1]=3 2857 B17R2.4993 O=C1NCCCCC1C(=O)c2ccccc2 1458a_100000185807_100000735217 [0,1,0,1,0,0|1,0,1]=4 2858 B17R2.10270 CCCCNC1C(=O)c2ccccc2C1=O 2230a_100000102301_200009813996 [0,1,0,1,0,0|1,0,1]=4 2859 B17R2.10270 CCCCSC1C(=O)c2ccccc2C1=O 62a_100000210211_200009813996 [0,1,0,1,0,0|1,0,1]=4 2860 B17R2.10270 CCCCSC1C(=O)c2ccccc2C1=O 62a_200009813996_100000210210 [0,1,0,1,0,0|1,0,1]=4 2861 B17R2.10270 CCCSCN1C(=O)c2ccccc2C1=O 62a_100000210303_100000211781 [0,1,0,1,0,0|2,0,0]=4 2862 B17R2.10270 CCCSCN1C(=O)c2ccccc2C1=O 62a_100000211781_100000210303 [0,1,0,1,0,0|2,0,0]=4 2863 B17R2.10270 CCNCCN1C(=O)c2ccccc2C1=O 2230a_100015525214_100000185391 [0,1,0,1,0,0|2,0,0]=4 2864 B17R2.10270 CCSCCN1C(=O)c2ccccc2C1=O 62a_100000185391_100000210202 [0,1,0,1,0,0|2,0,0]=4 2865 B17R2.10270 CCSCCN1C(=O)c2ccccc2C1=O 62a_100000210202_100000185391 [0,1,0,1,0,0|2,0,0]=4 2866 B17R2.10270 CNCCCN1C(=O)c2ccccc2C1=O 2230a_106832991635_100000230172 [0,1,0,1,0,0|2,0,0]=4 2867 B17R2.10270 CNCCCN1C(=O)c2ccccc2C1=O 7a_106832991635_100000230172 [0,1,0,1,0,0|2,0,0]=4 2868 B17R2.10270 CSCCCN1C(=O)c2ccccc2C1=O 62a_100000230172_200000210301 [0,1,0,1,0,0|2,0,0]=4 2869 B17R2.10270 CSCCCN1C(=O)c2ccccc2C1=O 62a_200000210301_100000230172 [0,1,0,1,0,0|2,0,0]=4 2870 B17R2.10270 [13CH3]SCCCN1C(=O)c2ccccc2C1=O 62a_100000230172_200025704644 [0,1,0,1,0,0|2,0,0]=4 2871 B17R2.10270 [13CH3]SCCCN1C(=O)c2ccccc2C1=O 62a_200025704644_100000230172 [0,1,0,1,0,0|2,0,0]=4 2872 B17R2.12072 CCCCNc1cc(c2ccccc2c1)Br 34a_100010089974_100000210210 [0,1,0,1,0,0|2,0,0]=4 2873 B17R2.12072 CCCCNc1cc(c2ccccc2c1)Br 7a_100010089974_100000210211 [0,1,0,1,0,0|2,0,0]=4 2874 B17R2.12072 CCCCOc1cc(c2ccccc2c1)Br 34a_100010001680_100000210210 [0,1,0,1,0,0|2,0,0]=4 2875 B17R2.12072 CCCCOc1cc(c2ccccc2c1)Br 7a_100010001680_100000210211 [0,1,0,1,0,0|2,0,0]=4 2876 B17R2.12072 CCCCSc1cc(=O)c2ccccc2[nH]1 62a_100000210211_100000090176 [0,1,0,1,0,0|2,0,0]=4 2877 B17R2.12072 CCCCSc1cc(c2ccccc2c1)N 62a_100000210211_100010171453 [0,1,0,1,0,0|2,0,0]=4 2878 B17R2.12072 CCCCSc1cc(c2ccccc2c1)N 62a_100010171453_100000210210 [0,1,0,1,0,0|2,0,0]=4 2879 B17R2.12072 CCCCSc1cc(c2ccccc2c1)O 62a_100000210211_100010089979 [0,1,0,1,0,0|1,0,1]=4 2880 B17R2.12072 CCCCSc1cc2ccccc2c(=O)[nH]1 62a_100000210211_200015811170 [0,1,0,1,0,0|1,0,0]=3 2881 B17R2.12072 CCCCSc1cc2ccccc2c(n1)N 62a_100000210211_100009957331 [0,1,0,1,0,0|2,0,0]=4 2882 B17R2.12072 CCCCSc1cc2ccccc2c(n1)N 62a_100009957331_100000210210 [0,1,0,1,0,0|2,0,0]=4 2883 B17R2.12072 CCOCSc1cc2ccccc2c(=O)[nH]1 62a_100000739092_200015811170 [0,1,0,1,0,0|2,0,0]=4 2884 B17R2.12072 COCCSc1cc2ccccc2c(=O)[nH]1 62a_100000233755_200015811170 [0,1,0,1,0,0|2,0,0]=4 2885 B17R2.12072 CSCCSc1cc2ccccc2c(=O)[nH]1 62a_100000212216_200015811170 [0,1,0,1,0,0|2,0,0]=4 2886 B17R2.12072 O=c1[nH]c(cc2c1cccc2)SCCCF 62a_100011934791_200015811170 [0,1,0,1,0,0|2,0,0]=4 2887 B17R2.12072 O=c1[nH]c(cc2c1cccc2)SCCCO 62a_100011215043_200015811170 [0,1,0,1,0,0|2,0,0]=4 2888 B17R2.75314 O=CCN(Cc1ccccc1)CC2CCC2 2230a_106354213860_200015260668 [0,1,0,1,0,0|1,0,1]=4 2889 B17R2.75314 O=CCN(Cc1ccccc1)CC2CCC2 269982a_106354213860_200015260668 [0,1,0,1,0,0|1,0,1]=4 2890 B17R2.75314 O=CCN(Cc1ccccc1)CC2CCC2 34a_106354213860_200009817547 [0,1,0,1,0,0|1,0,1]=4 2891 B17R2.12116 CCCC=Cc1cc2ccccc2oc1=O 271570a_100016258520_200000187772 [0,1,0,1,0,0|0,0,2]=4 2892 B17R2.12116 CCCCNc1cc2ccccc2cc1Br 34a_100009991566_100000210210 [0,1,0,1,0,0|2,0,0]=4 2893 B17R2.12116 CCCCNc1cc2ccccc2cc1Br 7a_100009991566_100000210211 [0,1,0,1,0,0|2,0,0]=4 2894 B17R2.12116 CCCCOc1cc2ccccc2cc1Br 34a_100009817189_100000210210 [0,1,0,1,0,0|2,0,0]=4 2895 B17R2.12116 CCCCOc1cc2ccccc2cc1Br 7a_100009817189_100000210211 [0,1,0,1,0,0|2,0,0]=4 2896 B17R2.12116 CCCCOc1cc2ccccc2cc1C 34a_100000091601_100000210210 [0,1,0,1,0,0|2,0,0]=4 2897 B17R2.12116 CCCCOc1cc2ccccc2cc1C 7a_100000091601_100000210211 [0,1,0,1,0,0|2,0,0]=4 2898 B17R2.12116 CCCCOc1cc2ccccc2cc1N 34a_106744474703_100000210210 [0,1,0,1,0,0|2,0,0]=4 2899 B17R2.12116 CCCCOc1cc2ccccc2cc1N 7a_106744474703_100000210211 [0,1,0,1,0,0|2,0,0]=4 2900 B17R2.12116 CCCCOc1cc2ccccc2nc1C 34a_200000079175_100000210210 [0,1,0,1,0,0|2,0,0]=4 2901 B17R2.12116 CCCCOc1cc2ccccc2nc1C 7a_200000079175_100000210211 [0,1,0,1,0,0|2,0,0]=4 2902 B17R2.12116 CCCCOc1cc2ccccc2nc1Cl 34a_200000100762_100000210210 [0,1,0,1,0,0|2,0,0]=4 2903 B17R2.12116 CCCCOc1cc2ccccc2nc1Cl 7a_200000100762_100000210211 [0,1,0,1,0,0|2,0,0]=4 2904 B17R2.12116 CCCCOc1cc2ccccc2oc1=O 7a_100000061252_100000210211 [0,1,0,1,0,0|1,0,0]=3 2905 B17R2.12116 CCCCSc1cc2ccccc2cc1N 62a_100000210211_100009991566 [0,1,0,1,0,0|2,0,0]=4 2906 B17R2.12116 CCCCSc1cc2ccccc2cc1N 62a_100009991566_100000210210 [0,1,0,1,0,0|2,0,0]=4 2907 B17R2.12116 CCCCSc1cc2ccccc2cc1O 62a_100000210211_100009817189 [0,1,0,1,0,0|1,0,1]=4 2908 B17R2.12116 CCCCSc1cc2ccccc2nc1Cl 62a_100000210211_100010220712 [0,1,0,1,0,0|2,0,0]=4 2909 B17R2.12116 CCCCSc1cc2ccccc2nc1F 62a_100000210211_100011158909 [0,1,0,1,0,0|2,0,0]=4 2910 B17R2.12116 CCCCSc1cc2ccccc2nc1F 62a_100011158909_100000210210 [0,1,0,1,0,0|2,0,0]=4 2911 B17R2.12116 CCCCSc1cc2ccccc2nc1N 62a_100010135404_100000210210 [0,1,0,1,0,0|2,0,0]=4 2912 B17R2.12116 CCCCSc1cc2ccccc2nc1O 62a_100000210211_200009820883 [0,1,0,1,0,0|1,0,1]=4 2913 B17R2.12116 CCCCSc1cc2ccccc2oc1=O 62a_100000210211_200000187772 [0,1,0,1,0,0|1,0,0]=3 2914 B17R2.12116 CCCNCc1cc2ccccc2nc1O 207a_100020643023_100000184424 [0,1,0,1,0,0|1,0,1]=4 2915 B17R2.12116 CCCNCc1cc2ccccc2nc1O 270004a_100020643023_100000184424 [0,1,0,1,0,0|1,0,1]=4 2916 B17R2.12116 CCCOCc1cc2ccccc2nc1Cl 34a_100000210258_100000189640 [0,1,0,1,0,0|2,0,0]=4 2917 B17R2.12116 CCCOCc1cc2ccccc2nc1Cl 34a_100000754719_100000210303 [0,1,0,1,0,0|2,0,0]=4 2918 B17R2.12116 CCCOCc1cc2ccccc2nc1Cl 7a_100000754719_100000210303 [0,1,0,1,0,0|2,0,0]=4 2919 B17R2.12116 CCCSCc1cc2ccccc2nc1Cl 62a_100000210303_100000189640 [0,1,0,1,0,0|2,0,0]=4 2920 B17R2.12116 CCCSCc1nc2ccccc2[nH]c1=O 62a_100000736137_100000210303 [0,1,0,1,0,0|2,0,0]=4 2921 B17R2.12116 CCNCCc1cc2ccccc2nc1Cl 2230a_100015525214_100000066995 [0,1,0,1,0,0|2,0,0]=4 2922 B17R2.12116 CCOCCc1cc2ccccc2nc1Cl 34a_100121572206_100000066995 [0,1,0,1,0,0|2,0,0]=4 2923 B17R2.12116 CCOCSc1cc2ccccc2oc1=O 62a_100000739092_200000187772 [0,1,0,1,0,0|2,0,0]=4 2924 B17R2.12116 CCSCCc1cc2ccccc2nc1Cl 62a_100000210202_100000066995 [0,1,0,1,0,0|2,0,0]=4 2925 B17R2.12116 COCCOc1cc2ccccc2oc1=O 7a_100000061252_100000233755 [0,1,0,1,0,0|2,0,0]=4 2926 B17R2.12116 COCCSc1cc2ccccc2oc1=O 62a_100000233755_200000187772 [0,1,0,1,0,0|2,0,0]=4 2927 B17R2.12116 CSCCOc1cc2ccccc2oc1=O 7a_100000061252_100000212216 [0,1,0,1,0,0|2,0,0]=4 2928 B17R2.12116 CSCCSc1cc2ccccc2oc1=O 62a_100000212216_200000187772 [0,1,0,1,0,0|2,0,0]=4 2929 B17R2.12116 O=c1oc2ccccc2cc1OCCCF 7a_100000061252_100011934791 [0,1,0,1,0,0|2,0,0]=4 2930 B17R2.12116 O=c1oc2ccccc2cc1OCCCO 7a_100000061252_100011215043 [0,1,0,1,0,0|2,0,0]=4 2931 B17R2.12116 O=c1oc2ccccc2cc1SCCCF 62a_100011934791_200000187772 [0,1,0,1,0,0|2,0,0]=4 2932 B17R2.12116 O=c1oc2ccccc2cc1SCCCO 62a_100011215043_200000187772 [0,1,0,1,0,0|2,0,0]=4 2933 B17R2.159069 CC(=O)N(Cc1ccccc1)CC2CCC2 11a_106354213860_100015343762 [0,1,0,1,0,0|1,0,1]=4 2934 B17R2.159069 CC(=O)N(Cc1ccccc1)CC2CCC2 1626a_106354213860_100015343762 [0,1,0,1,0,0|1,0,1]=4 2935 B17R2.159069 CC(=O)N(Cc1ccccc1)CC2CCC2 240690a_106354213860_100015343762 [0,1,0,1,0,0|1,0,1]=4 2936 B17R2.159069 CC(=O)N(Cc1ccccc1)CC2CCC2 527a_106354213860_100103153847 [0,1,0,1,0,0|1,0,1]=4 2937 B17R2.5669 CC(=O)CCCc1ccc2ccccc2c1 1458a_100000697136_200000210301 [0,1,0,1,0,0|1,0,1]=4 2938 B17R2.5669 CC(Br)COCc1ccc2ccccc2c1 34a_100012180447_100011216711 [0,1,0,1,0,0|2,0,0]=4 2939 B17R2.5669 CC(C)CCNc1ccc2ccccc2c1 34a_100000211940_100000210312 [0,1,0,1,0,0|2,0,0]=4 2940 B17R2.5669 CC(C)CCNc1ccc2ccccc2c1 7a_100000211940_100000210626 [0,1,0,1,0,0|2,0,0]=4 2941 B17R2.5669 CC(C)CCOc1ccc2ccccc2c1 34a_100000185828_100000210312 [0,1,0,1,0,0|2,0,0]=4 2942 B17R2.5669 CC(C)CCOc1ccc2ccccc2c1 7a_100000185828_100000210626 [0,1,0,1,0,0|2,0,0]=4 2943 B17R2.5669 CC(C)CCOc1cnc2ccccc2c1 34a_100011934006_100000210312 [0,1,0,1,0,0|2,0,0]=4 2944 B17R2.5669 CC(C)CCOc1cnc2ccccc2c1 7a_100011934006_100000210626 [0,1,0,1,0,0|2,0,0]=4 2945 B17R2.5669 CC(C)CCSc1ccc2ccccc2c1 62a_100000210312_100000233703 [0,1,0,1,0,0|2,0,0]=4 2946 B17R2.5669 CC(C)CCSc1cnc2ccccc2c1 62a_100000210312_100000737414 [0,1,0,1,0,0|2,0,0]=4 2947 B17R2.5669 CC(C)CNCc1ccc2ccccc2c1 207a_100000210953_100000211584 [0,1,0,1,0,0|2,0,0]=4 2948 B17R2.5669 CC(C)CNCc1ccc2ccccc2c1 2230a_100000210953_100011216711 [0,1,0,1,0,0|2,0,0]=4 2949 B17R2.5669 CC(C)CNCc1ccc2ccccc2c1 2230a_100000739491_100000210760 [0,1,0,1,0,0|2,0,0]=4 2950 B17R2.5669 CC(C)CNCc1ccc2ccccc2c1 270004a_100000210953_100000211584 [0,1,0,1,0,0|2,0,0]=4 2951 B17R2.5669 CC(C)CNCc1ccc2ccccc2c1 270004a_100000739491_100000210432 [0,1,0,1,0,0|2,0,0]=4 2952 B17R2.5669 CC(C)CNCc1ccc2ccccc2c1 34a_100000210953_100011216711 [0,1,0,1,0,0|2,0,0]=4 2953 B17R2.5669 CC(C)CNCc1ccc2ccccc2c1 34a_100000739491_100000210624 [0,1,0,1,0,0|2,0,0]=4 2954 B17R2.5669 CC(C)CNCc1cnc2ccccc2c1 207a_100000210953_100000750898 [0,1,0,1,0,0|2,0,0]=4 2955 B17R2.5669 CC(C)CNCc1cnc2ccccc2c1 270004a_100000210953_100000750898 [0,1,0,1,0,0|2,0,0]=4 2956 B17R2.5669 CC(C)CNCc1cnc2ccccc2c1 270004a_100000742225_100000210432 [0,1,0,1,0,0|2,0,0]=4 2957 B17R2.5669 CC(C)CNCc1cnc2ccccc2c1 34a_100000742225_100000210624 [0,1,0,1,0,0|2,0,0]=4 2958 B17R2.5669 CC(C)COCc1ccc2ccccc2c1 34a_100000210257_100011216711 [0,1,0,1,0,0|2,0,0]=4 2959 B17R2.5669 CC(C)COCc1ccc2ccccc2c1 34a_100011215330_100000210624 [0,1,0,1,0,0|2,0,0]=4 2960 B17R2.5669 CC(C)COCc1ccc2ccccc2c1 7a_100011215330_100000210760 [0,1,0,1,0,0|2,0,0]=4 2961 B17R2.5669 CC(C)COCc1cnc2ccccc2c1 34a_100011258773_100000210624 [0,1,0,1,0,0|2,0,0]=4 2962 B17R2.5669 CC(C)CSCc1ccc2ccccc2c1 62a_100000210624_100011216711 [0,1,0,1,0,0|2,0,0]=4 2963 B17R2.5669 CC(C)CSCc1ccc2ccccc2c1 62a_100011216711_100000210760 [0,1,0,1,0,0|2,0,0]=4 2964 B17R2.5669 CC(C)NCCc1ccc2ccccc2c1 2230a_100000746582_100000210206 [0,1,0,1,0,0|2,0,0]=4 2965 B17R2.5669 CC(C)NCCc1ccc2ccccc2c1 34a_100000746582_100000210206 [0,1,0,1,0,0|2,0,0]=4 2966 B17R2.5669 CC(C)OCCc1ccc2ccccc2c1 34a_100000755654_100000210206 [0,1,0,1,0,0|2,0,0]=4 2967 B17R2.5669 CC(C)OCCc1ccc2ccccc2c1 7a_100000755654_100000210206 [0,1,0,1,0,0|2,0,0]=4 2968 B17R2.5669 CC(F)COCc1ccc2ccccc2c1 34a_100015925927_100011216711 [0,1,0,1,0,0|2,0,0]=4 2969 B17R2.5669 CC(O)CCNc1ccc2ccccc2c1 34a_100000211940_100012276601 [0,1,0,1,0,0|2,0,0]=4 2970 B17R2.5669 CC(O)CCNc1ccc2ccccc2c1 7a_100000211940_100012276601 [0,1,0,1,0,0|2,0,0]=4 2971 B17R2.5669 CC(O)CCOc1ccc2ccccc2c1 34a_100000185828_100012276601 [0,1,0,1,0,0|2,0,0]=4 2972 B17R2.5669 CC(O)CCOc1ccc2ccccc2c1 7a_100000185828_100012276601 [0,1,0,1,0,0|2,0,0]=4 2973 B17R2.5669 CC(O)CCOc1cnc2ccccc2c1 34a_100011934006_100012276601 [0,1,0,1,0,0|2,0,0]=4 2974 B17R2.5669 CC(O)CCOc1cnc2ccccc2c1 7a_100011934006_100012276601 [0,1,0,1,0,0|2,0,0]=4 2975 B17R2.5669 CC(O)CCSc1ccc2ccccc2c1 62a_100012276601_100000233703 [0,1,0,1,0,0|2,0,0]=4 2976 B17R2.5669 CC(O)CCSc1cnc2ccccc2c1 62a_100012276601_100000737414 [0,1,0,1,0,0|2,0,0]=4 2977 B17R2.5669 CC(O)CNCc1ccc2ccccc2c1 207a_100000210904_100000211584 [0,1,0,1,0,0|2,0,0]=4 2978 B17R2.5669 CC(O)CNCc1ccc2ccccc2c1 2230a_100000210904_100011216711 [0,1,0,1,0,0|2,0,0]=4 2979 B17R2.5669 CC(O)CNCc1ccc2ccccc2c1 2230a_100000739491_100011218427 [0,1,0,1,0,0|2,0,0]=4 2980 B17R2.5669 CC(O)CNCc1ccc2ccccc2c1 270004a_100000210904_100000211584 [0,1,0,1,0,0|2,0,0]=4 2981 B17R2.5669 CC(O)CNCc1ccc2ccccc2c1 34a_100000210904_100011216711 [0,1,0,1,0,0|2,0,0]=4 2982 B17R2.5669 CC(O)CNCc1ccc2ccccc2c1 34a_100000739491_100011218427 [0,1,0,1,0,0|2,0,0]=4 2983 B17R2.5669 CC(O)CNCc1cnc2ccccc2c1 207a_100000210904_100000750898 [0,1,0,1,0,0|2,0,0]=4 2984 B17R2.5669 CC(O)CNCc1cnc2ccccc2c1 270004a_100000210904_100000750898 [0,1,0,1,0,0|2,0,0]=4 2985 B17R2.5669 CC(O)CNCc1cnc2ccccc2c1 34a_100000742225_100011218427 [0,1,0,1,0,0|2,0,0]=4 2986 B17R2.5669 CC(O)COCc1ccc2ccccc2c1 34a_100011215330_100011218427 [0,1,0,1,0,0|2,0,0]=4 2987 B17R2.5669 CC(O)COCc1ccc2ccccc2c1 7a_100011215330_100011218427 [0,1,0,1,0,0|2,0,0]=4 2988 B17R2.5669 CC(O)COCc1cnc2ccccc2c1 34a_100011258773_100011218427 [0,1,0,1,0,0|2,0,0]=4 2989 B17R2.5669 CC(O)CSCc1ccc2ccccc2c1 62a_100011216711_100011218427 [0,1,0,1,0,0|2,0,0]=4 2990 B17R2.5669 CC(O)CSCc1ccc2ccccc2c1 62a_100011218427_100011216711 [0,1,0,1,0,0|2,0,0]=4 2991 B17R2.5669 C[C@@H](Cl)COCc1ccc2ccccc2c1 34a_100016084084_100011216711 [0,1,0,1,0,0|2,0,0]=4 2992 B17R2.5669 C[C@@H](N)COCc1ccc2ccccc2c1 34a_100000737577_100011216711 [0,1,0,1,0,0|2,0,0]=4 2993 B17R2.5669 C[C@@H](O)CNCc1ccc2ccccc2c1 2230a_100000739491_100009817552 [0,1,0,1,0,0|2,0,0]=4 2994 B17R2.5669 C[C@@H](O)CNCc1ccc2ccccc2c1 34a_100000739491_100009817552 [0,1,0,1,0,0|2,0,0]=4 2995 B17R2.5669 C[C@@H](O)CNCc1cnc2ccccc2c1 34a_100000742225_100009817552 [0,1,0,1,0,0|2,0,0]=4 2996 B17R2.5669 C[C@@H](O)COCc1ccc2ccccc2c1 34a_100011215330_100009817552 [0,1,0,1,0,0|2,0,0]=4 2997 B17R2.5669 C[C@@H](O)COCc1ccc2ccccc2c1 7a_100011215330_100009817552 [0,1,0,1,0,0|2,0,0]=4 2998 B17R2.5669 C[C@@H](O)COCc1cnc2ccccc2c1 34a_100011258773_100009817552 [0,1,0,1,0,0|2,0,0]=4 2999 B17R2.5669 C[C@@H](O)CSCc1ccc2ccccc2c1 62a_100009817552_100011216711 [0,1,0,1,0,0|2,0,0]=4 3000 B17R2.5669 C[C@@H](O)CSCc1ccc2ccccc2c1 62a_100011216711_100009817552 [0,1,0,1,0,0|2,0,0]=4 3001 B17R2.5669 [13CH3]C(=O)CCCc1ccc2ccccc2c1 1458a_100000697136_200025704644 [0,1,0,1,0,0|1,0,1]=4 3002 B17R2.2023 CCCCNc1ccc2cccc(c2c1)O 34a_100132313934_100000210210 [0,1,0,1,0,0|2,0,0]=4 3003 B17R2.2023 CCCCOc1ccc2cccc(c2c1)Br 34a_100010169565_100000210210 [0,1,0,1,0,0|2,0,0]=4 3004 B17R2.2023 CCCCOc1ccc2cccc(c2c1)Br 7a_100010169565_100000210211 [0,1,0,1,0,0|2,0,0]=4 3005 B17R2.2023 CCCCOc1ccc2cccc(c2c1)C 34a_200000091600_100000210210 [0,1,0,1,0,0|2,0,0]=4 3006 B17R2.2023 CCCCOc1ccc2cccc(c2c1)C 7a_200000091600_100000210211 [0,1,0,1,0,0|2,0,0]=4 3007 B17R2.2023 CCCCOc1ccc2cccc(c2c1)F 34a_100000091619_100000210210 [0,1,0,1,0,0|2,0,0]=4 3008 B17R2.2023 CCCCOc1ccc2cccc(c2c1)F 7a_100000091619_100000210211 [0,1,0,1,0,0|2,0,0]=4 3009 B17R2.2023 CCCCOc1ccc2cccc(c2c1)N 34a_100000034012_100000210210 [0,1,0,1,0,0|2,0,0]=4 3010 B17R2.2023 CCCCOc1ccc2cccc(c2c1)N 7a_100000034012_100000210211 [0,1,0,1,0,0|2,0,0]=4 3011 B17R2.2023 CCCCSc1ccc2cccc(c2c1)N 62a_100000210211_100010090012 [0,1,0,1,0,0|2,0,0]=4 3012 B17R2.2023 CCCCSc1ccc2cccc(c2c1)N 62a_100010090012_100000210210 [0,1,0,1,0,0|2,0,0]=4 3013 B17R2.2023 CCCCSc1ccc2cccc(c2c1)O 62a_100000210211_100010089991 [0,1,0,1,0,0|2,0,0]=4 3014 B17R2.2023 CCCCSc1cnc2cccc(c2c1)N 62a_100000210211_100010264086 [0,1,0,1,0,0|2,0,0]=4 3015 B17R2.2023 CCCCSc1cnc2cccc(c2c1)N 62a_100010264086_100000210210 [0,1,0,1,0,0|2,0,0]=4 3016 B17R2.2023 CCCCSc1cnc2cccc(c2c1)O 62a_100000210211_200010153752 [0,1,0,1,0,0|2,0,0]=4 3017 B17R2.5000 Cc1ccccc1OC2CCCCCC2=O 7a_100000210338_100000243696 [0,1,0,1,0,0|1,0,1]=4 3018 B17R2.5000 Cc1ccccc1SC2CCCCCC2=O 62a_100000210755_100000243696 [0,1,0,1,0,0|1,0,1]=4 3019 B17R2.5000 Cc1ccccc1SC2CCCCCC2=O 62a_100000243696_100000210755 [0,1,0,1,0,0|1,0,1]=4 3020 B17R2.5000 Nc1ccccc1OC2CCCCCC2=O 7a_100000185747_100000243696 [0,1,0,1,0,0|1,0,1]=4 3021 B17R2.5000 Nc1ccccc1SC2CCCCCC2=O 62a_100000210017_100000243696 [0,1,0,1,0,0|1,0,1]=4 3022 B17R2.5000 Nc1ccccc1SC2CCCCCC2=O 62a_100000243696_100000210017 [0,1,0,1,0,0|1,0,1]=4 3023 B17R2.5000 O=C1CCCCCC1Oc2ccccc2Br 7a_100000181306_100000243696 [0,1,0,1,0,0|1,0,1]=4 3024 B17R2.5000 O=C1CCCCCC1Oc2ccccc2Cl 7a_100000210172_100000243696 [0,1,0,1,0,0|1,0,1]=4 3025 B17R2.5000 O=C1CCCCCC1Oc2ccccc2F 7a_100000210171_100000243696 [0,1,0,1,0,0|1,0,1]=4 3026 B17R2.5000 O=C1CCCCCC1Oc2ccccc2I 7a_100000739446_100000243696 [0,1,0,1,0,0|1,0,1]=4 3027 B17R2.5000 O=C1CCCCCC1Sc2ccccc2Br 62a_100000243696_100000695589 [0,1,0,1,0,0|1,0,1]=4 3028 B17R2.5000 O=C1CCCCCC1Sc2ccccc2Br 62a_100000695589_100000243696 [0,1,0,1,0,0|1,0,1]=4 3029 B17R2.5000 O=C1CCCCCC1Sc2ccccc2Cl 62a_100000243696_100000764095 [0,1,0,1,0,0|1,0,1]=4 3030 B17R2.5000 O=C1CCCCCC1Sc2ccccc2Cl 62a_100000764095_100000243696 [0,1,0,1,0,0|1,0,1]=4 3031 B17R2.5000 O=C1CCCCCC1Sc2ccccc2F 62a_100000243696_100011215700 [0,1,0,1,0,0|1,0,1]=4 3032 B17R2.5000 O=C1CCCCCC1Sc2ccccc2F 62a_100011215700_100000243696 [0,1,0,1,0,0|1,0,1]=4 3033 B17R2.5000 O=C1CCCCCC1Sc2ccccc2O 62a_100000243696_100000739446 [0,1,0,1,0,0|1,0,1]=4 3034 B17R2.5000 O=C1CCCCCC1Sc2ccccc2O 62a_100000739446_100000243696 [0,1,0,1,0,0|1,0,1]=4 3035 B17R2.556 CCC(=O)CCc1ccc2ccccc2c1 1458a_100000743016_100000210202 [0,1,0,1,0,0|1,0,1]=4 3036 B17R2.556 CCC(C)CNc1ccc2ccccc2c1 34a_100000211940_100000748023 [0,1,0,1,0,0|2,0,0]=4 3037 B17R2.556 CCC(C)CNc1ccc2ccccc2c1 7a_100000211940_100000748023 [0,1,0,1,0,0|2,0,0]=4 3038 B17R2.556 CCC(C)COc1ccc2ccccc2c1 34a_100000185828_100000748023 [0,1,0,1,0,0|2,0,0]=4 3039 B17R2.556 CCC(C)COc1ccc2ccccc2c1 7a_100000185828_100000748023 [0,1,0,1,0,0|2,0,0]=4 3040 B17R2.556 CCC(C)COc1cnc2ccccc2c1 34a_100011934006_100000748023 [0,1,0,1,0,0|2,0,0]=4 3041 B17R2.556 CCC(C)COc1cnc2ccccc2c1 7a_100011934006_100000748023 [0,1,0,1,0,0|2,0,0]=4 3042 B17R2.556 CCC(C)CSc1ccc2ccccc2c1 62a_100000748023_100000233703 [0,1,0,1,0,0|2,0,0]=4 3043 B17R2.556 CCC(C)CSc1cnc2ccccc2c1 62a_100000748023_100000737414 [0,1,0,1,0,0|2,0,0]=4 3044 B17R2.556 CCC(C)NCc1ccc2ccccc2c1 207a_100000209981_100000211584 [0,1,0,1,0,0|2,0,0]=4 3045 B17R2.556 CCC(C)NCc1ccc2ccccc2c1 2230a_100000209981_100011216711 [0,1,0,1,0,0|2,0,0]=4 3046 B17R2.556 CCC(C)NCc1ccc2ccccc2c1 2230a_100000739491_100000758301 [0,1,0,1,0,0|2,0,0]=4 3047 B17R2.556 CCC(C)NCc1ccc2ccccc2c1 270004a_100000209981_100000211584 [0,1,0,1,0,0|2,0,0]=4 3048 B17R2.556 CCC(C)NCc1ccc2ccccc2c1 34a_100000739491_100011215416 [0,1,0,1,0,0|2,0,0]=4 3049 B17R2.556 CCC(C)NCc1cnc2ccccc2c1 207a_100000209981_100000750898 [0,1,0,1,0,0|2,0,0]=4 3050 B17R2.556 CCC(C)NCc1cnc2ccccc2c1 270004a_100000209981_100000750898 [0,1,0,1,0,0|2,0,0]=4 3051 B17R2.556 CCC(C)NCc1cnc2ccccc2c1 34a_100000742225_100011215416 [0,1,0,1,0,0|2,0,0]=4 3052 B17R2.556 CCC(C)OCc1ccc2ccccc2c1 34a_100011215330_100011215416 [0,1,0,1,0,0|2,0,0]=4 3053 B17R2.556 CCC(C)OCc1ccc2ccccc2c1 7a_100000210228_100011216711 [0,1,0,1,0,0|2,0,0]=4 3054 B17R2.556 CCC(C)OCc1ccc2ccccc2c1 7a_100011215330_100000758301 [0,1,0,1,0,0|2,0,0]=4 3055 B17R2.556 CCC(C)OCc1cnc2ccccc2c1 34a_100011258773_100011215416 [0,1,0,1,0,0|2,0,0]=4 3056 B17R2.556 CCC(C)SCc1ccc2ccccc2c1 62a_100000758301_100011216711 [0,1,0,1,0,0|2,0,0]=4 3057 B17R2.556 CCC(C)SCc1ccc2ccccc2c1 62a_100011216711_100000758301 [0,1,0,1,0,0|2,0,0]=4 3058 B17R2.556 CCC(O)CNc1ccc2ccccc2c1 34a_100000211940_100011218378 [0,1,0,1,0,0|2,0,0]=4 3059 B17R2.556 CCC(O)CNc1ccc2ccccc2c1 7a_100000211940_100011218378 [0,1,0,1,0,0|2,0,0]=4 3060 B17R2.556 CCC(O)COc1ccc2ccccc2c1 34a_100000185828_100011218378 [0,1,0,1,0,0|2,0,0]=4 3061 B17R2.556 CCC(O)COc1ccc2ccccc2c1 7a_100000185828_100011218378 [0,1,0,1,0,0|2,0,0]=4 3062 B17R2.556 CCC(O)COc1cnc2ccccc2c1 34a_100011934006_100011218378 [0,1,0,1,0,0|2,0,0]=4 3063 B17R2.556 CCC(O)COc1cnc2ccccc2c1 7a_100011934006_100011218378 [0,1,0,1,0,0|2,0,0]=4 3064 B17R2.556 CCC(O)CSc1ccc2ccccc2c1 62a_100011218378_100000233703 [0,1,0,1,0,0|2,0,0]=4 3065 B17R2.556 CCC(O)CSc1cnc2ccccc2c1 62a_100011218378_100000737414 [0,1,0,1,0,0|2,0,0]=4 3066 B17R2.556 CC[C@H](C)CNc1ccc2ccccc2c1 34a_100000211940_100009816398 [0,1,0,1,0,0|2,0,0]=4 3067 B17R2.556 CC[C@H](C)CNc1ccc2ccccc2c1 7a_100000211940_100009816398 [0,1,0,1,0,0|2,0,0]=4 3068 B17R2.556 CC[C@H](C)COc1ccc2ccccc2c1 34a_100000185828_100009816398 [0,1,0,1,0,0|2,0,0]=4 3069 B17R2.556 CC[C@H](C)COc1ccc2ccccc2c1 7a_100000185828_100009816398 [0,1,0,1,0,0|2,0,0]=4 3070 B17R2.556 CC[C@H](C)COc1cnc2ccccc2c1 34a_100011934006_100009816398 [0,1,0,1,0,0|2,0,0]=4 3071 B17R2.556 CC[C@H](C)COc1cnc2ccccc2c1 7a_100011934006_100009816398 [0,1,0,1,0,0|2,0,0]=4 3072 B17R2.556 CC[C@H](C)CSc1ccc2ccccc2c1 62a_100009816398_100000233703 [0,1,0,1,0,0|2,0,0]=4 3073 B17R2.556 CC[C@H](C)CSc1cnc2ccccc2c1 62a_100009816398_100000737414 [0,1,0,1,0,0|2,0,0]=4 3074 B17R3.1861 O=C1C([C@@H]2CC[C@H]1C2)Sc3ccccc3 62a_100000719477_200015607011 [0,0,0,2,0,0|1,0,1]=4 3075 B17R3.1861 O=C1C([C@@H]2CC[C@H]1C2)Sc3ccccc3 62a_200015607011_100000041952 [0,0,0,2,0,0|1,0,1]=4 3076 B17R3.648661 c1ccc2cc(ccc2c1)CNC3CC3 34a_100000212008_100011216711 [0,0,0,2,0,0|2,0,0]=4 3077 B17R3.648661 c1ccc2cc(ccc2c1)CNC3CC3 34a_100000739491_100000211595 [0,0,0,2,0,0|2,0,0]=4 3078 B17R3.648661 c1ccc2cc(ccc2c1)COC3CC3 34a_100011215330_100000211595 [0,0,0,2,0,0|2,0,0]=4 3079 B17R3.648661 c1ccc2cc(ccc2c1)CSC3CC3 62a_100011216711_100000211595 [0,0,0,2,0,0|2,0,0]=4 3080 B17R3.648661 c1ccc2cc(ccc2c1)NCC3CC3 34a_100000211940_100000742324 [0,0,0,2,0,0|2,0,0]=4 3081 B17R3.648661 c1ccc2cc(ccc2c1)NCC3CC3 7a_100000211940_100000742324 [0,0,0,2,0,0|2,0,0]=4 3082 B17R3.648661 c1ccc2cc(ccc2c1)OCC3CC3 34a_100000185828_100000742324 [0,0,0,2,0,0|2,0,0]=4 3083 B17R3.648661 c1ccc2cc(ccc2c1)OCC3CC3 7a_100000185828_100000742324 [0,0,0,2,0,0|2,0,0]=4 3084 B17R3.648661 c1ccc2cc(ccc2c1)SCC3CC3 62a_100000756562_100000233703 [0,0,0,2,0,0|2,0,0]=4 3085 B17R3.648661 c1ccc2ncc(cc2c1)CNC3CC3 34a_100000742225_100000211595 [0,0,0,2,0,0|2,0,0]=4 3086 B17R3.648661 c1ccc2ncc(cc2c1)COC3CC3 34a_100011258773_100000211595 [0,0,0,2,0,0|2,0,0]=4 3087 B17R3.648661 c1ccc2ncc(cc2c1)OCC3CC3 34a_100011934006_100000742324 [0,0,0,2,0,0|2,0,0]=4 3088 B17R3.648661 c1ccc2ncc(cc2c1)OCC3CC3 7a_100011934006_100000742324 [0,0,0,2,0,0|2,0,0]=4 3089 B17R3.648661 c1ccc2ncc(cc2c1)SCC3CC3 62a_100000756562_100000737414 [0,0,0,2,0,0|2,0,0]=4 3090 B17R3.123564 c1ccc2cc(ccc2c1)CN3CCC3 269982a_100000754969_100011216711 [0,0,0,2,0,0|2,0,0]=4 3091 B17R3.123564 c1ccc2cc(ccc2c1)NC3CCC3 34a_100000211940_100000749161 [0,0,0,2,0,0|2,0,0]=4 3092 B17R3.123564 c1ccc2cc(ccc2c1)OC3CCC3 34a_100000185828_100000749161 [0,0,0,2,0,0|2,0,0]=4 3093 B17R3.123564 c1ccc2ncc(cc2c1)OC3CCC3 34a_100011934006_100000749161 [0,0,0,2,0,0|2,0,0]=4 3094 B13R1.24 C#CCCCC(=O)c1ccccc1 1458a_100000185807_100000731252 [1,0,0,0,1,0|0,0,2]=4 3095 B13R1.24 C=CCCCC(=O)c1ccccc1 1458a_100000185807_100000757094 [1,0,0,0,1,0|0,0,2]=4 3096 B13R1.24 CC/C=C\CC(=O)c1ccccc1 1458a_100000185807_100103147603 [1,0,0,0,1,0|0,0,2]=4 3097 B13R1.24 CCC#CCC(=O)c1ccccc1 1458a_100000185807_100009813939 [1,0,0,0,1,0|0,0,2]=4 3098 B13R1.24 CCCCCC(=O)c1ccccc1 1458a_100000185807_100000210326 [1,0,0,0,1,0|0,0,0]=2 3099 B13R1.24 CCCCCN(C)c1ccccc1 2230a_100000210012_100000210326 [1,0,0,0,1,0|1,0,1]=4 3100 B13R1.24 CCCCCN(C)c1ccccc1 2230a_200000219563_200000210301 [1,0,0,0,1,0|1,0,1]=4 3101 B13R1.24 CCCCCN(C)c1ccccc1 269982a_100000210012_100000210215 [1,0,0,0,1,0|1,0,1]=4 3102 B13R1.24 CCCCCN(C)c1ccccc1 269982a_200000219563_200000210301 [1,0,0,0,1,0|1,0,1]=4 3103 B13R1.24 CCCCCN(C)c1ccccc1 34a_100000210012_100000718602 [1,0,0,0,1,0|1,0,1]=4 3104 B13R1.24 CCCCCN(C)c1ccccc1 34a_200000219563_200000210301 [1,0,0,0,1,0|1,0,1]=4 3105 B13R1.24 CCCCCN(C)c1ccccc1 7a_200000219563_200000210301 [1,0,0,0,1,0|1,0,1]=4 3106 B13R1.24 CCCCCN([13CH3])c1ccccc1 2230a_200000219563_200025704644 [1,0,0,0,1,0|1,0,1]=4 3107 B13R1.24 CCCCCN([13CH3])c1ccccc1 269982a_200000219563_200025704644 [1,0,0,0,1,0|1,0,1]=4 3108 B13R1.24 CCCCCN([13CH3])c1ccccc1 34a_200000219563_200025704644 [1,0,0,0,1,0|1,0,1]=4 3109 B13R1.24 CCCCCN([13CH3])c1ccccc1 7a_200000219563_200025704644 [1,0,0,0,1,0|1,0,1]=4 3110 B13R1.24 CCCCNC(=O)c1ccccc1 11a_100000102301_100000185807 [1,0,0,0,1,0|1,0,0]=3 3111 B13R1.24 CCCCNC(=O)c1ccccc1 1626a_100000102301_100000185807 [1,0,0,0,1,0|1,0,0]=3 3112 B13R1.24 CCCCNC(=O)c1ccccc1 240690a_100000102301_100000185807 [1,0,0,0,1,0|1,0,0]=3 3113 B13R1.24 CCCCNC(=O)c1ccccc1 527a_100000102301_100000185807 [1,0,0,0,1,0|1,0,0]=3 3114 B13R1.24 CCCNNC(=O)c1ccccc1 22a_100000740057_100000185807 [1,0,0,0,1,0|2,0,0]=4 3115 B13R1.24 CCCOCC(=O)c1ccccn1 34a_100000210258_100000027445 [1,0,0,0,1,0|2,0,0]=4 3116 B13R1.24 CCCSCC(=O)c1ccccc1 62a_100000210303_100000211460 [1,0,0,0,1,0|1,0,0]=3 3117 B13R1.24 CCCSCC(=O)c1ccccc1 62a_100000211460_100000210303 [1,0,0,0,1,0|1,0,0]=3 3118 B13R1.24 CCCSCC(=O)c1ccccn1 62a_100000027445_100000210303 [1,0,0,0,1,0|2,0,0]=4 3119 B13R1.24 CCCSCC(=O)c1ccccn1 62a_100000210303_100000027445 [1,0,0,0,1,0|2,0,0]=4 3120 B13R1.24 CCCSCC(=O)c1cccnc1 62a_100000210303_100000757877 [1,0,0,0,1,0|2,0,0]=4 3121 B13R1.24 CCCSCC(=O)c1cccnc1 62a_100000757877_100000210303 [1,0,0,0,1,0|2,0,0]=4 3122 B13R1.24 CCCSCC(=O)c1ccncc1 62a_100000027454_100000210303 [1,0,0,0,1,0|2,0,0]=4 3123 B13R1.24 CCCSCC(=O)c1ccncc1 62a_100000210303_100000027454 [1,0,0,0,1,0|2,0,0]=4 3124 B13R1.24 CCCSCS(=O)c1ccccc1 62a_100000210303_100000031784 [1,0,0,0,1,0|2,0,0]=4 3125 B13R1.24 CCNCCC(=O)c1ccccc1 2230a_100015525214_100000750707 [1,0,0,0,1,0|1,0,0]=3 3126 B13R1.24 CCNCCS(=O)c1ccccc1 2230a_100015525214_100000740319 [1,0,0,0,1,0|2,0,0]=4 3127 B13R1.24 CCOCCC(=O)c1ccccc1 1458a_100000185807_100011215890 [1,0,0,0,1,0|1,0,0]=3 3128 B13R1.24 CCSCCC(=O)c1ccccc1 1458a_100000185807_100000757381 [1,0,0,0,1,0|1,0,0]=3 3129 B13R1.24 CCSCCC(=O)c1ccccc1 62a_100000210202_100000750707 [1,0,0,0,1,0|1,0,0]=3 3130 B13R1.24 CCSCCC(=O)c1ccccc1 62a_100000750707_100000210202 [1,0,0,0,1,0|1,0,0]=3 3131 B13R1.24 CCSCCS(=O)c1ccccc1 62a_100000210202_100000740319 [1,0,0,0,1,0|2,0,0]=4 3132 B13R1.24 CCSCOC(=O)c1ccccc1 62a_100000073877_100000210202 [1,0,0,0,1,0|2,0,0]=4 3133 B13R1.24 CCSCOC(=O)c1ccccc1 62a_100000210202_100000073877 [1,0,0,0,1,0|2,0,0]=4 3134 B13R1.24 CNCCCC(=O)c1ccccc1 2230a_106832991635_100000211006 [1,0,0,0,1,0|1,0,0]=3 3135 B13R1.24 CNCCCC(=O)c1ccccc1 7a_106832991635_100000211006 [1,0,0,0,1,0|1,0,0]=3 3136 B13R1.24 CNCCNC(=O)c1ccccc1 2230a_100000736134_200000210301 [1,0,0,0,1,0|2,0,0]=4 3137 B13R1.24 CNCCNC(=O)c1ccccc1 7a_106832991635_200011215302 [1,0,0,0,1,0|2,0,0]=4 3138 B13R1.24 CNCCOC(=O)c1ccccc1 34a_100102657272_100009812718 [1,0,0,0,1,0|2,0,0]=4 3139 B13R1.24 CNCCOC(=O)c1ccccc1 7a_106832991635_100000184176 [1,0,0,0,1,0|2,0,0]=4 3140 B13R1.24 COCCCC(=O)c1ccccc1 1458a_100000185807_100000740836 [1,0,0,0,1,0|1,0,0]=3 3141 B13R1.24 COCCNC(=O)c1ccccc1 1626a_100000209980_100000185807 [1,0,0,0,1,0|2,0,0]=4 3142 B13R1.24 COCCNC(=O)c1ccccc1 240690a_100000209980_100000185807 [1,0,0,0,1,0|2,0,0]=4 3143 B13R1.24 COCCNC(=O)c1ccccc1 34a_200000158897_200000210301 [1,0,0,0,1,0|2,0,0]=4 3144 B13R1.24 COCCNC(=O)c1ccccc1 527a_100000209980_100000185807 [1,0,0,0,1,0|2,0,0]=4 3145 B13R1.24 COCCNC(=O)c1ccccc1 7a_200000158897_200000210301 [1,0,0,0,1,0|2,0,0]=4 3146 B13R1.24 COCCOC(=O)c1ccccc1 34a_100138415774_100009812718 [1,0,0,0,1,0|2,0,0]=4 3147 B13R1.24 COCCOC(=O)c1ccccc1 7a_100000025465_200000210301 [1,0,0,0,1,0|2,0,0]=4 3148 B13R1.24 COCSCC(=O)c1ccccc1 62a_100000211460_100000766300 [1,0,0,0,1,0|2,0,0]=4 3149 B13R1.24 COCSCC(=O)c1ccccc1 62a_100000766300_100000211460 [1,0,0,0,1,0|2,0,0]=4 3150 B13R1.24 CSCCCC(=O)c1ccccc1 62a_100000211006_200000210301 [1,0,0,0,1,0|1,0,0]=3 3151 B13R1.24 CSCCCC(=O)c1ccccc1 62a_200000210301_100000211006 [1,0,0,0,1,0|1,0,0]=3 3152 B13R1.24 CSCCNC(=O)c1ccccc1 11a_100020590264_100000185807 [1,0,0,0,1,0|2,0,0]=4 3153 B13R1.24 CSCCNC(=O)c1ccccc1 1626a_100020590264_100000185807 [1,0,0,0,1,0|2,0,0]=4 3154 B13R1.24 CSCCNC(=O)c1ccccc1 240690a_100020590264_100000185807 [1,0,0,0,1,0|2,0,0]=4 3155 B13R1.24 CSCCNC(=O)c1ccccc1 527a_100020590264_100000185807 [1,0,0,0,1,0|2,0,0]=4 3156 B13R1.24 CSCCNC(=O)c1ccccc1 62a_200000210301_200011215302 [1,0,0,0,1,0|2,0,0]=4 3157 B13R1.24 CSCCNC(=O)c1ccccc1 62a_200011215302_200000210301 [1,0,0,0,1,0|2,0,0]=4 3158 B13R1.24 CSCCOC(=O)c1ccccc1 62a_100009812718_200000210301 [1,0,0,0,1,0|2,0,0]=4 3159 B13R1.24 CSCCOC(=O)c1ccccc1 62a_200000210301_100009812718 [1,0,0,0,1,0|2,0,0]=4 3160 B13R1.24 CSCSCC(=O)c1ccccc1 62a_100000211460_100011218213 [1,0,0,0,1,0|2,0,0]=4 3161 B13R1.24 CSCSCC(=O)c1ccccc1 62a_100011218213_100000211460 [1,0,0,0,1,0|2,0,0]=4 3162 B13R1.24 N#CCCCC(=O)c1ccccc1 1458a_100000185807_100000211468 [1,0,0,0,1,0|1,0,1]=4 3163 B13R1.24 O=C(CCCCF)c1ccccc1 1458a_100000185807_100000729493 [1,0,0,0,1,0|1,0,0]=3 3164 B13R1.24 O=C(CCCCO)c1ccccc1 1458a_100000185807_100000210776 [1,0,0,0,1,0|1,0,0]=3 3165 B13R1.24 O=C(CCSCF)c1ccccc1 62a_100000750707_100015361967 [1,0,0,0,1,0|2,0,0]=4 3166 B13R1.24 O=C(CCSCF)c1ccccc1 62a_100015361967_100000750707 [1,0,0,0,1,0|2,0,0]=4 3167 B13R1.24 O=C(CSCCF)c1ccccc1 62a_100000211460_100011217306 [1,0,0,0,1,0|2,0,0]=4 3168 B13R1.24 O=C(CSCCF)c1ccccc1 62a_100011217306_100000211460 [1,0,0,0,1,0|2,0,0]=4 3169 B13R1.24 O=C(CSCCO)c1ccccc1 62a_100000211460_100000211926 [1,0,0,0,1,0|2,0,0]=4 3170 B13R1.24 O=C(CSCCO)c1ccccc1 62a_100000211926_100000211460 [1,0,0,0,1,0|2,0,0]=4 3171 B13R1.24 O=C(NCCCF)c1ccccc1 11a_100015189416_100000185807 [1,0,0,0,1,0|2,0,0]=4 3172 B13R1.24 O=C(NCCCF)c1ccccc1 1626a_100015189416_100000185807 [1,0,0,0,1,0|2,0,0]=4 3173 B13R1.24 O=C(NCCCF)c1ccccc1 240690a_100015189416_100000185807 [1,0,0,0,1,0|2,0,0]=4 3174 B13R1.24 O=C(NCCCF)c1ccccc1 527a_100015189416_100000185807 [1,0,0,0,1,0|2,0,0]=4 3175 B13R1.24 O=C(NCCCO)c1ccccc1 240690a_100000182051_100000185807 [1,0,0,0,1,0|2,0,0]=4 3176 B13R1.24 O=C(NCCCO)c1ccccc1 527a_100000182051_100000185807 [1,0,0,0,1,0|2,0,0]=4 3177 B13R1.24 [13CH3]NCCNC(=O)c1ccccc1 2230a_100000736134_200025704644 [1,0,0,0,1,0|2,0,0]=4 3178 B13R1.24 [13CH3]OCCNC(=O)c1ccccc1 34a_200000158897_200025704644 [1,0,0,0,1,0|2,0,0]=4 3179 B13R1.24 [13CH3]OCCNC(=O)c1ccccc1 7a_200000158897_200025704644 [1,0,0,0,1,0|2,0,0]=4 3180 B13R1.24 [13CH3]OCCOC(=O)c1ccccc1 7a_100000025465_200025704644 [1,0,0,0,1,0|2,0,0]=4 3181 B13R1.24 [13CH3]SCCCC(=O)c1ccccc1 62a_100000211006_200025704644 [1,0,0,0,1,0|1,0,0]=3 3182 B13R1.24 [13CH3]SCCCC(=O)c1ccccc1 62a_200025704644_100000211006 [1,0,0,0,1,0|1,0,0]=3 3183 B13R1.24 [13CH3]SCCNC(=O)c1ccccc1 62a_200011215302_200025704644 [1,0,0,0,1,0|2,0,0]=4 3184 B13R1.24 [13CH3]SCCNC(=O)c1ccccc1 62a_200025704644_200011215302 [1,0,0,0,1,0|2,0,0]=4 3185 B13R1.24 [13CH3]SCCOC(=O)c1ccccc1 62a_100009812718_200025704644 [1,0,0,0,1,0|2,0,0]=4 3186 B13R1.24 [13CH3]SCCOC(=O)c1ccccc1 62a_200025704644_100009812718 [1,0,0,0,1,0|2,0,0]=4 3187 B13R1.156 CCCCCC(=O)Cc1ccc[nH]1 1458a_100000238377_100000210326 [1,0,0,0,1,0|1,0,1]=4 3188 B13R1.156 CCCCCC(=O)Cc1ccco1 1458a_100011217309_100000210326 [1,0,0,0,1,0|1,0,1]=4 3189 B13R1.156 CCCCCC(=O)Cc1cccs1 1458a_100000210189_100000210326 [1,0,0,0,1,0|1,0,1]=4 3190 B13R1.156 CCCCCC(=O)Cc1ccoc1 1458a_100000684892_100000210326 [1,0,0,0,1,0|1,0,1]=4 3191 B13R1.156 CCCCCC(=O)Cc1ccsc1 1458a_100000184062_100000210326 [1,0,0,0,1,0|1,0,1]=4 3192 B13R1.156 CCCCCC(=O)Cc1ccsc1 1458a_100000212188_100011233845 [1,0,0,0,1,0|1,0,1]=4 3193 B13R1.156 CCCCCC(=O)Cn1cccc1 1458a_100011196272_100000210326 [1,0,0,0,1,0|1,0,1]=4 3194 B15R1.78 C#CCCCC(=O)C=Cc1ccccc1 1458a_100000210462_100000731252 [1,0,0,0,0,1|0,0,2]=4 3195 B15R1.78 C=CCCCC(=O)C=Cc1ccccc1 1458a_100000210462_100000757094 [1,0,0,0,0,1|0,0,2]=4 3196 B15R1.78 CC/C=C\CC(=O)C=Cc1ccccc1 1458a_100000210462_100103147603 [1,0,0,0,0,1|0,0,2]=4 3197 B15R1.78 CCC#CCC(=O)C=Cc1ccccc1 1458a_100000210462_100009813939 [1,0,0,0,0,1|0,0,2]=4 3198 B15R1.78 CCCCCC(=NNc1ccccc1)C 4a_100015195140_100000211708 [1,0,0,0,0,1|1,0,1]=4 3199 B15R1.78 CCCCCC(=O)C#Cc1ccccc1 1458a_100000736102_100000210326 [1,0,0,0,0,1|0,0,1]=3 3200 B15R1.78 CCCCCC(=O)C#Cc1ccccn1 1458a_102125277312_100000210326 [1,0,0,0,0,1|1,0,1]=4 3201 B15R1.78 CCCCCC(=O)C=Cc1ccccc1 1458a_100000210462_100000210326 [1,0,0,0,0,1|0,0,0]=2 3202 B15R1.78 CCCCCC(=O)C=Cc1ccccn1 1458a_100000740811_100000210326 [1,0,0,0,0,1|1,0,0]=3 3203 B15R1.78 CCCCCC(=O)C=Cc1cccnc1 1458a_100000735890_100000210326 [1,0,0,0,0,1|1,0,0]=3 3204 B15R1.78 CCCCCC(=O)C=Cc1ccncc1 1458a_100000682801_100000210326 [1,0,0,0,0,1|1,0,0]=3 3205 B15R1.78 CCCCCC(=O)C=Cc1cncnc1 6a_100000749868_100011215151 [1,0,0,0,0,1|2,0,0]=4 3206 B15R1.78 CCCCCC(=O)CCc1ccccc1 1458a_100000185753_100000210326 [1,0,0,0,0,1|0,0,1]=3 3207 B15R1.78 CCCCCC(=O)CCc1ccccc1 1458a_100000212188_100000765856 [1,0,0,0,0,1|0,0,1]=3 3208 B15R1.78 CCCCCC(=O)CCc1ccccn1 1458a_100000212188_100015183660 [1,0,0,0,0,1|1,0,1]=4 3209 B15R1.78 CCCCCC(=O)CCc1ccccn1 1458a_100015195070_100000210326 [1,0,0,0,0,1|1,0,1]=4 3210 B15R1.78 CCCCCC(=O)CCc1cccnc1 1458a_100000198484_100000210326 [1,0,0,0,0,1|1,0,1]=4 3211 B15R1.78 CCCCCC(=O)CCc1cccnc1 1458a_100000212188_200011713674 [1,0,0,0,0,1|1,0,1]=4 3212 B15R1.78 CCCCCC(=O)CCc1ccncc1 1458a_100000212188_100000723409 [1,0,0,0,0,1|1,0,1]=4 3213 B15R1.78 CCCCCC(=O)CCc1ccncc1 1458a_100011225043_100000210326 [1,0,0,0,0,1|1,0,1]=4 3214 B15R1.78 CCCCCC(=O)CNc1ccccc1 34a_100000106764_200012276598 [1,0,0,0,0,1|0,0,1]=3 3215 B15R1.78 CCCCCC(=O)COc1ccccc1 1458a_100000186222_100000210326 [1,0,0,0,0,1|0,0,1]=3 3216 B15R1.78 CCCCCC(=O)COc1ccccc1 34a_100000210340_200012276598 [1,0,0,0,0,1|0,0,1]=3 3217 B15R1.78 CCCCCC(=O)COc1ccccc1 7a_100000210340_200012276598 [1,0,0,0,0,1|0,0,1]=3 3218 B15R1.78 CCCCCC(=O)COc1ccccn1 1458a_100102699861_100000210326 [1,0,0,0,0,1|1,0,1]=4 3219 B15R1.78 CCCCCC(=O)COc1cccnc1 1458a_100015207166_100000210326 [1,0,0,0,0,1|1,0,1]=4 3220 B15R1.78 CCCCCC(=O)COc1cccnc1 34a_100000210849_200012276598 [1,0,0,0,0,1|1,0,1]=4 3221 B15R1.78 CCCCCC(=O)COc1cccnc1 7a_100000210849_200012276598 [1,0,0,0,0,1|1,0,1]=4 3222 B15R1.78 CCCCCC(=O)COc1ccncc1 34a_100000212176_200012276598 [1,0,0,0,0,1|1,0,1]=4 3223 B15R1.78 CCCCCC(=O)CSc1ccccc1 1458a_100000211596_100000210326 [1,0,0,0,0,1|0,0,1]=3 3224 B15R1.78 CCCCCC(=O)CSc1ccccc1 62a_100000719477_200012276598 [1,0,0,0,0,1|0,0,1]=3 3225 B15R1.78 CCCCCC(=O)CSc1ccccc1 62a_200012276598_100000041952 [1,0,0,0,0,1|0,0,1]=3 3226 B15R1.78 CCCCCC(=O)CSc1ccccn1 1458a_100000156281_100000210326 [1,0,0,0,0,1|1,0,1]=4 3227 B15R1.78 CCCCCC(=O)CSc1ccccn1 62a_100011216584_200012276598 [1,0,0,0,0,1|1,0,1]=4 3228 B15R1.78 CCCCCC(=O)CSc1ccccn1 62a_200012276598_100011216584 [1,0,0,0,0,1|1,0,1]=4 3229 B15R1.78 CCCCCC(=O)CSc1cccnc1 62a_100000210063_200012276598 [1,0,0,0,0,1|1,0,1]=4 3230 B15R1.78 CCCCCC(=O)CSc1cccnc1 62a_200012276598_100000210063 [1,0,0,0,0,1|1,0,1]=4 3231 B15R1.78 CCCCCC(=O)CSc1ccncc1 1458a_100000211328_100000210326 [1,0,0,0,0,1|1,0,1]=4 3232 B15R1.78 CCCCCC(=O)CSc1ccncc1 62a_100000728582_200012276598 [1,0,0,0,0,1|1,0,1]=4 3233 B15R1.78 CCCCCC(=O)CSc1ccncc1 62a_200012276598_100000728582 [1,0,0,0,0,1|1,0,1]=4 3234 B15R1.78 CCCCCC(=O)NCc1ccccc1 11a_100015324214_100000212188 [1,0,0,0,0,1|0,0,1]=3 3235 B15R1.78 CCCCCC(=O)NCc1ccccc1 1626a_100015324214_100000212188 [1,0,0,0,0,1|0,0,1]=3 3236 B15R1.78 CCCCCC(=O)NCc1ccccc1 240690a_100015324214_100000212188 [1,0,0,0,0,1|0,0,1]=3 3237 B15R1.78 CCCCCC(=O)NCc1ccccc1 527a_100015324214_100000212188 [1,0,0,0,0,1|0,0,1]=3 3238 B15R1.78 CCCCCC(=O)NCc1ccccn1 11a_100000210449_100000212188 [1,0,0,0,0,1|1,0,1]=4 3239 B15R1.78 CCCCCC(=O)NCc1ccccn1 1626a_100000210449_100000212188 [1,0,0,0,0,1|1,0,1]=4 3240 B15R1.78 CCCCCC(=O)NCc1ccccn1 240690a_100000210449_100000212188 [1,0,0,0,0,1|1,0,1]=4 3241 B15R1.78 CCCCCC(=O)NCc1ccccn1 527a_100000210449_100000212188 [1,0,0,0,0,1|1,0,1]=4 3242 B15R1.78 CCCCCC(=O)NCc1cccnc1 11a_100000210453_100000212188 [1,0,0,0,0,1|1,0,1]=4 3243 B15R1.78 CCCCCC(=O)NCc1cccnc1 240690a_100000210453_100000212188 [1,0,0,0,0,1|1,0,1]=4 3244 B15R1.78 CCCCCC(=O)NCc1cccnc1 527a_100000210453_100000212188 [1,0,0,0,0,1|1,0,1]=4 3245 B15R1.78 CCCCCC(=O)NCc1ccncc1 11a_100000210450_100000212188 [1,0,0,0,0,1|1,0,1]=4 3246 B15R1.78 CCCCCC(=O)NCc1ccncc1 1626a_100000210450_100000212188 [1,0,0,0,0,1|1,0,1]=4 3247 B15R1.78 CCCCCC(=O)NCc1ccncc1 240690a_100000210450_100000212188 [1,0,0,0,0,1|1,0,1]=4 3248 B15R1.78 CCCCCC(=O)NCc1ccncc1 527a_100000210450_100000212188 [1,0,0,0,0,1|1,0,1]=4 3249 B15R1.78 CCCCCC(=O)NNc1ccccc1 22a_100015195140_100000212188 [1,0,0,0,0,1|1,0,0]=3 3250 B15R1.78 CCCCCC(=O)NNc1ccccn1 22a_100000183288_100000212188 [1,0,0,0,0,1|2,0,0]=4 3251 B15R1.78 CCCCCC(=O)NNc1cccnc1 22a_100000728903_100000212188 [1,0,0,0,0,1|2,0,0]=4 3252 B15R1.78 CCCCCC(=O)NNc1ccncc1 22a_100000698918_100000212188 [1,0,0,0,0,1|2,0,0]=4 3253 B15R1.78 CCCCNC(=O)C#Cc1ccccc1 240690a_100000102301_100000736102 [1,0,0,0,0,1|1,0,1]=4 3254 B15R1.78 CCCCNC(=O)C=Cc1ccccc1 11a_100000102301_100000210462 [1,0,0,0,0,1|1,0,0]=3 3255 B15R1.78 CCCCNC(=O)C=Cc1ccccc1 1626a_100000102301_100000210462 [1,0,0,0,0,1|1,0,0]=3 3256 B15R1.78 CCCCNC(=O)C=Cc1ccccn1 11a_100000102301_100000740811 [1,0,0,0,0,1|2,0,0]=4 3257 B15R1.78 CCCCNC(=O)C=Cc1ccccn1 240690a_100000102301_100000740811 [1,0,0,0,0,1|2,0,0]=4 3258 B15R1.78 CCCCNC(=O)C=Cc1cccnc1 11a_100000102301_100000735890 [1,0,0,0,0,1|2,0,0]=4 3259 B15R1.78 CCCCNC(=O)C=Cc1cccnc1 240690a_100000102301_100000735890 [1,0,0,0,0,1|2,0,0]=4 3260 B15R1.78 CCCCNC(=O)C=Cc1ccncc1 240690a_100000102301_100000682801 [1,0,0,0,0,1|2,0,0]=4 3261 B15R1.78 CCCCNC(=O)CCc1ccccc1 11a_100000102301_100000185753 [1,0,0,0,0,1|1,0,1]=4 3262 B15R1.78 CCCCNC(=O)CCc1ccccc1 1626a_100000102301_100000185753 [1,0,0,0,0,1|1,0,1]=4 3263 B15R1.78 CCCCNC(=O)CCc1ccccc1 240690a_100000102301_100000185753 [1,0,0,0,0,1|1,0,1]=4 3264 B15R1.78 CCCCNC(=O)CCc1ccccc1 527a_100000102301_100000185753 [1,0,0,0,0,1|1,0,1]=4 3265 B15R1.78 CCCCNC(=O)CNc1ccccc1 34a_100000106764_100000182744 [1,0,0,0,0,1|1,0,1]=4 3266 B15R1.78 CCCCNC(=O)COc1ccccc1 11a_100000102301_100000186222 [1,0,0,0,0,1|1,0,1]=4 3267 B15R1.78 CCCCNC(=O)COc1ccccc1 1626a_100000102301_100000186222 [1,0,0,0,0,1|1,0,1]=4 3268 B15R1.78 CCCCNC(=O)COc1ccccc1 240690a_100000102301_100000186222 [1,0,0,0,0,1|1,0,1]=4 3269 B15R1.78 CCCCNC(=O)COc1ccccc1 34a_100000210340_100000182744 [1,0,0,0,0,1|1,0,1]=4 3270 B15R1.78 CCCCNC(=O)COc1ccccc1 527a_100000102301_100000186222 [1,0,0,0,0,1|1,0,1]=4 3271 B15R1.78 CCCCNC(=O)COc1ccccc1 7a_100000210340_100000182744 [1,0,0,0,0,1|1,0,1]=4 3272 B15R1.78 CCCCNC(=O)CSc1ccccc1 11a_100000102301_100000211596 [1,0,0,0,0,1|1,0,1]=4 3273 B15R1.78 CCCCNC(=O)CSc1ccccc1 1626a_100000102301_100000211596 [1,0,0,0,0,1|1,0,1]=4 3274 B15R1.78 CCCCNC(=O)CSc1ccccc1 240690a_100000102301_100000211596 [1,0,0,0,0,1|1,0,1]=4 3275 B15R1.78 CCCCNC(=O)CSc1ccccc1 527a_100000102301_100000211596 [1,0,0,0,0,1|1,0,1]=4 3276 B15R1.78 CCCCNC(=O)CSc1ccccc1 62a_100000182744_100000041952 [1,0,0,0,0,1|1,0,1]=4 3277 B15R1.78 CCCCNC(=O)CSc1ccccc1 62a_100000719477_100000182744 [1,0,0,0,0,1|1,0,1]=4 3278 B15R1.78 CCCCNC(=O)NCc1ccccc1 2708a_100000102301_100015324214 [1,0,0,0,0,1|1,0,1]=4 3279 B15R1.78 CCCCNC(=O)NCc1ccccc1 2708a_100015324214_100000102301 [1,0,0,0,0,1|1,0,1]=4 3280 B15R1.78 CCCCNC(=O)NCc1ccccc1 273464a_100000102301_100015324214 [1,0,0,0,0,1|1,0,1]=4 3281 B15R1.78 CCCCNC(=O)NCc1ccccc1 273464a_100015324214_100000102301 [1,0,0,0,0,1|1,0,1]=4 3282 B15R1.78 CCCCNC(=O)NCc1ccccc1 512a_100000102301_100015324214 [1,0,0,0,0,1|1,0,1]=4 3283 B15R1.78 CCCCNC(=O)NCc1ccccc1 512a_100015324214_100000102301 [1,0,0,0,0,1|1,0,1]=4 3284 B15R1.78 CCCCNC(=O)NNc1ccccc1 273464a_100000102301_100015195140 [1,0,0,0,0,1|2,0,0]=4 3285 B15R1.78 CCCCNC(=O)NNc1ccccc1 512a_100000102301_100015195140 [1,0,0,0,0,1|2,0,0]=4 3286 B15R1.78 CCCCOC(=O)CNc1ccccc1 34a_100000106764_100000211628 [1,0,0,0,0,1|1,0,1]=4 3287 B15R1.78 CCCCOC(=O)COc1ccccc1 34a_100000210340_100000211628 [1,0,0,0,0,1|1,0,1]=4 3288 B15R1.78 CCCCOC(=O)COc1ccccc1 7a_100000210340_100000211628 [1,0,0,0,0,1|1,0,1]=4 3289 B15R1.78 CCCCOC(=O)CSc1ccccc1 62a_100000211628_100000041952 [1,0,0,0,0,1|1,0,1]=4 3290 B15R1.78 CCCCOC(=O)CSc1ccccc1 62a_100000719477_100000211628 [1,0,0,0,0,1|1,0,1]=4 3291 B15R1.78 CCCNCC(=O)NCc1ccccc1 2230a_100000739245_100000210303 [1,0,0,0,0,1|1,0,1]=4 3292 B15R1.78 CCCNNC(=O)C=Cc1ccccc1 22a_100000740057_100000210462 [1,0,0,0,0,1|2,0,0]=4 3293 B15R1.78 CCCOCC(=O)CCc1ccccc1 1458a_100000745993_100000765856 [1,0,0,0,0,1|1,0,1]=4 3294 B15R1.78 CCCOCC(=O)CCc1ccccc1 34a_100000210258_100012361361 [1,0,0,0,0,1|1,0,1]=4 3295 B15R1.78 CCCOCC(=O)NCc1ccccc1 11a_100015324214_100000745993 [1,0,0,0,0,1|1,0,1]=4 3296 B15R1.78 CCCOCC(=O)NCc1ccccc1 1626a_100015324214_100000745993 [1,0,0,0,0,1|1,0,1]=4 3297 B15R1.78 CCCOCC(=O)NCc1ccccc1 240690a_100015324214_100000745993 [1,0,0,0,0,1|1,0,1]=4 3298 B15R1.78 CCCOCC(=O)NCc1ccccc1 34a_100000210258_100000183539 [1,0,0,0,0,1|1,0,1]=4 3299 B15R1.78 CCCOCC(=O)NCc1ccccc1 527a_100015324214_100000745993 [1,0,0,0,0,1|1,0,1]=4 3300 B15R1.78 CCCOCC(=O)NNc1ccccc1 22a_100015195140_100000745993 [1,0,0,0,0,1|2,0,0]=4 3301 B15R1.78 CCCOCC(=O)OCc1ccccc1 34a_100000210258_100000753625 [1,0,0,0,0,1|1,0,1]=4 3302 B15R1.78 CCCSCC(=O)CCc1ccccc1 1458a_100000217233_100000765856 [1,0,0,0,0,1|1,0,1]=4 3303 B15R1.78 CCCSCC(=O)CCc1ccccc1 62a_100000210303_100012361361 [1,0,0,0,0,1|1,0,1]=4 3304 B15R1.78 CCCSCC(=O)CCc1ccccc1 62a_100012361361_100000210303 [1,0,0,0,0,1|1,0,1]=4 3305 B15R1.78 CCCSCC(=O)NCc1ccccc1 11a_100015324214_100000217233 [1,0,0,0,0,1|1,0,1]=4 3306 B15R1.78 CCCSCC(=O)NCc1ccccc1 1626a_100015324214_100000217233 [1,0,0,0,0,1|1,0,1]=4 3307 B15R1.78 CCCSCC(=O)NCc1ccccc1 240690a_100015324214_100000217233 [1,0,0,0,0,1|1,0,1]=4 3308 B15R1.78 CCCSCC(=O)NCc1ccccc1 527a_100015324214_100000217233 [1,0,0,0,0,1|1,0,1]=4 3309 B15R1.78 CCCSCC(=O)NCc1ccccc1 62a_100000183539_100000210303 [1,0,0,0,0,1|1,0,1]=4 3310 B15R1.78 CCCSCC(=O)NCc1ccccc1 62a_100000210303_100000183539 [1,0,0,0,0,1|1,0,1]=4 3311 B15R1.78 CCCSCC(=O)NNc1ccccc1 22a_100015195140_100000217233 [1,0,0,0,0,1|2,0,0]=4 3312 B15R1.78 CCCSCC(=O)OCc1ccccc1 62a_100000210303_100000753625 [1,0,0,0,0,1|1,0,1]=4 3313 B15R1.78 CCCSCC(=O)OCc1ccccc1 62a_100000753625_100000210303 [1,0,0,0,0,1|1,0,1]=4 3314 B15R1.78 CCNCCC(=O)NCc1ccccc1 2230a_100025741942_100000210202 [1,0,0,0,0,1|1,0,1]=4 3315 B15R1.78 CCNCCC(=O)NCc1ccccc1 34a_100025741942_100000210202 [1,0,0,0,0,1|1,0,1]=4 3316 B15R1.78 CCNCCC(=O)OCc1ccccc1 2230a_100015525214_100009813219 [1,0,0,0,0,1|1,0,1]=4 3317 B15R1.78 CCOCCC(=O)C#Cc1ccccc1 1458a_100000736102_100011215890 [1,0,0,0,0,1|1,0,1]=4 3318 B15R1.78 CCOCCC(=O)C=Cc1ccccc1 1458a_100000210462_100011215890 [1,0,0,0,0,1|1,0,0]=3 3319 B15R1.78 CCOCCC(=O)C=Cc1ccccn1 1458a_100000740811_100011215890 [1,0,0,0,0,1|2,0,0]=4 3320 B15R1.78 CCOCCC(=O)C=Cc1cccnc1 1458a_100000735890_100011215890 [1,0,0,0,0,1|2,0,0]=4 3321 B15R1.78 CCOCCC(=O)C=Cc1ccncc1 1458a_100000682801_100011215890 [1,0,0,0,0,1|2,0,0]=4 3322 B15R1.78 CCOCCC(=O)CCc1ccccc1 1458a_100000185753_100011215890 [1,0,0,0,0,1|1,0,1]=4 3323 B15R1.78 CCOCCC(=O)CCc1ccccc1 1458a_100000749530_100000765856 [1,0,0,0,0,1|1,0,1]=4 3324 B15R1.78 CCOCCC(=O)COc1ccccc1 1458a_100000186222_100011215890 [1,0,0,0,0,1|1,0,1]=4 3325 B15R1.78 CCOCCC(=O)CSc1ccccc1 1458a_100000211596_100011215890 [1,0,0,0,0,1|1,0,1]=4 3326 B15R1.78 CCOCCC(=O)NCc1ccccc1 11a_100015324214_100000749530 [1,0,0,0,0,1|1,0,1]=4 3327 B15R1.78 CCOCCC(=O)NCc1ccccc1 1626a_100015324214_100000749530 [1,0,0,0,0,1|1,0,1]=4 3328 B15R1.78 CCOCCC(=O)NCc1ccccc1 240690a_100015324214_100000749530 [1,0,0,0,0,1|1,0,1]=4 3329 B15R1.78 CCOCCC(=O)NCc1ccccc1 527a_100015324214_100000749530 [1,0,0,0,0,1|1,0,1]=4 3330 B15R1.78 CCOCCC(=O)NNc1ccccc1 22a_100015195140_100000749530 [1,0,0,0,0,1|2,0,0]=4 3331 B15R1.78 CCOCCC(=O)OCc1ccccc1 7a_100009831632_100000210202 [1,0,0,0,0,1|1,0,1]=4 3332 B15R1.78 CCSCCC(=O)C#Cc1ccccc1 1458a_100000736102_100000757381 [1,0,0,0,0,1|1,0,1]=4 3333 B15R1.78 CCSCCC(=O)C=Cc1ccccc1 1458a_100000210462_100000757381 [1,0,0,0,0,1|1,0,0]=3 3334 B15R1.78 CCSCCC(=O)C=Cc1ccccn1 1458a_100000740811_100000757381 [1,0,0,0,0,1|2,0,0]=4 3335 B15R1.78 CCSCCC(=O)C=Cc1cccnc1 1458a_100000735890_100000757381 [1,0,0,0,0,1|2,0,0]=4 3336 B15R1.78 CCSCCC(=O)C=Cc1ccncc1 1458a_100000682801_100000757381 [1,0,0,0,0,1|2,0,0]=4 3337 B15R1.78 CCSCCC(=O)CCc1ccccc1 1458a_100000185753_100000757381 [1,0,0,0,0,1|1,0,1]=4 3338 B15R1.78 CCSCCC(=O)CCc1ccccc1 1458a_100000230768_100000765856 [1,0,0,0,0,1|1,0,1]=4 3339 B15R1.78 CCSCCC(=O)COc1ccccc1 1458a_100000186222_100000757381 [1,0,0,0,0,1|1,0,1]=4 3340 B15R1.78 CCSCCC(=O)CSc1ccccc1 1458a_100000211596_100000757381 [1,0,0,0,0,1|1,0,1]=4 3341 B15R1.78 CCSCCC(=O)NCc1ccccc1 11a_100015324214_100000230768 [1,0,0,0,0,1|1,0,1]=4 3342 B15R1.78 CCSCCC(=O)NCc1ccccc1 1626a_100015324214_100000230768 [1,0,0,0,0,1|1,0,1]=4 3343 B15R1.78 CCSCCC(=O)NCc1ccccc1 240690a_100015324214_100000230768 [1,0,0,0,0,1|1,0,1]=4 3344 B15R1.78 CCSCCC(=O)NCc1ccccc1 527a_100015324214_100000230768 [1,0,0,0,0,1|1,0,1]=4 3345 B15R1.78 CCSCCC(=O)NNc1ccccc1 22a_100015195140_100000230768 [1,0,0,0,0,1|2,0,0]=4 3346 B15R1.78 CCSCCC(=O)OCc1ccccc1 62a_100000210202_100009813219 [1,0,0,0,0,1|1,0,1]=4 3347 B15R1.78 CCSCCC(=O)OCc1ccccc1 62a_100009813219_100000210202 [1,0,0,0,0,1|1,0,1]=4 3348 B15R1.78 CNCCCC(=O)OCc1ccccc1 2230a_106832991635_100009813218 [1,0,0,0,0,1|1,0,1]=4 3349 B15R1.78 CNCCCC(=O)OCc1ccccc1 34a_100102657272_100009813218 [1,0,0,0,0,1|1,0,1]=4 3350 B15R1.78 CNCCCC(=O)OCc1ccccc1 7a_106832991635_100009813218 [1,0,0,0,0,1|1,0,1]=4 3351 B15R1.78 COCCCC(=O)C#Cc1ccccc1 1458a_100000736102_100000740836 [1,0,0,0,0,1|1,0,1]=4 3352 B15R1.78 COCCCC(=O)C=Cc1ccccc1 1458a_100000210462_100000740836 [1,0,0,0,0,1|1,0,0]=3 3353 B15R1.78 COCCCC(=O)C=Cc1ccccn1 1458a_100000740811_100000740836 [1,0,0,0,0,1|2,0,0]=4 3354 B15R1.78 COCCCC(=O)C=Cc1cccnc1 1458a_100000735890_100000740836 [1,0,0,0,0,1|2,0,0]=4 3355 B15R1.78 COCCCC(=O)C=Cc1ccncc1 1458a_100000682801_100000740836 [1,0,0,0,0,1|2,0,0]=4 3356 B15R1.78 COCCCC(=O)CCc1ccccc1 1458a_100000185753_100000740836 [1,0,0,0,0,1|1,0,1]=4 3357 B15R1.78 COCCCC(=O)CCc1ccccc1 1458a_100000741012_100000765856 [1,0,0,0,0,1|1,0,1]=4 3358 B15R1.78 COCCCC(=O)COc1ccccc1 1458a_100000186222_100000740836 [1,0,0,0,0,1|1,0,1]=4 3359 B15R1.78 COCCCC(=O)CSc1ccccc1 1458a_100000211596_100000740836 [1,0,0,0,0,1|1,0,1]=4 3360 B15R1.78 COCCCC(=O)NCc1ccccc1 11a_100015324214_100000741012 [1,0,0,0,0,1|1,0,1]=4 3361 B15R1.78 COCCCC(=O)NCc1ccccc1 1626a_100015324214_100000741012 [1,0,0,0,0,1|1,0,1]=4 3362 B15R1.78 COCCCC(=O)NCc1ccccc1 240690a_100015324214_100000741012 [1,0,0,0,0,1|1,0,1]=4 3363 B15R1.78 COCCCC(=O)NCc1ccccc1 527a_100015324214_100000741012 [1,0,0,0,0,1|1,0,1]=4 3364 B15R1.78 COCCCC(=O)NNc1ccccc1 22a_100015195140_100000741012 [1,0,0,0,0,1|2,0,0]=4 3365 B15R1.78 COCCCC(=O)OCc1ccccc1 34a_100138415774_100009813218 [1,0,0,0,0,1|1,0,1]=4 3366 B15R1.78 COCCCC(=O)OCc1ccccc1 7a_100009831633_200000210301 [1,0,0,0,0,1|1,0,1]=4 3367 B15R1.78 COCCNC(=O)C=Cc1ccccc1 1626a_100000209980_100000210462 [1,0,0,0,0,1|2,0,0]=4 3368 B15R1.78 CSCCCC(=O)CCc1ccccc1 1458a_100000173376_100000765856 [1,0,0,0,0,1|1,0,1]=4 3369 B15R1.78 CSCCCC(=O)NCc1ccccc1 11a_100015324214_100000173376 [1,0,0,0,0,1|1,0,1]=4 3370 B15R1.78 CSCCCC(=O)NCc1ccccc1 1626a_100015324214_100000173376 [1,0,0,0,0,1|1,0,1]=4 3371 B15R1.78 CSCCCC(=O)NCc1ccccc1 240690a_100015324214_100000173376 [1,0,0,0,0,1|1,0,1]=4 3372 B15R1.78 CSCCCC(=O)NCc1ccccc1 527a_100015324214_100000173376 [1,0,0,0,0,1|1,0,1]=4 3373 B15R1.78 CSCCCC(=O)NNc1ccccc1 22a_100015195140_100000173376 [1,0,0,0,0,1|2,0,0]=4 3374 B15R1.78 CSCCCC(=O)OCc1ccccc1 62a_100009813218_200000210301 [1,0,0,0,0,1|1,0,1]=4 3375 B15R1.78 CSCCCC(=O)OCc1ccccc1 62a_200000210301_100009813218 [1,0,0,0,0,1|1,0,1]=4 3376 B15R1.78 CSCCNC(=O)C=Cc1ccccc1 11a_100020590264_100000210462 [1,0,0,0,0,1|2,0,0]=4 3377 B15R1.78 CSCCNC(=O)C=Cc1ccccc1 1626a_100020590264_100000210462 [1,0,0,0,0,1|2,0,0]=4 3378 B15R1.78 N#CCCCC(=O)C=Cc1ccccc1 1458a_100000210462_100000211468 [1,0,0,0,0,1|1,0,1]=4 3379 B15R1.78 O=C(C#Cc1ccccc1)CCCCF 1458a_100000736102_100000729493 [1,0,0,0,0,1|1,0,1]=4 3380 B15R1.78 O=C(C#Cc1ccccc1)CCCCO 1458a_100000736102_100000210776 [1,0,0,0,0,1|1,0,1]=4 3381 B15R1.78 O=C(C=Cc1ccccc1)CCCCF 1458a_100000210462_100000729493 [1,0,0,0,0,1|1,0,0]=3 3382 B15R1.78 O=C(C=Cc1ccccc1)CCCCO 1458a_100000210462_100000210776 [1,0,0,0,0,1|1,0,0]=3 3383 B15R1.78 O=C(C=Cc1ccccc1)NCCCF 11a_100015189416_100000210462 [1,0,0,0,0,1|2,0,0]=4 3384 B15R1.78 O=C(C=Cc1ccccc1)NCCCF 1626a_100015189416_100000210462 [1,0,0,0,0,1|2,0,0]=4 3385 B15R1.78 O=C(C=Cc1ccccn1)CCCCF 1458a_100000740811_100000729493 [1,0,0,0,0,1|2,0,0]=4 3386 B15R1.78 O=C(C=Cc1ccccn1)CCCCO 1458a_100000740811_100000210776 [1,0,0,0,0,1|2,0,0]=4 3387 B15R1.78 O=C(C=Cc1cccnc1)CCCCF 1458a_100000735890_100000729493 [1,0,0,0,0,1|2,0,0]=4 3388 B15R1.78 O=C(C=Cc1cccnc1)CCCCO 1458a_100000735890_100000210776 [1,0,0,0,0,1|2,0,0]=4 3389 B15R1.78 O=C(C=Cc1ccncc1)CCCCF 1458a_100000682801_100000729493 [1,0,0,0,0,1|2,0,0]=4 3390 B15R1.78 O=C(C=Cc1ccncc1)CCCCO 1458a_100000682801_100000210776 [1,0,0,0,0,1|2,0,0]=4 3391 B15R1.78 O=C(CCCCF)CCc1ccccc1 1458a_100000185753_100000729493 [1,0,0,0,0,1|1,0,1]=4 3392 B15R1.78 O=C(CCCCF)COc1ccccc1 1458a_100000186222_100000729493 [1,0,0,0,0,1|1,0,1]=4 3393 B15R1.78 O=C(CCCCF)CSc1ccccc1 1458a_100000211596_100000729493 [1,0,0,0,0,1|1,0,1]=4 3394 B15R1.78 O=C(CCCCO)CCc1ccccc1 1458a_100000185753_100000210776 [1,0,0,0,0,1|1,0,1]=4 3395 B15R1.78 O=C(CCCCO)CCc1ccccc1 1458a_100000695505_100000765856 [1,0,0,0,0,1|1,0,1]=4 3396 B15R1.78 O=C(CCCCO)COc1ccccc1 1458a_100000186222_100000210776 [1,0,0,0,0,1|1,0,1]=4 3397 B15R1.78 O=C(CCCCO)CSc1ccccc1 1458a_100000211596_100000210776 [1,0,0,0,0,1|1,0,1]=4 3398 B15R1.78 O=C(CCCCO)NCc1ccccc1 1626a_100015324214_100000695505 [1,0,0,0,0,1|1,0,1]=4 3399 B15R1.78 [13CH3]OCCCC(=O)OCc1ccccc1 7a_100009831633_200025704644 [1,0,0,0,0,1|1,0,1]=4 3400 B15R1.78 [13CH3]SCCCC(=O)OCc1ccccc1 62a_100009813218_200025704644 [1,0,0,0,0,1|1,0,1]=4 3401 B15R1.78 [13CH3]SCCCC(=O)OCc1ccccc1 62a_200025704644_100009813218 [1,0,0,0,0,1|1,0,1]=4 3402 B17R1.1937 C=CC(=NNCc1ccccc1)CCCCC 4a_100000007032_100011217817 [0,0,0,0,0,2|1,0,1]=4