0 B17R2.19053 C#CCCCSc1cccc2c1CC(=O)N2 62a_100011215417_100009816812 [0,0,0,0,0,0|2,0,2]=4 1 B17R2.19053 C=CCCCSc1cccc2c1CC(=O)N2 62a_100011713584_100009816812 [0,0,0,0,0,0|2,0,2]=4 2 B17R2.19053 CC/C=C\CSc1cccc2c1CC(=O)C2 62a_100010205903_100103147603 [0,0,0,0,0,0|3,0,1]=4 3 B17R2.19053 CC/C=C\CSc1cccc2c1CC(=O)N2 62a_100103147603_100009816812 [0,0,0,0,0,0|2,0,1]=3 4 B17R2.19053 CC/C=C\CSc1ccnc2c1CC(=O)N2 62a_100103147603_100000104061 [0,0,0,0,0,0|3,0,1]=4 5 B17R2.19053 CCC#CCSc1cccc2c1CC(=O)C2 62a_100010205903_100009813939 [0,0,0,0,0,0|3,0,1]=4 6 B17R2.19053 CCC#CCSc1cccc2c1CC(=O)N2 62a_100009813939_100009816812 [0,0,0,0,0,0|2,0,1]=3 7 B17R2.19053 CCC#CCSc1ccnc2c1CC(=O)N2 62a_100009813939_100000104061 [0,0,0,0,0,0|3,0,1]=4 8 B17R2.19053 CCCCC=Cc1cccc2c1CC(=O)C2 271570a_100016275911_100010205903 [0,0,0,0,0,0|2,0,2]=4 9 B17R2.19053 CCCCC=Cc1cccc2c1CC(=O)N2 271570a_100016275911_100009816812 [0,0,0,0,0,0|1,0,2]=3 10 B17R2.19053 CCCCC=Cc1cccc2c1oc(=O)[nH]2 271570a_100016275911_100012360093 [0,0,0,0,0,0|2,0,2]=4 11 B17R2.19053 CCCCC=Cc1ccnc2c1CC(=O)N2 271570a_100016275911_100000104061 [0,0,0,0,0,0|2,0,2]=4 12 B17R2.19053 CCCCCOc1cccc2c1cc([nH]2)C 34a_200000059750_100000718602 [0,0,0,0,0,0|3,0,1]=4 13 B17R2.19053 CCCCCSc1cccc2c1CC(=C2)C 62a_100010271545_100000210326 [0,0,0,0,0,0|4,0,0]=4 14 B17R2.19053 CCCCCSc1cccc2c1CC(=O)C2 62a_100010205903_100000210326 [0,0,0,0,0,0|3,0,0]=3 15 B17R2.19053 CCCCCSc1cccc2c1CC(=O)N2 62a_100000210326_100009816812 [0,0,0,0,0,0|2,0,0]=2 16 B17R2.19053 CCCCCSc1cccc2c1NC(=O)C2 62a_100000210326_100000767046 [0,0,0,0,0,0|4,0,0]=4 17 B17R2.19053 CCCCCSc1cccc2c1cc([nH]2)C 62a_100000210326_100010143266 [0,0,0,0,0,0|3,0,1]=4 18 B17R2.19053 CCCCCSc1cccc2c1nc([nH]2)C 62a_100000210326_100012360556 [0,0,0,0,0,0|4,0,0]=4 19 B17R2.19053 CCCCCSc1ccnc2c1CC(=O)N2 62a_100000210326_100000104061 [0,0,0,0,0,0|3,0,0]=3 20 B17R2.19053 CCCCCSc1ncnc2c1CC(=O)N2 62a_100000210326_100000094081 [0,0,0,0,0,0|4,0,0]=4 21 B17R2.19053 CCOCCSc1cccc2c1CC(=O)C2 62a_100010205903_100011215890 [0,0,0,0,0,0|4,0,0]=4 22 B17R2.19053 CCOCCSc1cccc2c1CC(=O)N2 62a_100000210147_100009816812 [0,0,0,0,0,0|3,0,0]=3 23 B17R2.19053 CCOCCSc1ccnc2c1CC(=O)N2 62a_100000210147_100000104061 [0,0,0,0,0,0|4,0,0]=4 24 B17R2.19053 CCSCCSc1cccc2c1CC(=O)C2 62a_100010205903_100000757381 [0,0,0,0,0,0|4,0,0]=4 25 B17R2.19053 CCSCCSc1cccc2c1CC(=O)N2 62a_100000757381_100009816812 [0,0,0,0,0,0|3,0,0]=3 26 B17R2.19053 CCSCCSc1ccnc2c1CC(=O)N2 62a_100000757381_100000104061 [0,0,0,0,0,0|4,0,0]=4 27 B17R2.19053 COCCCSc1cccc2c1CC(=O)C2 62a_100010205903_100000709357 [0,0,0,0,0,0|4,0,0]=4 28 B17R2.19053 COCCCSc1cccc2c1CC(=O)N2 62a_100000709357_100009816812 [0,0,0,0,0,0|3,0,0]=3 29 B17R2.19053 COCCCSc1ccnc2c1CC(=O)N2 62a_100000709357_100000104061 [0,0,0,0,0,0|4,0,0]=4 30 B17R2.19053 N#CCCCSc1cccc2c1CC(=O)N2 62a_100000687738_100009816812 [0,0,0,0,0,0|3,0,1]=4 31 B17R2.19053 O=C1Cc2c(cccc2SCC#CCO)N1 62a_200000047223_100009816812 [0,0,0,0,0,0|3,0,1]=4 32 B17R2.19053 O=C1Cc2c(cccc2SCCCCF)N1 62a_100000729493_100009816812 [0,0,0,0,0,0|3,0,0]=3 33 B17R2.19053 O=C1Cc2c(cccc2SCCCCO)N1 62a_100000210776_100009816812 [0,0,0,0,0,0|3,0,0]=3 34 B17R2.19053 O=C1Cc2c(ccnc2N1)SCCCCF 62a_100000729493_100000104061 [0,0,0,0,0,0|4,0,0]=4 35 B17R2.19053 O=C1Cc2c(ccnc2N1)SCCCCO 62a_100000210776_100000104061 [0,0,0,0,0,0|4,0,0]=4 36 B17R2.19053 O=C1Cc2cccc(c2C1)SCCCCF 62a_100010205903_100000729493 [0,0,0,0,0,0|4,0,0]=4 37 B17R2.19053 O=C1Cc2cccc(c2C1)SCCCCO 62a_100010205903_100000210776 [0,0,0,0,0,0|4,0,0]=4 38 B17R2.19053 O=CCCCSc1cccc2c1CC(=O)N2 62a_200011292268_100009816812 [0,0,0,0,0,0|3,0,1]=4 39 B16R2.6352 C#CCCSc1cccc2c1CC(=O)N2 62a_100000688953_100009816812 [1,0,0,0,0,0|1,0,2]=4 40 B16R2.6352 C/C=C/CSc1cccc2c1CC(=O)N2 62a_100102629194_100009816812 [1,0,0,0,0,0|1,0,2]=4 41 B16R2.6352 C=CCCSc1cccc2c1CC(=O)N2 62a_100000754431_100009816812 [1,0,0,0,0,0|1,0,2]=4 42 B16R2.6352 CC#CCSc1cccc2c1CC(=O)N2 62a_100000748600_100009816812 [1,0,0,0,0,0|1,0,2]=4 43 B16R2.6352 CC=CCSc1cccc2c1CC(=O)N2 62a_100000070051_100009816812 [1,0,0,0,0,0|1,0,2]=4 44 B16R2.6352 CCCC=Cc1cccc2c1CC(=O)C2 271570a_100016258520_100010205903 [1,0,0,0,0,0|1,0,2]=4 45 B16R2.6352 CCCC=Cc1cccc2c1CC(=O)N2 271570a_100016258520_100009816812 [1,0,0,0,0,0|0,0,2]=3 46 B16R2.6352 CCCC=Cc1cccc2c1oc(=O)[nH]2 271570a_100016258520_100012360093 [1,0,0,0,0,0|1,0,2]=4 47 B16R2.6352 CCCC=Cc1ccnc2c1CC(=O)N2 271570a_100016258520_100000104061 [1,0,0,0,0,0|1,0,2]=4 48 B16R2.6352 CCCCOc1cccc2c1cc([nH]2)C 34a_200000059750_100000210210 [1,0,0,0,0,0|2,0,1]=4 49 B16R2.6352 CCCCSc1cccc2c1CC(=C2)C 62a_100010271545_100000210210 [1,0,0,0,0,0|3,0,0]=4 50 B16R2.6352 CCCCSc1cccc2c1CC(=O)C2 62a_100010205903_100000210210 [1,0,0,0,0,0|2,0,0]=3 51 B16R2.6352 CCCCSc1cccc2c1CC(=O)N2 62a_100000210211_100009816812 [1,0,0,0,0,0|1,0,0]=2 52 B16R2.6352 CCCCSc1cccc2c1NC(=O)C2 62a_100000210211_100000767046 [1,0,0,0,0,0|3,0,0]=4 53 B16R2.6352 CCCCSc1cccc2c1cc([nH]2)C 62a_100000210211_100010143266 [1,0,0,0,0,0|2,0,1]=4 54 B16R2.6352 CCCCSc1cccc2c1nc([nH]2)C 62a_100000210211_100012360556 [1,0,0,0,0,0|3,0,0]=4 55 B16R2.6352 CCCCSc1ccnc2c1CC(=O)N2 62a_100000210211_100000104061 [1,0,0,0,0,0|2,0,0]=3 56 B16R2.6352 CCCCSc1ncnc2c1CC(=O)N2 62a_100000210211_100000094081 [1,0,0,0,0,0|3,0,0]=4 57 B16R2.6352 CCOC=Cc1cccc2c1CC(=O)N2 271570a_100016256518_100009816812 [1,0,0,0,0,0|1,0,2]=4 58 B16R2.6352 CCOCSc1cccc2c1CC(=O)C2 62a_100010205903_100000739092 [1,0,0,0,0,0|3,0,0]=4 59 B16R2.6352 CCOCSc1cccc2c1CC(=O)N2 62a_100000739092_100009816812 [1,0,0,0,0,0|2,0,0]=3 60 B16R2.6352 CCOCSc1ccnc2c1CC(=O)N2 62a_100000739092_100000104061 [1,0,0,0,0,0|3,0,0]=4 61 B16R2.6352 COCC=Cc1cccc2c1CC(=O)N2 271570a_100016286323_100009816812 [1,0,0,0,0,0|1,0,2]=4 62 B16R2.6352 COCCSc1cccc2c1CC(=O)C2 62a_100010205903_100000233755 [1,0,0,0,0,0|3,0,0]=4 63 B16R2.6352 COCCSc1cccc2c1CC(=O)N2 62a_100000233755_100009816812 [1,0,0,0,0,0|2,0,0]=3 64 B16R2.6352 COCCSc1ccnc2c1CC(=O)N2 62a_100000233755_100000104061 [1,0,0,0,0,0|3,0,0]=4 65 B16R2.6352 CSCCSc1cccc2c1CC(=O)C2 62a_100010205903_100000751147 [1,0,0,0,0,0|3,0,0]=4 66 B16R2.6352 CSCCSc1cccc2c1CC(=O)N2 62a_100000212216_100009816812 [1,0,0,0,0,0|2,0,0]=3 67 B16R2.6352 CSCCSc1ccnc2c1CC(=O)N2 62a_100000212216_100000104061 [1,0,0,0,0,0|3,0,0]=4 68 B16R2.6352 N#CCCSc1cccc2c1CC(=O)N2 62a_100011215226_100009816812 [1,0,0,0,0,0|2,0,1]=4 69 B16R2.6352 O=C1Cc2c(cccc2SCCCF)N1 62a_100011934791_100009816812 [1,0,0,0,0,0|2,0,0]=3 70 B16R2.6352 O=C1Cc2c(cccc2SCCCO)N1 62a_100011215043_100009816812 [1,0,0,0,0,0|2,0,0]=3 71 B16R2.6352 O=C1Cc2c(ccnc2N1)SCCCF 62a_100011934791_100000104061 [1,0,0,0,0,0|3,0,0]=4 72 B16R2.6352 O=C1Cc2c(ccnc2N1)SCCCO 62a_100011215043_100000104061 [1,0,0,0,0,0|3,0,0]=4 73 B16R2.6352 O=C1Cc2cccc(c2C1)SCCCF 62a_100010205903_100011934791 [1,0,0,0,0,0|3,0,0]=4 74 B16R2.6352 O=C1Cc2cccc(c2C1)SCCCO 62a_100010205903_100011215043 [1,0,0,0,0,0|3,0,0]=4 75 B16R2.11632 CCCCCOc1cccc2c1CCN2 34a_100000703684_100000718602 [1,0,0,0,0,0|2,0,1]=4 76 B16R2.11632 CCCCCOc1cccc2c1cc[nH]2 34a_100000763377_100000718602 [1,0,0,0,0,0|2,0,1]=4 77 B16R2.11632 CCCCCSc1cccc2c1CC=C2 62a_100000210326_100009844718 [1,0,0,0,0,0|3,0,0]=4 78 B16R2.11632 CCCCCSc1cccc2c1CC=C2 62a_100009844718_100000210326 [1,0,0,0,0,0|3,0,0]=4 79 B16R2.11632 CCCCCSc1cccc2c1CCN2 62a_100000210326_100009817896 [1,0,0,0,0,0|2,0,1]=4 80 B16R2.11632 CCCCCSc1cccc2c1CCN2 62a_100009817896_100000210326 [1,0,0,0,0,0|2,0,1]=4 81 B16R2.11632 CCCCCSc1cccc2c1cc[nH]2 62a_100000210326_100000685724 [1,0,0,0,0,0|2,0,1]=4 82 B16R2.11632 CCCCCSc1cccc2c1nc[nH]2 62a_100000210326_100011935113 [1,0,0,0,0,0|3,0,0]=4 83 B16R2.11632 CCCCNCc1cccc2c1cc[nH]2 207a_100000102301_100000750904 [1,0,0,0,0,0|2,0,1]=4 84 B16R2.11632 CCCNN=Cc1cccc2c1cc[nH]2 4a_100000740057_100000750904 [1,0,0,0,0,0|1,0,2]=4 85 B18R2.6448 CC(=O)CCCSc1cccc2c1CC(=O)N2 62a_100011215641_100009816812 [0,1,0,0,0,0|2,0,1]=4 86 B18R2.6448 CC(C)CCCSc1cccc2c1CC(=O)C2 62a_100010205903_100011214892 [0,1,0,0,0,0|3,0,0]=4 87 B18R2.6448 CC(C)CCCSc1cccc2c1CC(=O)N2 62a_100011214892_100009816812 [0,1,0,0,0,0|2,0,0]=3 88 B18R2.6448 CC(C)CCCSc1ccnc2c1CC(=O)N2 62a_100011214892_100000104061 [0,1,0,0,0,0|3,0,0]=4 89 B18R2.6448 CC(C)OCCSc1cccc2c1CC(=O)N2 62a_100000211751_100009816812 [0,1,0,0,0,0|3,0,0]=4 90 B18R2.6448 CC(C)SCCSc1cccc2c1CC(=O)N2 62a_100000730970_100009816812 [0,1,0,0,0,0|3,0,0]=4 91 B18R2.6448 CC(O)CCCSc1cccc2c1CC(=O)C2 62a_100010205903_200000718107 [0,1,0,0,0,0|3,0,0]=4 92 B18R2.6448 CC(O)CCCSc1cccc2c1CC(=O)N2 62a_200000718107_100009816812 [0,1,0,0,0,0|2,0,0]=3 93 B18R2.6448 CC(O)CCCSc1ccnc2c1CC(=O)N2 62a_200000718107_100000104061 [0,1,0,0,0,0|3,0,0]=4 94 B18R2.11386 CCCCNC(=O)c1cccc2c1CC(=O)N2 240690a_100000102301_100000098511 [0,1,0,0,0,0|2,0,1]=4 95 B18R2.11386 CCCCNC(=O)c1cccc2c1CC(=O)N2 527a_100000102301_100000098511 [0,1,0,0,0,0|2,0,1]=4 96 B18R2.11386 CCCNNC(=O)c1cccc2c1CC(=O)N2 22a_100000740057_100000098511 [0,1,0,0,0,0|1,0,1]=3 97 B18R2.11386 O=C1Cc2c(cccc2C(=O)NNCCO)N1 22a_100000210001_100000098511 [0,1,0,0,0,0|2,0,1]=4 98 B18R2.16177 C#CCCCCSc1cccc2c1CC(=O)N2 62a_100010269958_100009816812 [0,1,0,0,0,0|1,0,2]=4 99 B18R2.16177 C#CCOCCSc1cccc2c1CC(=O)N2 62a_100010402529_100009816812 [0,1,0,0,0,0|1,0,2]=4 100 B18R2.16177 C=CCCCCSc1cccc2c1CC(=O)N2 62a_100011215482_100009816812 [0,1,0,0,0,0|1,0,2]=4 101 B18R2.16177 CC/C=C\CCSc1cccc2c1CC(=O)C2 62a_100010205903_100015370543 [0,1,0,0,0,0|2,0,1]=4 102 B18R2.16177 CC/C=C\CCSc1cccc2c1CC(=O)N2 62a_100015370543_100009816812 [0,1,0,0,0,0|1,0,1]=3 103 B18R2.16177 CC/C=C\CCSc1ccnc2c1CC(=O)N2 62a_100015370543_100000104061 [0,1,0,0,0,0|2,0,1]=4 104 B18R2.16177 CCCCCC=Cc1cccc2c1CC(=O)C2 271570a_100000062253_100010205903 [0,1,0,0,0,0|2,0,1]=4 105 B18R2.16177 CCCCCC=Cc1cccc2c1CC(=O)N2 271570a_100000062253_100009816812 [0,1,0,0,0,0|1,0,1]=3 106 B18R2.16177 CCCCCC=Cc1cccc2c1oc(=O)[nH]2 271570a_100000062253_100012360093 [0,1,0,0,0,0|2,0,1]=4 107 B18R2.16177 CCCCCC=Cc1ccnc2c1CC(=O)N2 271570a_100000062253_100000104061 [0,1,0,0,0,0|2,0,1]=4 108 B18R2.16177 CCCCCCOc1cccc2c1cc([nH]2)C 34a_200000059750_100000210314 [0,1,0,0,0,0|2,0,1]=4 109 B18R2.16177 CCCCCCSc1cccc2c1CC(=O)C2 62a_100010205903_100000210757 [0,1,0,0,0,0|2,0,0]=3 110 B18R2.16177 CCCCCCSc1cccc2c1CC(=O)N2 62a_100000210314_100009816812 [0,1,0,0,0,0|1,0,0]=2 111 B18R2.16177 CCCCCCSc1cccc2c1NC(=O)C2 62a_100000210314_100000767046 [0,1,0,0,0,0|3,0,0]=4 112 B18R2.16177 CCCCCCSc1cccc2c1nc([nH]2)C 62a_100000210314_100012360556 [0,1,0,0,0,0|3,0,0]=4 113 B18R2.16177 CCCCCCSc1ccnc2c1CC(=O)N2 62a_100000210314_100000104061 [0,1,0,0,0,0|2,0,0]=3 114 B18R2.16177 CCCCCCSc1ncnc2c1CC(=O)N2 62a_100000210314_100000094081 [0,1,0,0,0,0|3,0,0]=4 115 B18R2.16177 CCCCOCSc1cccc2c1CC(=O)C2 62a_100010205903_100011995733 [0,1,0,0,0,0|3,0,0]=4 116 B18R2.16177 CCCCOCSc1cccc2c1CC(=O)N2 62a_100011995733_100009816812 [0,1,0,0,0,0|2,0,0]=3 117 B18R2.16177 CCCCOCSc1ccnc2c1CC(=O)N2 62a_100011995733_100000104061 [0,1,0,0,0,0|3,0,0]=4 118 B18R2.16177 CCCOCCOc1cccc2c1cc([nH]2)C 34a_200000059750_100011215938 [0,1,0,0,0,0|2,0,1]=4 119 B18R2.16177 CCCOCCSc1cccc2c1CC(=C2)C 62a_100010271545_100011215938 [0,1,0,0,0,0|3,0,0]=4 120 B18R2.16177 CCCOCCSc1cccc2c1CC(=O)C2 62a_100010205903_100011215938 [0,1,0,0,0,0|2,0,0]=3 121 B18R2.16177 CCCOCCSc1cccc2c1CC(=O)N2 62a_100011215938_100009816812 [0,1,0,0,0,0|1,0,0]=2 122 B18R2.16177 CCCOCCSc1cccc2c1NC(=O)C2 62a_100011215938_100000767046 [0,1,0,0,0,0|3,0,0]=4 123 B18R2.16177 CCCOCCSc1cccc2c1cc([nH]2)C 62a_100011215938_100010143266 [0,1,0,0,0,0|2,0,1]=4 124 B18R2.16177 CCCOCCSc1cccc2c1nc([nH]2)C 62a_100011215938_100012360556 [0,1,0,0,0,0|3,0,0]=4 125 B18R2.16177 CCCOCCSc1ccnc2c1CC(=O)N2 62a_100011215938_100000104061 [0,1,0,0,0,0|2,0,0]=3 126 B18R2.16177 CCCOCCSc1ncnc2c1CC(=O)N2 62a_100011215938_100000094081 [0,1,0,0,0,0|3,0,0]=4 127 B18R2.16177 CCOCCCSc1cccc2c1CC(=O)C2 62a_100010205903_100012232248 [0,1,0,0,0,0|3,0,0]=4 128 B18R2.16177 CCOCCCSc1cccc2c1CC(=O)N2 62a_100012232248_100009816812 [0,1,0,0,0,0|2,0,0]=3 129 B18R2.16177 CCOCCCSc1ccnc2c1CC(=O)N2 62a_100012232248_100000104061 [0,1,0,0,0,0|3,0,0]=4 130 B18R2.16177 COCCCCSc1cccc2c1CC(=O)C2 62a_100010205903_100000730899 [0,1,0,0,0,0|3,0,0]=4 131 B18R2.16177 COCCCCSc1cccc2c1CC(=O)N2 62a_100000730899_100009816812 [0,1,0,0,0,0|2,0,0]=3 132 B18R2.16177 COCCCCSc1ccnc2c1CC(=O)N2 62a_100000730899_100000104061 [0,1,0,0,0,0|3,0,0]=4 133 B18R2.16177 COCCOCSc1cccc2c1CC(=O)C2 62a_100010205903_100000231047 [0,1,0,0,0,0|3,0,0]=4 134 B18R2.16177 COCCOCSc1cccc2c1CC(=O)N2 62a_100000231047_100009816812 [0,1,0,0,0,0|2,0,0]=3 135 B18R2.16177 COCCOCSc1ccnc2c1CC(=O)N2 62a_100000231047_100000104061 [0,1,0,0,0,0|3,0,0]=4 136 B18R2.16177 N#CCCCCSc1cccc2c1CC(=O)N2 62a_100011219923_100009816812 [0,1,0,0,0,0|2,0,1]=4 137 B18R2.16177 N#CCOCCSc1cccc2c1CC(=O)N2 62a_200000047693_100009816812 [0,1,0,0,0,0|2,0,1]=4 138 B18R2.16177 O=C1Cc2c(cccc2SCCCCCF)N1 62a_100000729378_100009816812 [0,1,0,0,0,0|2,0,0]=3 139 B18R2.16177 O=C1Cc2c(cccc2SCCCCCO)N1 62a_100000746330_100009816812 [0,1,0,0,0,0|2,0,0]=3 140 B18R2.16177 O=C1Cc2c(cccc2SCCOCCO)N1 62a_100011215305_100009816812 [0,1,0,0,0,0|2,0,0]=3 141 B18R2.16177 O=C1Cc2c(ccnc2N1)SCCCCCF 62a_100000729378_100000104061 [0,1,0,0,0,0|3,0,0]=4 142 B18R2.16177 O=C1Cc2c(ccnc2N1)SCCCCCO 62a_100000746330_100000104061 [0,1,0,0,0,0|3,0,0]=4 143 B18R2.16177 O=C1Cc2c(ccnc2N1)SCCOCCO 62a_100011215305_100000104061 [0,1,0,0,0,0|3,0,0]=4 144 B18R2.16177 O=C1Cc2cccc(c2C1)SCCCCCF 62a_100010205903_100000729378 [0,1,0,0,0,0|3,0,0]=4 145 B18R2.16177 O=C1Cc2cccc(c2C1)SCCCCCO 62a_100010205903_100000746330 [0,1,0,0,0,0|3,0,0]=4 146 B18R2.16177 O=C1Cc2cccc(c2C1)SCCOCCO 62a_100010205903_100011215305 [0,1,0,0,0,0|3,0,0]=4 147 B18R2.16177 O=CCCCCSc1cccc2c1CC(=O)N2 62a_100000139335_100009816812 [0,1,0,0,0,0|2,0,1]=4 148 B18R2.123283 CCCCC(=Cc1cccc2c1CC(=O)N2)Br 271570a_206741709834_100009816812 [0,1,0,0,0,0|1,0,2]=4 149 B18R2.123283 CCCCC(C)Sc1cccc2c1CC(=O)C2 62a_100010205903_200011215066 [0,1,0,0,0,0|3,0,0]=4 150 B18R2.123283 CCCCC(C)Sc1cccc2c1CC(=O)N2 62a_200011215066_100009816812 [0,1,0,0,0,0|2,0,0]=3 151 B18R2.123283 CCCCC(C)Sc1ccnc2c1CC(=O)N2 62a_200011215066_100000104061 [0,1,0,0,0,0|3,0,0]=4 152 B18R2.123283 CCCNC(=O)Nc1cccc2c1oc(=O)[nH]2 2430a_100000093329_100020643023 [0,1,0,0,0,0|2,0,1]=4 153 B18R2.123283 CCCNC(=O)Nc1cccc2c1oc(=O)[nH]2 512a_100000093329_100020643023 [0,1,0,0,0,0|2,0,1]=4 154 B18R2.124423 CCCC(=O)CSc1cccc2c1CC(=O)C2 62a_100010205903_100000747444 [0,1,0,0,0,0|3,0,0]=4 155 B18R2.124423 CCCC(=O)CSc1cccc2c1CC(=O)N2 62a_100000747444_100009816812 [0,1,0,0,0,0|2,0,0]=3 156 B18R2.124423 CCCC(=O)CSc1ccnc2c1CC(=O)N2 62a_100000747444_100000104061 [0,1,0,0,0,0|3,0,0]=4 157 B18R2.124423 CCCC(C)CSc1cccc2c1CC(=O)C2 62a_100010205903_100011216630 [0,1,0,0,0,0|3,0,0]=4 158 B18R2.124423 CCCC(C)CSc1cccc2c1CC(=O)N2 62a_100011216630_100009816812 [0,1,0,0,0,0|2,0,0]=3 159 B18R2.124423 CCCC(C)CSc1ccnc2c1CC(=O)N2 62a_100011216630_100000104061 [0,1,0,0,0,0|3,0,0]=4 160 B18R2.124423 CCNC(=O)CSc1cccc2c1CC(=O)N2 62a_100000183381_100009816812 [0,1,0,0,0,0|3,0,0]=4 161 B18R2.124423 CCOC(=O)CSc1cccc2c1CC(=O)N2 62a_100000188475_100009816812 [0,1,0,0,0,0|3,0,0]=4 162 B18R2.124423 COCC(O)CSc1cccc2c1CC(=O)N2 62a_100011215053_100009816812 [0,1,0,0,0,0|3,0,0]=4 163 B18R2.268050 CCCCCSc1cccc2c1cc([nH]2)C=O 62a_100000210326_200010333833 [0,1,0,0,0,0|2,0,1]=4 164 B18R2.268094 CCCCCSc1cccc2c1C(=O)C(=O)N2 62a_100000210326_100000697038 [0,1,0,0,0,0|2,0,1]=4 165 B18R2.268094 CCCCCSc1cccc2c1C(=O)C(=O)N2 62a_100000697038_100000210326 [0,1,0,0,0,0|2,0,1]=4 166 B18R2.268094 CCCCCSc1cccc2c1n(c(=O)[nH]2)C 62a_100000210326_100010994120 [0,1,0,0,0,0|3,0,0]=4 167 B18R2.268258 CC/C=C\CSc1ccc(c2c1CC(=O)N2)F 62a_100103147603_100012355367 [0,1,0,0,0,0|2,0,1]=4 168 B18R2.268258 CCC#CCSc1ccc(c2c1CC(=O)N2)F 62a_100009813939_100012355367 [0,1,0,0,0,0|2,0,1]=4 169 B18R2.268258 CCCCC=Cc1ccc(c2c1CC(=O)N2)F 271570a_100016275911_100012355367 [0,1,0,0,0,0|1,0,2]=4 170 B18R2.268258 CCCCCSc1ccc(c2c1CC(=O)N2)F 62a_100000210326_100012355367 [0,1,0,0,0,0|2,0,0]=3 171 B18R2.268258 CCOCCSc1ccc(c2c1CC(=O)N2)F 62a_100000210147_100012355367 [0,1,0,0,0,0|3,0,0]=4 172 B18R2.268258 CCSCCSc1ccc(c2c1CC(=O)N2)F 62a_100000757381_100012355367 [0,1,0,0,0,0|3,0,0]=4 173 B18R2.268258 COCCCSc1ccc(c2c1CC(=O)N2)F 62a_100000709357_100012355367 [0,1,0,0,0,0|3,0,0]=4 174 B18R2.268258 O=C1Cc2c(ccc(c2N1)F)SCCCCF 62a_100000729493_100012355367 [0,1,0,0,0,0|3,0,0]=4 175 B18R2.268258 O=C1Cc2c(ccc(c2N1)F)SCCCCO 62a_100000210776_100012355367 [0,1,0,0,0,0|3,0,0]=4 176 B18R2.568535 CC/C=C\CSc1c(ccc2c1CC(=O)N2)C 62a_100103147603_100015548004 [0,1,0,0,0,0|2,0,1]=4 177 B18R2.568535 CCC#CCSc1c(ccc2c1CC(=O)N2)C 62a_100009813939_100015548004 [0,1,0,0,0,0|2,0,1]=4 178 B18R2.568535 CCCCC=Cc1c(ccc2c1CC(=O)N2)C 271570a_100016275911_100015548004 [0,1,0,0,0,0|1,0,2]=4 179 B18R2.568535 CCCCCSc1c(ccc2c1CC(=O)N2)C 62a_100000210326_100015548004 [0,1,0,0,0,0|2,0,0]=3 180 B18R2.568535 CCOCCSc1c(ccc2c1CC(=O)N2)C 62a_100000210147_100015548004 [0,1,0,0,0,0|3,0,0]=4 181 B18R2.568535 CCSCCSc1c(ccc2c1CC(=O)N2)C 62a_100000757381_100015548004 [0,1,0,0,0,0|3,0,0]=4 182 B18R2.568535 COCCCSc1c(ccc2c1CC(=O)N2)C 62a_100000709357_100015548004 [0,1,0,0,0,0|3,0,0]=4 183 B18R2.568535 Cc1ccc2c(c1SCCCCF)CC(=O)N2 62a_100000729493_100015548004 [0,1,0,0,0,0|3,0,0]=4 184 B18R2.568535 Cc1ccc2c(c1SCCCCO)CC(=O)N2 62a_100000210776_100015548004 [0,1,0,0,0,0|3,0,0]=4 185 B16R1.262 CC(=O)Nc1cccc(c1)C=NNCCO 4a_100000210001_100011257792 [0,0,1,0,0,0|2,0,1]=4 186 B16R1.262 CC(=O)Nc1cccc(c1)CNCCCF 207a_100015189416_100011257792 [0,0,1,0,0,0|3,0,0]=4 187 B16R1.262 CC(=O)Nc1cccc(c1)CNCCCF 2230a_100000740035_100011934791 [0,0,1,0,0,0|3,0,0]=4 188 B16R1.262 CC(=O)Nc1cccc(c1)CNCCCF 270004a_100015189416_100011257792 [0,0,1,0,0,0|3,0,0]=4 189 B16R1.262 CC(=O)Nc1cccc(c1)CNCCCF 34a_100000740035_100011934791 [0,0,1,0,0,0|3,0,0]=4 190 B16R1.262 CC(=O)Nc1cccc(c1)CNCCCO 207a_100000182051_100011257792 [0,0,1,0,0,0|3,0,0]=4 191 B16R1.262 CC(=O)Nc1cccc(c1)CNCCCO 2230a_100000740035_100000230001 [0,0,1,0,0,0|3,0,0]=4 192 B16R1.262 CC(=O)Nc1cccc(c1)CNCCCO 270004a_100000182051_100011257792 [0,0,1,0,0,0|3,0,0]=4 193 B16R1.262 CC(=O)Nc1cccc(c1)CNCCCO 34a_100000740035_100000230001 [0,0,1,0,0,0|3,0,0]=4 194 B16R1.262 CC(=O)Nc1cccc(c1)NCCCCF 34a_100000749408_100000729493 [0,0,1,0,0,0|3,0,0]=4 195 B16R1.262 CC(=O)Nc1cccc(c1)NCCCCO 34a_100000749408_100011216708 [0,0,1,0,0,0|3,0,0]=4 196 B16R1.262 CC(=O)Nc1cccc(c1)OCCCCF 34a_100000158604_100000729493 [0,0,1,0,0,0|3,0,0]=4 197 B16R1.262 CC(=O)Nc1cccc(c1)OCCCCF 7a_100000158604_100000729493 [0,0,1,0,0,0|3,0,0]=4 198 B16R1.262 CC(=O)Nc1cccc(c1)OCCCCO 34a_100000158604_100011216708 [0,0,1,0,0,0|3,0,0]=4 199 B16R1.262 CC(=O)Nc1cccc(c1)OCCCCO 7a_100000158604_100000210776 [0,0,1,0,0,0|3,0,0]=4 200 B16R1.262 CC(=O)Nc1cccc(c1)SCCCCF 62a_100000729493_100000153616 [0,0,1,0,0,0|3,0,0]=4 201 B16R1.262 CC(=O)Nc1cccc(c1)SCCCCO 62a_100000210776_100000153616 [0,0,1,0,0,0|3,0,0]=4 202 B16R1.262 CC/C=C\CNc1cccc(c1)NC(=O)C 34a_100000749408_100103147603 [0,0,1,0,0,0|2,0,1]=4 203 B16R1.262 CC/C=C\COc1cccc(c1)NC(=O)C 34a_100000158604_100103147603 [0,0,1,0,0,0|2,0,1]=4 204 B16R1.262 CC/C=C\COc1cccc(c1)NC(=O)C 7a_100000158604_100103147603 [0,0,1,0,0,0|2,0,1]=4 205 B16R1.262 CC/C=C\CSc1cccc(c1)NC(=O)C 62a_100103147603_100000153616 [0,0,1,0,0,0|2,0,1]=4 206 B16R1.262 CCC#CCNc1cccc(c1)NC(=O)C 34a_100000749408_100009813939 [0,0,1,0,0,0|2,0,1]=4 207 B16R1.262 CCC#CCOc1cccc(c1)NC(=O)C 34a_100000158604_100009813939 [0,0,1,0,0,0|2,0,1]=4 208 B16R1.262 CCC#CCOc1cccc(c1)NC(=O)C 7a_100000158604_100009813939 [0,0,1,0,0,0|2,0,1]=4 209 B16R1.262 CCC#CCSc1cccc(c1)NC(=O)C 62a_100009813939_100000153616 [0,0,1,0,0,0|2,0,1]=4 210 B16R1.262 CCCCC=Cc1cccc(c1)NC(=O)C 271570a_100016275911_100000153616 [0,0,1,0,0,0|1,0,2]=4 211 B16R1.262 CCCCCNc1cccc(c1)NC(=O)C 34a_100000749408_100000718602 [0,0,1,0,0,0|2,0,0]=3 212 B16R1.262 CCCCCNc1cccc(c1)NC(=O)N 34a_100000736001_100000718602 [0,0,1,0,0,0|3,0,0]=4 213 B16R1.262 CCCCCOc1cccc(c1)NC(=O)C 34a_100000158604_100000718602 [0,0,1,0,0,0|2,0,0]=3 214 B16R1.262 CCCCCOc1cccc(c1)NC(=O)C 7a_100000158604_100000210326 [0,0,1,0,0,0|2,0,0]=3 215 B16R1.262 CCCCCOc1cccc(c1)NC(=O)N 34a_100011219624_100000718602 [0,0,1,0,0,0|3,0,0]=4 216 B16R1.262 CCCCCOc1cccc(c1)NC(=O)N 7a_100011219624_100000210326 [0,0,1,0,0,0|3,0,0]=4 217 B16R1.262 CCCCCOc1cccc(c1)OC(=O)C 7a_100011218754_100000210326 [0,0,1,0,0,0|3,0,0]=4 218 B16R1.262 CCCCCSc1cc(ccn1)NC(=O)C 62a_100000210326_100000238608 [0,0,1,0,0,0|3,0,0]=4 219 B16R1.262 CCCCCSc1cccc(c1)CC(=O)C 62a_100000210326_100000689217 [0,0,1,0,0,0|3,0,0]=4 220 B16R1.262 CCCCCSc1cccc(c1)CC(=O)C 62a_100000689217_100000210326 [0,0,1,0,0,0|3,0,0]=4 221 B16R1.262 CCCCCSc1cccc(c1)NC(=O)C 62a_100000210326_100000153616 [0,0,1,0,0,0|2,0,0]=3 222 B16R1.262 CCCCCSc1cccc(c1)NC(=O)N 62a_100000210326_100000238923 [0,0,1,0,0,0|3,0,0]=4 223 B16R1.262 CCCCCSc1cccc(c1)OC(=O)C 62a_100000210326_100009811612 [0,0,1,0,0,0|3,0,0]=4 224 B16R1.262 CCCCCSc1cccc(n1)NC(=O)C 62a_100000210326_200011307899 [0,0,1,0,0,0|3,0,0]=4 225 B16R1.262 CCCCCSc1ccnc(c1)NC(=O)C 62a_100000210326_100012362434 [0,0,1,0,0,0|3,0,0]=4 226 B16R1.262 CCCCCSc1cncc(c1)NC(=O)C 62a_100000210326_100012351681 [0,0,1,0,0,0|3,0,0]=4 227 B16R1.262 CCCCNCc1cccc(c1)NC(=O)C 207a_100000102301_100011257792 [0,0,1,0,0,0|2,0,0]=3 228 B16R1.262 CCCCNCc1cccc(c1)NC(=O)C 2230a_100000740035_100000210211 [0,0,1,0,0,0|2,0,0]=3 229 B16R1.262 CCCCNCc1cccc(c1)NC(=O)C 270004a_100000102301_100011257792 [0,0,1,0,0,0|2,0,0]=3 230 B16R1.262 CCCCNCc1cccc(c1)NC(=O)C 34a_100000740035_100000210210 [0,0,1,0,0,0|2,0,0]=3 231 B16R1.262 CCCCNCc1cccc(c1)OC(=O)C 207a_100000102301_100000014719 [0,0,1,0,0,0|3,0,0]=4 232 B16R1.262 CCCCNCc1cccc(c1)OC(=O)C 2230a_100000102301_200009816940 [0,0,1,0,0,0|3,0,0]=4 233 B16R1.262 CCCCNCc1cccc(c1)OC(=O)C 270004a_100000102301_100000014719 [0,0,1,0,0,0|3,0,0]=4 234 B16R1.262 CCCCNCc1cccc(c1)OC(=O)C 7a_106832991798_200009816940 [0,0,1,0,0,0|3,0,0]=4 235 B16R1.262 CCCCOCc1cccc(c1)OC(=O)C 34a_100000210227_200009816940 [0,0,1,0,0,0|3,0,0]=4 236 B16R1.262 CCCCOCc1cccc(c1)OC(=O)C 7a_100000210227_200009816940 [0,0,1,0,0,0|3,0,0]=4 237 B16R1.262 CCCCSCc1cccc(c1)OC(=O)C 62a_100000210211_200009816940 [0,0,1,0,0,0|3,0,0]=4 238 B16R1.262 CCCCSCc1cccc(c1)OC(=O)C 62a_200009816940_100000210210 [0,0,1,0,0,0|3,0,0]=4 239 B16R1.262 CCCNN=Cc1cccc(c1)NC(=O)C 4a_100000740057_100011257792 [0,0,1,0,0,0|1,0,1]=3 240 B16R1.262 CCCNN=Cc1cccc(c1)OC(=O)C 4a_100000740057_100000014719 [0,0,1,0,0,0|2,0,1]=4 241 B16R1.262 CCOCCNc1cccc(c1)NC(=O)C 34a_100000749408_100000210147 [0,0,1,0,0,0|3,0,0]=4 242 B16R1.262 CCOCCOc1cccc(c1)NC(=O)C 34a_100000158604_100000210147 [0,0,1,0,0,0|3,0,0]=4 243 B16R1.262 CCOCCOc1cccc(c1)NC(=O)C 7a_100000158604_100011215890 [0,0,1,0,0,0|3,0,0]=4 244 B16R1.262 CCOCCSc1cccc(c1)NC(=O)C 62a_100000210147_100000153616 [0,0,1,0,0,0|3,0,0]=4 245 B16R1.262 CCSCCNc1cccc(c1)NC(=O)C 34a_100000749408_100000757381 [0,0,1,0,0,0|3,0,0]=4 246 B16R1.262 CCSCCOc1cccc(c1)NC(=O)C 34a_100000158604_100000757381 [0,0,1,0,0,0|3,0,0]=4 247 B16R1.262 CCSCCOc1cccc(c1)NC(=O)C 7a_100000158604_100000757381 [0,0,1,0,0,0|3,0,0]=4 248 B16R1.262 CCSCCSc1cccc(c1)NC(=O)C 62a_100000757381_100000153616 [0,0,1,0,0,0|3,0,0]=4 249 B16R1.262 COCCCNc1cccc(c1)NC(=O)C 34a_100000749408_100000740836 [0,0,1,0,0,0|3,0,0]=4 250 B16R1.262 COCCCOc1cccc(c1)NC(=O)C 34a_100000158604_100000740836 [0,0,1,0,0,0|3,0,0]=4 251 B16R1.262 COCCCOc1cccc(c1)NC(=O)C 7a_100000158604_100000740836 [0,0,1,0,0,0|3,0,0]=4 252 B16R1.262 COCCCSc1cccc(c1)NC(=O)C 62a_100000709357_100000153616 [0,0,1,0,0,0|3,0,0]=4 253 B16R1.262 COCCNCc1cccc(c1)NC(=O)C 207a_100000209980_100011257792 [0,0,1,0,0,0|3,0,0]=4 254 B16R1.262 COCCNCc1cccc(c1)NC(=O)C 2230a_100000740035_100011201679 [0,0,1,0,0,0|3,0,0]=4 255 B16R1.262 COCCNCc1cccc(c1)NC(=O)C 270004a_100000209980_100011257792 [0,0,1,0,0,0|3,0,0]=4 256 B16R1.262 COCCNCc1cccc(c1)NC(=O)C 34a_100000740035_100011201679 [0,0,1,0,0,0|3,0,0]=4 257 B16R1.262 CSCCNCc1cccc(c1)NC(=O)C 207a_100020590264_100011257792 [0,0,1,0,0,0|3,0,0]=4 258 B16R1.262 CSCCNCc1cccc(c1)NC(=O)C 2230a_100000740035_100000751147 [0,0,1,0,0,0|3,0,0]=4 259 B16R1.262 CSCCNCc1cccc(c1)NC(=O)C 270004a_100020590264_100011257792 [0,0,1,0,0,0|3,0,0]=4 260 B16R1.262 CSCCNCc1cccc(c1)NC(=O)C 34a_100000740035_100000212216 [0,0,1,0,0,0|3,0,0]=4 261 B16R1.270 CC/C=C\CSc1ccccc1CC(=O)N 62a_100103147603_200009814924 [0,0,1,0,0,0|2,0,1]=4 262 B16R1.270 CC/C=C\CSc1ccccc1CC(=O)N 62a_200009814924_100103147603 [0,0,1,0,0,0|2,0,1]=4 263 B16R1.270 CCC#CCSc1ccccc1CC(=O)N 62a_100009813939_200009814924 [0,0,1,0,0,0|2,0,1]=4 264 B16R1.270 CCC#CCSc1ccccc1CC(=O)N 62a_200009814924_100009813939 [0,0,1,0,0,0|2,0,1]=4 265 B16R1.270 CCCCC=Cc1ccccc1CC(=O)N 271570a_100016275911_200009814924 [0,0,1,0,0,0|1,0,2]=4 266 B16R1.270 CCCCCSc1ccccc1CC(=O)C 62a_100000210326_100011350739 [0,0,1,0,0,0|3,0,0]=4 267 B16R1.270 CCCCCSc1ccccc1CC(=O)C 62a_100011350739_100000210326 [0,0,1,0,0,0|3,0,0]=4 268 B16R1.270 CCCCCSc1ccccc1CC(=O)N 62a_100000210326_200009814924 [0,0,1,0,0,0|2,0,0]=3 269 B16R1.270 CCCCCSc1ccccc1CC(=O)N 62a_200009814924_100000210326 [0,0,1,0,0,0|2,0,0]=3 270 B16R1.270 CCCCCSc1ccccc1NC(=O)N 62a_100000210326_100000742221 [0,0,1,0,0,0|3,0,0]=4 271 B16R1.270 CCCCNCc1ccccc1CC(=O)O 269956a_100000688124_100000210211 [0,0,1,0,0,0|3,0,0]=4 272 B16R1.270 CCOCCSc1ccccc1CC(=O)N 62a_100000210147_200009814924 [0,0,1,0,0,0|3,0,0]=4 273 B16R1.270 CCOCCSc1ccccc1CC(=O)N 62a_200009814924_100011215890 [0,0,1,0,0,0|3,0,0]=4 274 B16R1.270 CCSCCSc1ccccc1CC(=O)N 62a_100000757381_200009814924 [0,0,1,0,0,0|3,0,0]=4 275 B16R1.270 CCSCCSc1ccccc1CC(=O)N 62a_200009814924_100000757381 [0,0,1,0,0,0|3,0,0]=4 276 B16R1.270 COCCCSc1ccccc1CC(=O)N 62a_100000709357_200009814924 [0,0,1,0,0,0|3,0,0]=4 277 B16R1.270 COCCCSc1ccccc1CC(=O)N 62a_200009814924_100000709357 [0,0,1,0,0,0|3,0,0]=4 278 B16R1.270 NC(=O)Cc1ccccc1SCCCCF 62a_100000729493_200009814924 [0,0,1,0,0,0|3,0,0]=4 279 B16R1.270 NC(=O)Cc1ccccc1SCCCCF 62a_200009814924_100000729493 [0,0,1,0,0,0|3,0,0]=4 280 B16R1.270 NC(=O)Cc1ccccc1SCCCCO 62a_100000210776_200009814924 [0,0,1,0,0,0|3,0,0]=4 281 B16R1.270 NC(=O)Cc1ccccc1SCCCCO 62a_200009814924_100000210776 [0,0,1,0,0,0|3,0,0]=4 282 B18R3.213 O=C1Cc2c(cccc2C3=CCCCC3)N1 271570a_100000062251_100009816812 [0,0,0,1,0,0|1,0,2]=4 283 B18R3.213 O=C1Cc2c(cccc2C3=COCCC3)N1 271570a_100010175576_100009816812 [0,0,0,1,0,0|1,0,2]=4 284 B18R3.6952 O=C1Cc2c(cccc2N1)C=C3CCCC3 271570a_100010378317_100009816812 [0,0,0,1,0,0|1,0,2]=4 285 B18R3.6952 O=C1Cc2c(cccc2SC3CCCC3)N1 62a_100011217020_100009816812 [0,0,0,1,0,0|2,0,0]=3 286 B18R3.6952 O=C1Cc2c(ccnc2N1)SC3CCCC3 62a_100011217020_100000104061 [0,0,0,1,0,0|3,0,0]=4 287 B18R3.6952 O=C1Cc2cccc(c2C1)SC3CCCC3 62a_100010205903_100000179811 [0,0,0,1,0,0|3,0,0]=4 288 B18R3.106442 O=C1Cc2c(cccc2SCCC3CC3)N1 62a_100000764125_100009816812 [0,0,0,1,0,0|2,0,0]=3 289 B18R3.106442 O=C1Cc2c(cccc2SCCC3CO3)N1 62a_100000732470_100009816812 [0,0,0,1,0,0|3,0,0]=4 290 B18R3.106442 O=C1Cc2c(ccnc2N1)SCCC3CC3 62a_100000764125_100000104061 [0,0,0,1,0,0|3,0,0]=4 291 B18R3.106442 O=C1Cc2cccc(c2C1)SCCC3CC3 62a_100010205903_100000764125 [0,0,0,1,0,0|3,0,0]=4 292 B18R3.106447 O=C1Cc2c(cccc2SCC3CCC3)N1 62a_100000763275_100009816812 [0,0,0,1,0,0|2,0,0]=3 293 B18R3.106447 O=C1Cc2c(cccc2SCC3CCO3)N1 62a_100000103362_100009816812 [0,0,0,1,0,0|3,0,0]=4 294 B18R3.106447 O=C1Cc2c(cccc2SCC3COC3)N1 62a_100010264016_100009816812 [0,0,0,1,0,0|3,0,0]=4 295 B18R3.106447 O=C1Cc2c(ccnc2N1)SCC3CCC3 62a_100000763275_100000104061 [0,0,0,1,0,0|3,0,0]=4 296 B18R3.106447 O=C1Cc2cccc(c2C1)SCC3CCC3 62a_100010205903_100000763275 [0,0,0,1,0,0|3,0,0]=4 297 B18R2.30191 CC/C=C\COc1cccc2c1CCC(=O)N2 34a_100000066681_100103147603 [0,0,0,0,0,1|2,0,1]=4 298 B18R2.30191 CC/C=C\COc1cccc2c1CCC(=O)N2 7a_100000066681_100103147603 [0,0,0,0,0,1|2,0,1]=4 299 B18R2.30191 CC/C=C\CSc1cccc2c1CCC(=O)N2 62a_100010232564_100103147603 [0,0,0,0,0,1|2,0,1]=4 300 B18R2.30191 CC/C=C\CSc1cccc2c1CCC(=O)N2 62a_100103147603_100010232564 [0,0,0,0,0,1|2,0,1]=4 301 B18R2.30191 CCC#CCOc1cccc2c1CCC(=O)N2 34a_100000066681_100009813939 [0,0,0,0,0,1|2,0,1]=4 302 B18R2.30191 CCC#CCOc1cccc2c1CCC(=O)N2 7a_100000066681_100009813939 [0,0,0,0,0,1|2,0,1]=4 303 B18R2.30191 CCC#CCSc1cccc2c1CCC(=O)N2 62a_100009813939_100010232564 [0,0,0,0,0,1|2,0,1]=4 304 B18R2.30191 CCC#CCSc1cccc2c1CCC(=O)N2 62a_100010232564_100009813939 [0,0,0,0,0,1|2,0,1]=4 305 B18R2.30191 CCCCC=Cc1cccc2c1CCC(=O)N2 271570a_100016275911_100010232564 [0,0,0,0,0,1|1,0,2]=4 306 B18R2.30191 CCCCC=Cc1cccc2c1OCC(=O)N2 271570a_100016275911_100012355675 [0,0,0,0,0,1|1,0,2]=4 307 B18R2.30191 CCCCCOc1cccc2c1CCC(=O)N2 34a_100000066681_100000718602 [0,0,0,0,0,1|2,0,0]=3 308 B18R2.30191 CCCCCOc1cccc2c1CCC(=O)N2 7a_100000066681_100000210326 [0,0,0,0,0,1|2,0,0]=3 309 B18R2.30191 CCCCCSc1cccc2c1CCC(=O)C2 62a_100000210326_100010138409 [0,0,0,0,0,1|3,0,0]=4 310 B18R2.30191 CCCCCSc1cccc2c1CCC(=O)C2 62a_100010138409_100000210326 [0,0,0,0,0,1|3,0,0]=4 311 B18R2.30191 CCCCCSc1cccc2c1CCC(=O)N2 62a_100000210326_100010232564 [0,0,0,0,0,1|2,0,0]=3 312 B18R2.30191 CCCCCSc1cccc2c1CCC(=O)N2 62a_100010232564_100000210326 [0,0,0,0,0,1|2,0,0]=3 313 B18R2.30191 CCCCCSc1cccc2c1CCC(=O)O2 62a_100000210326_200015620928 [0,0,0,0,0,1|3,0,0]=4 314 B18R2.30191 CCCCCSc1cccc2c1CCC(=O)O2 62a_200015620928_100000210326 [0,0,0,0,0,1|3,0,0]=4 315 B18R2.30191 CCCCCSc1cccc2c1ccc(=O)[nH]2 62a_100000210326_100000726145 [0,0,0,0,0,1|2,0,1]=4 316 B18R2.30191 CCCCCSc1nccc2c1OCC(=O)N2 62a_100000210326_100009863569 [0,0,0,0,0,1|3,0,0]=4 317 B18R2.30191 CCOCCOc1cccc2c1CCC(=O)N2 34a_100000066681_100000210147 [0,0,0,0,0,1|3,0,0]=4 318 B18R2.30191 CCOCCOc1cccc2c1CCC(=O)N2 7a_100000066681_100011215890 [0,0,0,0,0,1|3,0,0]=4 319 B18R2.30191 CCOCCSc1cccc2c1CCC(=O)N2 62a_100000210147_100010232564 [0,0,0,0,0,1|3,0,0]=4 320 B18R2.30191 CCOCCSc1cccc2c1CCC(=O)N2 62a_100010232564_100011215890 [0,0,0,0,0,1|3,0,0]=4 321 B18R2.30191 CCSCCOc1cccc2c1CCC(=O)N2 34a_100000066681_100000757381 [0,0,0,0,0,1|3,0,0]=4 322 B18R2.30191 CCSCCOc1cccc2c1CCC(=O)N2 7a_100000066681_100000757381 [0,0,0,0,0,1|3,0,0]=4 323 B18R2.30191 CCSCCSc1cccc2c1CCC(=O)N2 62a_100000757381_100010232564 [0,0,0,0,0,1|3,0,0]=4 324 B18R2.30191 CCSCCSc1cccc2c1CCC(=O)N2 62a_100010232564_100000757381 [0,0,0,0,0,1|3,0,0]=4 325 B18R2.30191 COCCCOc1cccc2c1CCC(=O)N2 34a_100000066681_100000740836 [0,0,0,0,0,1|3,0,0]=4 326 B18R2.30191 COCCCOc1cccc2c1CCC(=O)N2 7a_100000066681_100000740836 [0,0,0,0,0,1|3,0,0]=4 327 B18R2.30191 COCCCSc1cccc2c1CCC(=O)N2 62a_100000709357_100010232564 [0,0,0,0,0,1|3,0,0]=4 328 B18R2.30191 COCCCSc1cccc2c1CCC(=O)N2 62a_100010232564_100000709357 [0,0,0,0,0,1|3,0,0]=4 329 B18R2.30191 O=C1CCc2c(cccc2OCCCCF)N1 34a_100000066681_100000729493 [0,0,0,0,0,1|3,0,0]=4 330 B18R2.30191 O=C1CCc2c(cccc2OCCCCF)N1 7a_100000066681_100000729493 [0,0,0,0,0,1|3,0,0]=4 331 B18R2.30191 O=C1CCc2c(cccc2OCCCCO)N1 34a_100000066681_100011216708 [0,0,0,0,0,1|3,0,0]=4 332 B18R2.30191 O=C1CCc2c(cccc2OCCCCO)N1 7a_100000066681_100000210776 [0,0,0,0,0,1|3,0,0]=4 333 B18R2.30191 O=C1CCc2c(cccc2SCCCCF)N1 62a_100000729493_100010232564 [0,0,0,0,0,1|3,0,0]=4 334 B18R2.30191 O=C1CCc2c(cccc2SCCCCF)N1 62a_100010232564_100000729493 [0,0,0,0,0,1|3,0,0]=4 335 B18R2.30191 O=C1CCc2c(cccc2SCCCCO)N1 62a_100000210776_100010232564 [0,0,0,0,0,1|3,0,0]=4 336 B18R2.30191 O=C1CCc2c(cccc2SCCCCO)N1 62a_100010232564_100000210776 [0,0,0,0,0,1|3,0,0]=4 337 B18R2.268087 CCCCCSc1cccc2c1CC(=O)CC2 62a_100010006498_100000210326 [0,0,0,0,0,1|3,0,0]=4 338 B15R1.236 CC=Cc1cccc(c1)CCCCCC 271570a_100016259895_100009816010 [1,0,1,0,0,0|2,0,0]=4 339 B15R1.236 CCCNCCc1cccc(c1)OCC 2230a_100138557038_100000210303 [1,0,1,0,0,0|1,0,1]=4 340 B15R1.236 CCCNCCc1cccc(c1)OCC 34a_100138557038_100000210303 [1,0,1,0,0,0|1,0,1]=4 341 B15R1.1180 C#CCNCc1cccc(c1)NC(=O)C 2230a_100000740035_100000038162 [1,0,1,0,0,0|0,0,2]=4 342 B15R1.1180 C#CCNCc1cccc(c1)NC(=O)C 34a_100000740035_100000184674 [1,0,1,0,0,0|0,0,2]=4 343 B15R1.1180 C=CCNCc1cccc(c1)NC(=O)C 2230a_100000740035_100000210623 [1,0,1,0,0,0|0,0,2]=4 344 B15R1.1180 C=CCNCc1cccc(c1)NC(=O)C 270004a_100020586998_100011257792 [1,0,1,0,0,0|0,0,2]=4 345 B15R1.1180 C=CCNCc1cccc(c1)NC(=O)C 34a_100000740035_100015514636 [1,0,1,0,0,0|0,0,2]=4 346 B15R1.1180 CC(=O)Nc1cccc(c1)CNCC#N 2230a_100000740035_100011215382 [1,0,1,0,0,0|1,0,1]=4 347 B15R1.1180 CC(=O)Nc1cccc(c1)CNCC=O 2230a_100000740035_200015260668 [1,0,1,0,0,0|1,0,1]=4 348 B15R1.1180 CC(=O)Nc1cccc(c1)CNCC=O 34a_100000740035_200009817547 [1,0,1,0,0,0|1,0,1]=4 349 B15R1.1180 CC(=O)Nc1cccc(c1)CNCCF 2230a_100000740035_100011217306 [1,0,1,0,0,0|1,0,0]=3 350 B15R1.1180 CC(=O)Nc1cccc(c1)CNCCF 34a_100000740035_100011217306 [1,0,1,0,0,0|1,0,0]=3 351 B15R1.1180 CC(=O)Nc1cccc(c1)CNCCO 207a_100000210304_100011257792 [1,0,1,0,0,0|1,0,0]=3 352 B15R1.1180 CC(=O)Nc1cccc(c1)CNCCO 2230a_100000740035_100000211926 [1,0,1,0,0,0|1,0,0]=3 353 B15R1.1180 CC(=O)Nc1cccc(c1)CNCCO 270004a_100000210304_100011257792 [1,0,1,0,0,0|1,0,0]=3 354 B15R1.1180 CC(=O)Nc1cccc(c1)CNCCO 34a_100000740035_100000211926 [1,0,1,0,0,0|1,0,0]=3 355 B15R1.1180 CC(=O)Nc1cccc(c1)NCCCF 34a_100000749408_100011934791 [1,0,1,0,0,0|2,0,0]=4 356 B15R1.1180 CC(=O)Nc1cccc(c1)NCCCO 34a_100000749408_100000230001 [1,0,1,0,0,0|2,0,0]=4 357 B15R1.1180 CC(=O)Nc1cccc(c1)OCCCF 34a_100000158604_100011934791 [1,0,1,0,0,0|2,0,0]=4 358 B15R1.1180 CC(=O)Nc1cccc(c1)OCCCF 7a_100000158604_100011934791 [1,0,1,0,0,0|2,0,0]=4 359 B15R1.1180 CC(=O)Nc1cccc(c1)OCCCO 34a_100000158604_100000230001 [1,0,1,0,0,0|2,0,0]=4 360 B15R1.1180 CC(=O)Nc1cccc(c1)OCCCO 7a_100000158604_100011215043 [1,0,1,0,0,0|2,0,0]=4 361 B15R1.1180 CC(=O)Nc1cccc(c1)SCCCF 62a_100011934791_100000153616 [1,0,1,0,0,0|2,0,0]=4 362 B15R1.1180 CC(=O)Nc1cccc(c1)SCCCO 62a_100011215043_100000153616 [1,0,1,0,0,0|2,0,0]=4 363 B15R1.1180 CC(=O)Oc1cccc(c1)CNCCF 34a_100000724931_200009816940 [1,0,1,0,0,0|2,0,0]=4 364 B15R1.1180 CC(=O)Oc1cccc(c1)CNCCO 207a_100000210304_100000014719 [1,0,1,0,0,0|2,0,0]=4 365 B15R1.1180 CC(=O)Oc1cccc(c1)CNCCO 2230a_100016997473_200009816940 [1,0,1,0,0,0|2,0,0]=4 366 B15R1.1180 CC(=O)Oc1cccc(c1)CNCCO 270004a_100000210304_100000014719 [1,0,1,0,0,0|2,0,0]=4 367 B15R1.1180 CC(=O)Oc1cccc(c1)CNCCO 34a_100016990907_200009816940 [1,0,1,0,0,0|2,0,0]=4 368 B15R1.1180 CCCC=Cc1cccc(c1)NC(=O)C 271570a_100016258520_100000153616 [1,0,1,0,0,0|0,0,2]=4 369 B15R1.1180 CCCCNc1cccc(c1)NC(=O)C 34a_100000749408_100000210210 [1,0,1,0,0,0|1,0,0]=3 370 B15R1.1180 CCCCNc1cccc(c1)NC(=O)N 34a_100000736001_100000210210 [1,0,1,0,0,0|2,0,0]=4 371 B15R1.1180 CCCCOc1cccc(c1)NC(=O)C 11a_100000744072_100015343762 [1,0,1,0,0,0|1,0,0]=3 372 B15R1.1180 CCCCOc1cccc(c1)NC(=O)C 1626a_100000744072_100015343762 [1,0,1,0,0,0|1,0,0]=3 373 B15R1.1180 CCCCOc1cccc(c1)NC(=O)C 22a_100000744072_100000070787 [1,0,1,0,0,0|1,0,0]=3 374 B15R1.1180 CCCCOc1cccc(c1)NC(=O)C 34a_100000158604_100000210210 [1,0,1,0,0,0|1,0,0]=3 375 B15R1.1180 CCCCOc1cccc(c1)NC(=O)C 527a_100000744072_100103153847 [1,0,1,0,0,0|1,0,0]=3 376 B15R1.1180 CCCCOc1cccc(c1)NC(=O)C 7a_100000158604_100000210211 [1,0,1,0,0,0|1,0,0]=3 377 B15R1.1180 CCCCOc1cccc(c1)NC(=O)N 34a_100011219624_100000210210 [1,0,1,0,0,0|2,0,0]=4 378 B15R1.1180 CCCCOc1cccc(c1)NC(=O)N 7a_100011219624_100000210211 [1,0,1,0,0,0|2,0,0]=4 379 B15R1.1180 CCCCOc1cccc(c1)OC(=O)C 7a_100011218754_100000210211 [1,0,1,0,0,0|2,0,0]=4 380 B15R1.1180 CCCCSc1cc(ccn1)NC(=O)C 62a_100000210211_100000238608 [1,0,1,0,0,0|2,0,0]=4 381 B15R1.1180 CCCCSc1cccc(c1)CC(=O)C 62a_100000210211_100000689217 [1,0,1,0,0,0|2,0,0]=4 382 B15R1.1180 CCCCSc1cccc(c1)CC(=O)C 62a_100000689217_100000210210 [1,0,1,0,0,0|2,0,0]=4 383 B15R1.1180 CCCCSc1cccc(c1)NC(=O)C 62a_100000210211_100000153616 [1,0,1,0,0,0|1,0,0]=3 384 B15R1.1180 CCCCSc1cccc(c1)NC(=O)N 62a_100000210211_100000238923 [1,0,1,0,0,0|2,0,0]=4 385 B15R1.1180 CCCCSc1cccc(c1)OC(=O)C 62a_100000210211_100009811612 [1,0,1,0,0,0|2,0,0]=4 386 B15R1.1180 CCCCSc1cccc(n1)NC(=O)C 62a_100000210211_200011307899 [1,0,1,0,0,0|2,0,0]=4 387 B15R1.1180 CCCCSc1ccnc(c1)NC(=O)C 62a_100000210211_100012362434 [1,0,1,0,0,0|2,0,0]=4 388 B15R1.1180 CCCCSc1cncc(c1)NC(=O)C 62a_100000210211_100012351681 [1,0,1,0,0,0|2,0,0]=4 389 B15R1.1180 CCCNCc1cccc(c1)C=C(C)C 271570a_100102525489_100015184641 [1,0,1,0,0,0|2,0,0]=4 390 B15R1.1180 CCCNCc1cccc(c1)NC(=O)C 207a_100020643023_100011257792 [1,0,1,0,0,0|0,0,0]=2 391 B15R1.1180 CCCNCc1cccc(c1)NC(=O)C 2230a_100000740035_100000210303 [1,0,1,0,0,0|0,0,0]=2 392 B15R1.1180 CCCNCc1cccc(c1)NC(=O)C 270004a_100020643023_100011257792 [1,0,1,0,0,0|0,0,0]=2 393 B15R1.1180 CCCNCc1cccc(c1)NC(=O)C 34a_100000740035_100000210303 [1,0,1,0,0,0|0,0,0]=2 394 B15R1.1180 CCCNCc1cccc(c1)OC(=O)C 207a_100020643023_100000014719 [1,0,1,0,0,0|1,0,0]=3 395 B15R1.1180 CCCNCc1cccc(c1)OC(=O)C 270004a_100020643023_100000014719 [1,0,1,0,0,0|1,0,0]=3 396 B15R1.1180 CCCOCc1cccc(c1)OC(=O)C 34a_100000210258_200009816940 [1,0,1,0,0,0|2,0,0]=4 397 B15R1.1180 CCCSCc1cccc(c1)OC(=O)C 62a_100000210303_200009816940 [1,0,1,0,0,0|2,0,0]=4 398 B15R1.1180 CCCSCc1cccc(c1)OC(=O)C 62a_200009816940_100000210303 [1,0,1,0,0,0|2,0,0]=4 399 B15R1.1180 CCNN=Cc1cccc(c1)NC(=O)C 4a_100000756455_100011257792 [1,0,1,0,0,0|1,0,1]=4 400 B15R1.1180 CCOCSc1cccc(c1)NC(=O)C 62a_100000739092_100000153616 [1,0,1,0,0,0|2,0,0]=4 401 B15R1.1180 COCCNc1cccc(c1)NC(=O)C 34a_100000749408_100011201679 [1,0,1,0,0,0|2,0,0]=4 402 B15R1.1180 COCCOc1cccc(c1)NC(=O)C 11a_100000742008_100015343762 [1,0,1,0,0,0|2,0,0]=4 403 B15R1.1180 COCCOc1cccc(c1)NC(=O)C 1626a_100000742008_100015343762 [1,0,1,0,0,0|2,0,0]=4 404 B15R1.1180 COCCOc1cccc(c1)NC(=O)C 22a_100000742008_100000070787 [1,0,1,0,0,0|2,0,0]=4 405 B15R1.1180 COCCOc1cccc(c1)NC(=O)C 34a_100000158604_100011201679 [1,0,1,0,0,0|2,0,0]=4 406 B15R1.1180 COCCOc1cccc(c1)NC(=O)C 527a_100000742008_100103153847 [1,0,1,0,0,0|2,0,0]=4 407 B15R1.1180 COCCOc1cccc(c1)NC(=O)C 7a_100000158604_100000233755 [1,0,1,0,0,0|2,0,0]=4 408 B15R1.1180 COCCSc1cccc(c1)NC(=O)C 62a_100000233755_100000153616 [1,0,1,0,0,0|2,0,0]=4 409 B15R1.1180 COCNCc1cccc(c1)NC(=O)C 2230a_100000740035_100000766300 [1,0,1,0,0,0|1,0,0]=3 410 B15R1.1180 CSCCNc1cccc(c1)NC(=O)C 34a_100000749408_100000212216 [1,0,1,0,0,0|2,0,0]=4 411 B15R1.1180 CSCCOc1cccc(c1)NC(=O)C 34a_100000158604_100000212216 [1,0,1,0,0,0|2,0,0]=4 412 B15R1.1180 CSCCOc1cccc(c1)NC(=O)C 7a_100000158604_100000212216 [1,0,1,0,0,0|2,0,0]=4 413 B15R1.1180 CSCCSc1cccc(c1)NC(=O)C 62a_100000212216_100000153616 [1,0,1,0,0,0|2,0,0]=4 414 B15R1.1180 CSCNCc1cccc(c1)NC(=O)C 2230a_100000740035_100011218213 [1,0,1,0,0,0|1,0,0]=3 415 B15R1.1180 CSCNCc1cccc(c1)NC(=O)C 34a_100000740035_100011218213 [1,0,1,0,0,0|1,0,0]=3 416 B15R1.238 CCCCCSc1cccc(c1C)C=O 62a_100000210326_100012179384 [1,0,1,0,0,0|2,0,0]=4 417 B15R1.238 CCCCCSc1cccc(c1C)C=O 62a_100012179384_100000210326 [1,0,1,0,0,0|2,0,0]=4 418 B15R1.1188 CCCC=Cc1ccccc1CC(=O)N 271570a_100016258520_200009814924 [1,0,1,0,0,0|0,0,2]=4 419 B15R1.1188 CCCCSc1ccccc1CC(=O)C 62a_100000210211_100011350739 [1,0,1,0,0,0|2,0,0]=4 420 B15R1.1188 CCCCSc1ccccc1CC(=O)C 62a_100011350739_100000210210 [1,0,1,0,0,0|2,0,0]=4 421 B15R1.1188 CCCCSc1ccccc1CC(=O)N 62a_100000210211_200009814924 [1,0,1,0,0,0|1,0,0]=3 422 B15R1.1188 CCCCSc1ccccc1CC(=O)N 62a_200009814924_100000210210 [1,0,1,0,0,0|1,0,0]=3 423 B15R1.1188 CCCCSc1ccccc1NC(=O)N 62a_100000210211_100000742221 [1,0,1,0,0,0|2,0,0]=4 424 B15R1.1188 CCCNCc1ccccc1CC(=O)O 269956a_100000688124_100000210207 [1,0,1,0,0,0|1,0,0]=3 425 B15R1.1188 CCCNCc1ccccc1OC(=O)C 270004a_100020643023_100009864558 [1,0,1,0,0,0|2,0,0]=4 426 B15R1.1188 CCOCSc1ccccc1CC(=O)N 62a_100000739092_200009814924 [1,0,1,0,0,0|2,0,0]=4 427 B15R1.1188 CCOCSc1ccccc1CC(=O)N 62a_200009814924_100000739092 [1,0,1,0,0,0|2,0,0]=4 428 B15R1.1188 COCCSc1ccccc1CC(=O)N 62a_100000233755_200009814924 [1,0,1,0,0,0|2,0,0]=4 429 B15R1.1188 COCCSc1ccccc1CC(=O)N 62a_200009814924_100000233755 [1,0,1,0,0,0|2,0,0]=4 430 B15R1.1188 COCNCc1ccccc1CC(=O)O 269956a_100000688124_100000766300 [1,0,1,0,0,0|2,0,0]=4 431 B15R1.1188 CSCCSc1ccccc1CC(=O)N 62a_100000212216_200009814924 [1,0,1,0,0,0|2,0,0]=4 432 B15R1.1188 CSCCSc1ccccc1CC(=O)N 62a_200009814924_100000751147 [1,0,1,0,0,0|2,0,0]=4 433 B15R1.1188 CSCNCc1ccccc1CC(=O)O 269956a_100000688124_100011218213 [1,0,1,0,0,0|2,0,0]=4 434 B15R1.1188 NC(=O)Cc1ccccc1SCCCF 62a_100011934791_200009814924 [1,0,1,0,0,0|2,0,0]=4 435 B15R1.1188 NC(=O)Cc1ccccc1SCCCF 62a_200009814924_100011934791 [1,0,1,0,0,0|2,0,0]=4 436 B15R1.1188 NC(=O)Cc1ccccc1SCCCO 62a_100011215043_200009814924 [1,0,1,0,0,0|2,0,0]=4 437 B15R1.1188 NC(=O)Cc1ccccc1SCCCO 62a_200009814924_100011215043 [1,0,1,0,0,0|2,0,0]=4 438 B15R1.1188 O=C(O)Cc1ccccc1CNCCF 269956a_100000688124_100011217306 [1,0,1,0,0,0|2,0,0]=4 439 B15R1.1188 O=C(O)Cc1ccccc1CNCCO 269956a_100000688124_100000211926 [1,0,1,0,0,0|2,0,0]=4 440 B15R1.9497 CCCCCSc1cccc(c1C=O)N 62a_100010232536_100000210326 [1,0,1,0,0,0|2,0,0]=4 441 B15R2.1453 CCCCc1cccc2c1CC(=C2)C 271570a_100020621405_100010271545 [2,0,0,0,0,0|2,0,0]=4 442 B15R2.1453 CCCCc1cccc2c1CC(=O)C2 271570a_100020621405_100010205903 [2,0,0,0,0,0|1,0,0]=3 443 B15R2.1453 CCCCc1cccc2c1CC(=O)N2 271570a_100020621405_100009816812 [2,0,0,0,0,0|0,0,0]=2 444 B15R2.1453 CCCCc1cccc2c1NC(=O)C2 271570a_100020621405_100000767046 [2,0,0,0,0,0|2,0,0]=4 445 B15R2.1453 CCCCc1cccc2c1cc([nH]2)C 271570a_100020621405_100010143266 [2,0,0,0,0,0|1,0,1]=4 446 B15R2.1453 CCCCc1cccc2c1nc([nH]2)C 271570a_100020621405_100012360556 [2,0,0,0,0,0|2,0,0]=4 447 B15R2.1453 CCCCc1cccc2c1nc([nH]2)N 271570a_100020621405_100012356985 [2,0,0,0,0,0|2,0,0]=4 448 B15R2.1453 CCCCc1cccc2c1nc([nH]2)O 271570a_100020621405_100012347640 [2,0,0,0,0,0|1,0,1]=4 449 B15R2.1453 CCCCc1cccc2c1oc(=O)[nH]2 271570a_100020621405_100012360093 [2,0,0,0,0,0|1,0,0]=3 450 B15R2.1453 CCCCc1ccnc2c1CC(=O)N2 271570a_100020621405_100000104061 [2,0,0,0,0,0|1,0,0]=3 451 B15R2.1453 CCCCc1ccnc2c1[nH]c(=O)[nH]2 271570a_100020621405_100009840862 [2,0,0,0,0,0|2,0,0]=4 452 B15R2.1453 CCCSc1cccc2c1CC(=O)C2 62a_100010205903_100000210303 [2,0,0,0,0,0|2,0,0]=4 453 B15R2.1453 CCCSc1cccc2c1CC(=O)N2 62a_100000210303_100009816812 [2,0,0,0,0,0|1,0,0]=3 454 B15R2.1453 CCCSc1ccnc2c1CC(=O)N2 62a_100000210303_100000104061 [2,0,0,0,0,0|2,0,0]=4 455 B15R2.1453 COCSc1cccc2c1CC(=O)N2 62a_100000766300_100009816812 [2,0,0,0,0,0|2,0,0]=4 456 B15R2.1453 CSCSc1cccc2c1CC(=O)N2 62a_100011218213_100009816812 [2,0,0,0,0,0|2,0,0]=4 457 B15R2.1453 O=C1Cc2c(cccc2SCCF)N1 62a_100011217306_100009816812 [2,0,0,0,0,0|2,0,0]=4 458 B15R2.1453 O=C1Cc2c(cccc2SCCO)N1 62a_100000211926_100009816812 [2,0,0,0,0,0|2,0,0]=4 459 B15R2.4278 CCCCOc1cccc2c1CCN2 34a_100000703684_100000210210 [2,0,0,0,0,0|1,0,1]=4 460 B15R2.4278 CCCCOc1cccc2c1cc[nH]2 34a_100000763377_100000210210 [2,0,0,0,0,0|1,0,1]=4 461 B15R2.4278 CCCCSc1cccc2c1CC=C2 62a_100000210211_100009844718 [2,0,0,0,0,0|2,0,0]=4 462 B15R2.4278 CCCCSc1cccc2c1CC=C2 62a_100009844718_100000210210 [2,0,0,0,0,0|2,0,0]=4 463 B15R2.4278 CCCCSc1cccc2c1CCN2 62a_100000210211_100009817896 [2,0,0,0,0,0|1,0,1]=4 464 B15R2.4278 CCCCSc1cccc2c1CCN2 62a_100009817896_100000210210 [2,0,0,0,0,0|1,0,1]=4 465 B15R2.4278 CCCCSc1cccc2c1cc[nH]2 62a_100000210211_100000685724 [2,0,0,0,0,0|1,0,1]=4 466 B15R2.4278 CCCCSc1cccc2c1nc[nH]2 62a_100000210211_100011935113 [2,0,0,0,0,0|2,0,0]=4 467 B15R2.4278 CCCNCc1cccc2c1CCO2 207a_100020643023_100000045544 [2,0,0,0,0,0|1,0,1]=4 468 B15R2.4278 CCCNCc1cccc2c1CCO2 270004a_100020643023_100000045544 [2,0,0,0,0,0|1,0,1]=4 469 B15R2.4278 CCCNCc1cccc2c1[nH]cc2 207a_100020643023_100000750900 [2,0,0,0,0,0|2,0,0]=4 470 B15R2.4278 CCCNCc1cccc2c1[nH]cc2 270004a_100020643023_100000750900 [2,0,0,0,0,0|2,0,0]=4 471 B15R2.4278 CCCNCc1cccc2c1[nH]cn2 207a_100020643023_100000100021 [2,0,0,0,0,0|1,0,1]=4 472 B15R2.4278 CCCNCc1cccc2c1[nH]cn2 270004a_100020643023_100000100021 [2,0,0,0,0,0|1,0,1]=4 473 B15R2.4278 CCCNCc1cccc2c1cc[nH]2 207a_100020643023_100000750904 [2,0,0,0,0,0|0,0,1]=3 474 B15R2.4278 CCCNCc1cccc2c1ccs2 207a_100020643023_100009860987 [2,0,0,0,0,0|1,0,1]=4 475 B15R2.4278 CCCNCc1cccc2c1ccs2 270004a_100020643023_100009860987 [2,0,0,0,0,0|1,0,1]=4 476 B15R2.4278 CCCNCc1cccc2c1cn[nH]2 207a_100020643023_100000068380 [2,0,0,0,0,0|1,0,1]=4 477 B15R2.4278 CCCNCc1cccc2c1cn[nH]2 270004a_100020643023_100000068380 [2,0,0,0,0,0|1,0,1]=4 478 B15R2.4278 CCCNCc1cccc2c1occ2 207a_100020643023_100000050329 [2,0,0,0,0,0|2,0,0]=4 479 B15R2.4278 CCCNCc1cccc2c1occ2 270004a_100020643023_100000050329 [2,0,0,0,0,0|2,0,0]=4 480 B15R2.4278 CCCNCc1cccc2c1scc2 207a_100020643023_100011934923 [2,0,0,0,0,0|2,0,0]=4 481 B15R2.4278 CCCNCc1cccc2c1scc2 270004a_100020643023_100011934923 [2,0,0,0,0,0|2,0,0]=4 482 B15R2.4278 OCCNCc1cccc2c1cc[nH]2 207a_100000210304_100000750904 [2,0,0,0,0,0|1,0,1]=4 483 B17R1.273 CCCCCNc1cc(ccc1C)NC(=O)C 34a_100000739390_100000718602 [0,1,1,0,0,0|2,0,0]=4 484 B17R1.273 CCCCCNc1cc(ccc1C)NC(=O)C 7a_100000739390_100000210326 [0,1,1,0,0,0|2,0,0]=4 485 B17R1.273 CCCCCNc1cc(ccc1Cl)NC(=O)C 34a_100000742996_100000718602 [0,1,1,0,0,0|2,0,0]=4 486 B17R1.273 CCCCCNc1cc(ccc1F)NC(=O)C 34a_106454645589_100000718602 [0,1,1,0,0,0|2,0,0]=4 487 B17R1.273 CCCCCOc1cc(ccc1Cl)NC(=O)C 34a_100011935283_100000718602 [0,1,1,0,0,0|2,0,0]=4 488 B17R1.273 CCCCCOc1cc(ccc1Cl)NC(=O)C 7a_100011935283_100000210326 [0,1,1,0,0,0|2,0,0]=4 489 B17R1.273 CCCCCSc1cc(ccc1C)NC(=O)C 62a_100000210326_100011221169 [0,1,1,0,0,0|2,0,0]=4 490 B17R1.273 CCCCCSc1cc(ccc1F)NC(=O)C 62a_100000210326_100012348134 [0,1,1,0,0,0|2,0,0]=4 491 B17R1.308 CCCCCNc1cccc(c1)NC(=O)CC 34a_100000186510_100000718602 [0,1,1,0,0,0|2,0,0]=4 492 B17R1.308 CCCCCOc1cccc(c1)NC(=O)CC 34a_100000158609_100000718602 [0,1,1,0,0,0|2,0,0]=4 493 B17R1.308 CCCCCOc1cccc(c1)NC(=O)CC 7a_100000158609_100000210326 [0,1,1,0,0,0|2,0,0]=4 494 B17R1.308 CCCCCOc1cccc(c1)NC(=O)CCl 34a_100011236192_100000718602 [0,1,1,0,0,0|2,0,0]=4 495 B17R1.308 CCCCCOc1cccc(c1)NC(=O)CCl 7a_100011236192_100000210326 [0,1,1,0,0,0|2,0,0]=4 496 B17R1.308 CCCCCOc1cccc(c1)NC(=O)OC 34a_100000741004_100000718602 [0,1,1,0,0,0|2,0,0]=4 497 B17R1.308 CCCCCOc1cccc(c1)NC(=O)OC 7a_100000741004_100000210326 [0,1,1,0,0,0|2,0,0]=4 498 B17R1.308 CCCCNCc1cccc(c1)NC(=O)CC 2230a_100000740940_100000210211 [0,1,1,0,0,0|2,0,0]=4 499 B17R1.308 CCCCNCc1cccc(c1)NC(=O)CC 34a_100000740940_100000210210 [0,1,1,0,0,0|2,0,0]=4 500 B17R1.310 CCCCCNc1cccc(c1C)NC(=O)C 34a_100000736503_100000718602 [0,1,1,0,0,0|2,0,0]=4 501 B17R1.310 CCCCCNc1cccc(c1C)NC(=O)C 7a_100000736503_100000210326 [0,1,1,0,0,0|2,0,0]=4 502 B17R1.329 CCCCCNc1ccc(c(c1)NC(=O)C)C 34a_100000740626_100000718602 [0,1,1,0,0,0|2,0,0]=4 503 B17R1.329 CCCCCNc1ccc(c(c1)NC(=O)C)C 7a_100000740626_100000210326 [0,1,1,0,0,0|2,0,0]=4 504 B17R1.329 CCCCCNc1ccc(c(c1)NC(=O)C)Cl 34a_100000745429_100000718602 [0,1,1,0,0,0|2,0,0]=4 505 B17R1.329 CCCCCNc1ccc(c(c1)NC(=O)C)Cl 7a_100000745429_100000210326 [0,1,1,0,0,0|2,0,0]=4 506 B17R1.329 CCCCCNc1ccc(c(c1)NC(=O)C)F 34a_100000736141_100000718602 [0,1,1,0,0,0|2,0,0]=4 507 B17R1.329 CCCCCNc1ccc(c(c1)NC(=O)C)F 7a_100000736141_100000210326 [0,1,1,0,0,0|2,0,0]=4 508 B17R1.329 CCCCCNc1ccc(c(c1)NC(=O)C)O 34a_100000070259_100000718602 [0,1,1,0,0,0|2,0,0]=4 509 B17R1.329 CCCCCNc1ccc(c(c1)NC(=O)C)O 7a_100000070259_100000210326 [0,1,1,0,0,0|2,0,0]=4 510 B17R1.329 CCCCCSc1ccc(c(c1)NC(=O)C)C 62a_100000210326_100011344836 [0,1,1,0,0,0|2,0,0]=4 511 B17R1.329 CCCCCSc1ccc(c(c1)NC(=O)C)F 62a_100000210326_200011951791 [0,1,1,0,0,0|2,0,0]=4 512 B17R1.1876 CCCCCC(=O)c1cccc(c1)NC(=O)C 1458a_100000188798_100000210326 [0,1,1,0,0,0|1,0,1]=4 513 B17R1.1876 CCCCNC(C)c1cccc(c1)NC(=O)C 269862a_100000102301_100000155543 [0,1,1,0,0,0|2,0,0]=4 514 B17R1.1876 CCCNN=C(C)c1cccc(c1)NC(=O)C 4a_100000740057_100000155543 [0,1,1,0,0,0|1,0,1]=4 515 B17R1.1876 CCCNNC(=O)c1cccc(c1)NC(=O)C 22a_100000740057_100000188798 [0,1,1,0,0,0|1,0,1]=4 516 B17R1.4912 CCCCC(C)Nc1cccc(c1)NC(=O)C 34a_100000749408_200011215066 [0,1,1,0,0,0|2,0,0]=4 517 B17R1.4912 CCCCC(C)Oc1cccc(c1)NC(=O)C 34a_100000158604_200011215066 [0,1,1,0,0,0|2,0,0]=4 518 B17R1.4912 CCCCC(C)Oc1cccc(c1)NC(=O)C 7a_100000158604_200011215066 [0,1,1,0,0,0|2,0,0]=4 519 B17R1.4912 CCCCC(C)Sc1cccc(c1)NC(=O)C 62a_200011215066_100000153616 [0,1,1,0,0,0|2,0,0]=4 520 B17R1.4912 CCCCN(C)Cc1cccc(c1)NC(=O)C 270004a_100000207549_100011257792 [0,1,1,0,0,0|2,0,0]=4 521 B17R1.4912 CCCNC(=O)Nc1cccc(c1)NC(=O)C 2430a_100000749408_100020643023 [0,1,1,0,0,0|1,0,1]=4 522 B17R1.4912 CCCNC(=O)Nc1cccc(c1)NC(=O)C 512a_100000749408_100020643023 [0,1,1,0,0,0|1,0,1]=4 523 B17R1.17900 CCCCCNc1cccc(c1)N(C)C(=O)C 34a_100000765750_100000718602 [0,1,1,0,0,0|2,0,0]=4 524 B17R1.17900 CCCCNCc1cccc(c1)N(C)C(=O)C 2230a_100020605210_100000210211 [0,1,1,0,0,0|2,0,0]=4 525 B17R1.21230 CCCC(=O)COc1cccc(c1)NC(=O)C 7a_100000158604_100000747444 [0,1,1,0,0,0|2,0,0]=4 526 B17R1.21230 CCCC(=O)CSc1cccc(c1)NC(=O)C 62a_100000747444_100000153616 [0,1,1,0,0,0|2,0,0]=4 527 B17R1.21230 CCCC(=O)NCc1cccc(c1)NC(=O)C 11a_100000740035_100000211992 [0,1,1,0,0,0|2,0,0]=4 528 B17R1.21230 CCCC(=O)NCc1cccc(c1)NC(=O)C 1626a_100000740035_100000211992 [0,1,1,0,0,0|2,0,0]=4 529 B17R1.21230 CCCC(=O)NCc1cccc(c1)NC(=O)C 240690a_100000740035_100000211992 [0,1,1,0,0,0|2,0,0]=4 530 B17R1.21230 CCCC(=O)NCc1cccc(c1)NC(=O)C 527a_100000740035_100000211992 [0,1,1,0,0,0|2,0,0]=4 531 B17R1.21230 CCCC(C)CNc1cccc(c1)NC(=O)C 34a_100000749408_100011216630 [0,1,1,0,0,0|2,0,0]=4 532 B17R1.21230 CCCC(C)COc1cccc(c1)NC(=O)C 34a_100000158604_100011216630 [0,1,1,0,0,0|2,0,0]=4 533 B17R1.21230 CCCC(C)COc1cccc(c1)NC(=O)C 7a_100000158604_100011216630 [0,1,1,0,0,0|2,0,0]=4 534 B17R1.21230 CCCC(C)CSc1cccc(c1)NC(=O)C 62a_100011216630_100000153616 [0,1,1,0,0,0|2,0,0]=4 535 B17R1.21230 CCCC(C)NCc1cccc(c1)NC(=O)C 207a_100000741246_100011257792 [0,1,1,0,0,0|2,0,0]=4 536 B17R1.21230 CCCC(C)NCc1cccc(c1)NC(=O)C 2230a_100000740035_100000766640 [0,1,1,0,0,0|2,0,0]=4 537 B17R1.21230 CCCC(C)NCc1cccc(c1)NC(=O)C 270004a_100000740035_100000211909 [0,1,1,0,0,0|2,0,0]=4 538 B17R1.21230 CCCC(C)NCc1cccc(c1)NC(=O)C 270004a_100000741246_100011257792 [0,1,1,0,0,0|2,0,0]=4 539 B17R1.21230 CCCC(C)NCc1cccc(c1)NC(=O)C 34a_100000740035_100000766640 [0,1,1,0,0,0|2,0,0]=4 540 B17R1.24594 CCC(C)CNCc1cccc(c1)NC(=O)C 207a_100020588543_100011257792 [0,1,1,0,0,0|2,0,0]=4 541 B17R1.24594 CCC(C)CNCc1cccc(c1)NC(=O)C 2230a_100000740035_100000748023 [0,1,1,0,0,0|2,0,0]=4 542 B17R1.24594 CCC(C)CNCc1cccc(c1)NC(=O)C 270004a_100000740035_100000243153 [0,1,1,0,0,0|2,0,0]=4 543 B17R1.24594 CCC(C)CNCc1cccc(c1)NC(=O)C 270004a_100020588543_100011257792 [0,1,1,0,0,0|2,0,0]=4 544 B17R1.24594 CCC(C)CNCc1cccc(c1)NC(=O)C 34a_100000740035_100000748023 [0,1,1,0,0,0|2,0,0]=4 545 B17R1.24594 CCC(C)NN=Cc1cccc(c1)NC(=O)C 4a_100000718999_100011257792 [0,1,1,0,0,0|1,0,1]=4 546 B17R1.24594 CCC(O)CNCc1cccc(c1)NC(=O)C 207a_100011218483_100011257792 [0,1,1,0,0,0|2,0,0]=4 547 B17R1.24594 CCC(O)CNCc1cccc(c1)NC(=O)C 2230a_100000740035_100011218378 [0,1,1,0,0,0|2,0,0]=4 548 B17R1.24594 CCC(O)CNCc1cccc(c1)NC(=O)C 270004a_100011218483_100011257792 [0,1,1,0,0,0|2,0,0]=4 549 B17R1.24594 CCC(O)CNCc1cccc(c1)NC(=O)C 34a_100000740035_100011218378 [0,1,1,0,0,0|2,0,0]=4 550 B17R1.24594 CC[C@H](C)CNCc1cccc(c1)NC(=O)C 2230a_100000740035_100009816398 [0,1,1,0,0,0|2,0,0]=4 551 B17R1.24594 CC[C@H](C)CNCc1cccc(c1)NC(=O)C 34a_100000740035_100009816398 [0,1,1,0,0,0|2,0,0]=4 552 B17R1.25717 CC(=O)Nc1cccc(c1)CNCCCCF 2230a_100000740035_100000729493 [0,1,1,0,0,0|2,0,0]=4 553 B17R1.25717 CC(=O)Nc1cccc(c1)CNCCCCF 34a_100000740035_100000729493 [0,1,1,0,0,0|2,0,0]=4 554 B17R1.25717 CC(=O)Nc1cccc(c1)CNCCCCO 207a_100000750430_100011257792 [0,1,1,0,0,0|2,0,0]=4 555 B17R1.25717 CC(=O)Nc1cccc(c1)CNCCCCO 2230a_100000740035_100000210776 [0,1,1,0,0,0|2,0,0]=4 556 B17R1.25717 CC(=O)Nc1cccc(c1)CNCCCCO 270004a_100000750430_100011257792 [0,1,1,0,0,0|2,0,0]=4 557 B17R1.25717 CC(=O)Nc1cccc(c1)CNCCCCO 34a_100000740035_100011216708 [0,1,1,0,0,0|2,0,0]=4 558 B17R1.25717 CC(=O)Nc1cccc(c1)NCCCCCF 34a_100000749408_100000729378 [0,1,1,0,0,0|2,0,0]=4 559 B17R1.25717 CC(=O)Nc1cccc(c1)NCCCCCO 34a_100000749408_100000746330 [0,1,1,0,0,0|2,0,0]=4 560 B17R1.25717 CC(=O)Nc1cccc(c1)NCCOCCO 34a_100000749408_100000692535 [0,1,1,0,0,0|2,0,0]=4 561 B17R1.25717 CC(=O)Nc1cccc(c1)OCCCCCF 34a_100000158604_100000729378 [0,1,1,0,0,0|2,0,0]=4 562 B17R1.25717 CC(=O)Nc1cccc(c1)OCCCCCF 7a_100000158604_100000729378 [0,1,1,0,0,0|2,0,0]=4 563 B17R1.25717 CC(=O)Nc1cccc(c1)OCCCCCO 34a_100000158604_100000746330 [0,1,1,0,0,0|2,0,0]=4 564 B17R1.25717 CC(=O)Nc1cccc(c1)OCCCCCO 7a_100000158604_100000746330 [0,1,1,0,0,0|2,0,0]=4 565 B17R1.25717 CC(=O)Nc1cccc(c1)OCCOCCO 34a_100000158604_100000692535 [0,1,1,0,0,0|2,0,0]=4 566 B17R1.25717 CC(=O)Nc1cccc(c1)OCCOCCO 7a_100000158604_100011215305 [0,1,1,0,0,0|2,0,0]=4 567 B17R1.25717 CC(=O)Nc1cccc(c1)SCCCCCF 62a_100000729378_100000153616 [0,1,1,0,0,0|2,0,0]=4 568 B17R1.25717 CC(=O)Nc1cccc(c1)SCCCCCO 62a_100000746330_100000153616 [0,1,1,0,0,0|2,0,0]=4 569 B17R1.25717 CC(=O)Nc1cccc(c1)SCCOCCO 62a_100011215305_100000153616 [0,1,1,0,0,0|2,0,0]=4 570 B17R1.25717 CC/C=C\CCNc1cccc(c1)NC(=O)C 34a_100000749408_100015370543 [0,1,1,0,0,0|1,0,1]=4 571 B17R1.25717 CC/C=C\CCOc1cccc(c1)NC(=O)C 34a_100000158604_100015370543 [0,1,1,0,0,0|1,0,1]=4 572 B17R1.25717 CC/C=C\CCOc1cccc(c1)NC(=O)C 7a_100000158604_100015370543 [0,1,1,0,0,0|1,0,1]=4 573 B17R1.25717 CC/C=C\CCSc1cccc(c1)NC(=O)C 62a_100015370543_100000153616 [0,1,1,0,0,0|1,0,1]=4 574 B17R1.25717 CC/C=C\CNCc1cccc(c1)NC(=O)C 2230a_100000740035_100103147603 [0,1,1,0,0,0|1,0,1]=4 575 B17R1.25717 CC/C=C\CNCc1cccc(c1)NC(=O)C 34a_100000740035_100103147603 [0,1,1,0,0,0|1,0,1]=4 576 B17R1.25717 CCC#CCNCc1cccc(c1)NC(=O)C 2230a_100000740035_100009813939 [0,1,1,0,0,0|1,0,1]=4 577 B17R1.25717 CCC#CCNCc1cccc(c1)NC(=O)C 34a_100000740035_100009813939 [0,1,1,0,0,0|1,0,1]=4 578 B17R1.25717 CCCCCC=Cc1cccc(c1)NC(=O)C 271570a_100000062253_100000153616 [0,1,1,0,0,0|1,0,1]=4 579 B17R1.25717 CCCCCCNc1cccc(c1)NC(=O)C 34a_100000749408_100000210314 [0,1,1,0,0,0|1,0,0]=3 580 B17R1.25717 CCCCCCNc1cccc(c1)NC(=O)N 34a_100000736001_100000210314 [0,1,1,0,0,0|2,0,0]=4 581 B17R1.25717 CCCCCCOc1cccc(c1)NC(=O)C 34a_100000158604_100000210314 [0,1,1,0,0,0|1,0,0]=3 582 B17R1.25717 CCCCCCOc1cccc(c1)NC(=O)C 7a_100000158604_100000210314 [0,1,1,0,0,0|1,0,0]=3 583 B17R1.25717 CCCCCCOc1cccc(c1)NC(=O)N 34a_100011219624_100000210314 [0,1,1,0,0,0|2,0,0]=4 584 B17R1.25717 CCCCCCOc1cccc(c1)NC(=O)N 7a_100011219624_100000210314 [0,1,1,0,0,0|2,0,0]=4 585 B17R1.25717 CCCCCCOc1cccc(c1)OC(=O)C 7a_100011218754_100000210314 [0,1,1,0,0,0|2,0,0]=4 586 B17R1.25717 CCCCCCSc1cc(ccn1)NC(=O)C 62a_100000210314_100000238608 [0,1,1,0,0,0|2,0,0]=4 587 B17R1.25717 CCCCCCSc1cccc(c1)CC(=O)C 62a_100000210314_100000689217 [0,1,1,0,0,0|2,0,0]=4 588 B17R1.25717 CCCCCCSc1cccc(c1)CC(=O)C 62a_100000689217_100000210757 [0,1,1,0,0,0|2,0,0]=4 589 B17R1.25717 CCCCCCSc1cccc(c1)NC(=O)C 62a_100000210314_100000153616 [0,1,1,0,0,0|1,0,0]=3 590 B17R1.25717 CCCCCCSc1cccc(c1)NC(=O)N 62a_100000210314_100000238923 [0,1,1,0,0,0|2,0,0]=4 591 B17R1.25717 CCCCCCSc1cccc(c1)OC(=O)C 62a_100000210314_100009811612 [0,1,1,0,0,0|2,0,0]=4 592 B17R1.25717 CCCCCCSc1cccc(n1)NC(=O)C 62a_100000210314_200011307899 [0,1,1,0,0,0|2,0,0]=4 593 B17R1.25717 CCCCCCSc1ccnc(c1)NC(=O)C 62a_100000210314_100012362434 [0,1,1,0,0,0|2,0,0]=4 594 B17R1.25717 CCCCCCSc1cncc(c1)NC(=O)C 62a_100000210314_100012351681 [0,1,1,0,0,0|2,0,0]=4 595 B17R1.25717 CCCCCNCc1cccc(c1)NC(=O)C 207a_100000209983_100011257792 [0,1,1,0,0,0|1,0,0]=3 596 B17R1.25717 CCCCCNCc1cccc(c1)NC(=O)C 2230a_100000740035_100000210326 [0,1,1,0,0,0|1,0,0]=3 597 B17R1.25717 CCCCCNCc1cccc(c1)NC(=O)C 270004a_100000209983_100011257792 [0,1,1,0,0,0|1,0,0]=3 598 B17R1.25717 CCCCCNCc1cccc(c1)NC(=O)C 34a_100000740035_100000718602 [0,1,1,0,0,0|1,0,0]=3 599 B17R1.25717 CCCCCNCc1cccc(c1)OC(=O)C 207a_100000209983_100000014719 [0,1,1,0,0,0|2,0,0]=4 600 B17R1.25717 CCCCCNCc1cccc(c1)OC(=O)C 2230a_100000209983_200009816940 [0,1,1,0,0,0|2,0,0]=4 601 B17R1.25717 CCCCCNCc1cccc(c1)OC(=O)C 270004a_100000209983_100000014719 [0,1,1,0,0,0|2,0,0]=4 602 B17R1.25717 CCCCCOCc1cccc(c1)OC(=O)C 34a_100000210253_200009816940 [0,1,1,0,0,0|2,0,0]=4 603 B17R1.25717 CCCCCOCc1cccc(c1)OC(=O)C 7a_100000210253_200009816940 [0,1,1,0,0,0|2,0,0]=4 604 B17R1.25717 CCCCCSCc1cccc(c1)OC(=O)C 62a_100000210326_200009816940 [0,1,1,0,0,0|2,0,0]=4 605 B17R1.25717 CCCCCSCc1cccc(c1)OC(=O)C 62a_200009816940_100000210326 [0,1,1,0,0,0|2,0,0]=4 606 B17R1.25717 CCCCNN=Cc1cccc(c1)NC(=O)C 4a_100025702795_100011257792 [0,1,1,0,0,0|1,0,1]=4 607 B17R1.25717 CCCCOCNc1cccc(c1)NC(=O)C 34a_100000749408_100011995733 [0,1,1,0,0,0|2,0,0]=4 608 B17R1.25717 CCCCOCOc1cccc(c1)NC(=O)C 34a_100000158604_100011995733 [0,1,1,0,0,0|2,0,0]=4 609 B17R1.25717 CCCCOCSc1cccc(c1)NC(=O)C 62a_100011995733_100000153616 [0,1,1,0,0,0|2,0,0]=4 610 B17R1.25717 CCCOCCNc1cccc(c1)NC(=O)C 34a_100000749408_100011215938 [0,1,1,0,0,0|1,0,0]=3 611 B17R1.25717 CCCOCCNc1cccc(c1)NC(=O)N 34a_100000736001_100011215938 [0,1,1,0,0,0|2,0,0]=4 612 B17R1.25717 CCCOCCOc1cccc(c1)NC(=O)C 34a_100000158604_100011215938 [0,1,1,0,0,0|1,0,0]=3 613 B17R1.25717 CCCOCCOc1cccc(c1)NC(=O)C 7a_100000158604_100011215938 [0,1,1,0,0,0|1,0,0]=3 614 B17R1.25717 CCCOCCOc1cccc(c1)NC(=O)N 34a_100011219624_100011215938 [0,1,1,0,0,0|2,0,0]=4 615 B17R1.25717 CCCOCCOc1cccc(c1)NC(=O)N 7a_100011219624_100011215938 [0,1,1,0,0,0|2,0,0]=4 616 B17R1.25717 CCCOCCOc1cccc(c1)OC(=O)C 7a_100011218754_100011215938 [0,1,1,0,0,0|2,0,0]=4 617 B17R1.25717 CCCOCCSc1cc(ccn1)NC(=O)C 62a_100011215938_100000238608 [0,1,1,0,0,0|2,0,0]=4 618 B17R1.25717 CCCOCCSc1cccc(c1)CC(=O)C 62a_100000689217_100011215938 [0,1,1,0,0,0|2,0,0]=4 619 B17R1.25717 CCCOCCSc1cccc(c1)CC(=O)C 62a_100011215938_100000689217 [0,1,1,0,0,0|2,0,0]=4 620 B17R1.25717 CCCOCCSc1cccc(c1)NC(=O)C 62a_100011215938_100000153616 [0,1,1,0,0,0|1,0,0]=3 621 B17R1.25717 CCCOCCSc1cccc(c1)NC(=O)N 62a_100011215938_100000238923 [0,1,1,0,0,0|2,0,0]=4 622 B17R1.25717 CCCOCCSc1cccc(c1)OC(=O)C 62a_100011215938_100009811612 [0,1,1,0,0,0|2,0,0]=4 623 B17R1.25717 CCCOCCSc1cccc(n1)NC(=O)C 62a_100011215938_200011307899 [0,1,1,0,0,0|2,0,0]=4 624 B17R1.25717 CCCOCCSc1ccnc(c1)NC(=O)C 62a_100011215938_100012362434 [0,1,1,0,0,0|2,0,0]=4 625 B17R1.25717 CCCOCCSc1cncc(c1)NC(=O)C 62a_100011215938_100012351681 [0,1,1,0,0,0|2,0,0]=4 626 B17R1.25717 CCOCCCNc1cccc(c1)NC(=O)C 34a_100000749408_100012232248 [0,1,1,0,0,0|2,0,0]=4 627 B17R1.25717 CCOCCCOc1cccc(c1)NC(=O)C 34a_100000158604_100012232248 [0,1,1,0,0,0|2,0,0]=4 628 B17R1.25717 CCOCCCOc1cccc(c1)NC(=O)C 7a_100000158604_100012232248 [0,1,1,0,0,0|2,0,0]=4 629 B17R1.25717 CCOCCCSc1cccc(c1)NC(=O)C 62a_100012232248_100000153616 [0,1,1,0,0,0|2,0,0]=4 630 B17R1.25717 CCOCCNCc1cccc(c1)NC(=O)C 207a_100011200944_100011257792 [0,1,1,0,0,0|2,0,0]=4 631 B17R1.25717 CCOCCNCc1cccc(c1)NC(=O)C 2230a_100000740035_100011215890 [0,1,1,0,0,0|2,0,0]=4 632 B17R1.25717 CCOCCNCc1cccc(c1)NC(=O)C 270004a_102516460346_100011257792 [0,1,1,0,0,0|2,0,0]=4 633 B17R1.25717 CCOCCNCc1cccc(c1)NC(=O)C 34a_100000740035_100000210147 [0,1,1,0,0,0|2,0,0]=4 634 B17R1.25717 CCSCCNCc1cccc(c1)NC(=O)C 207a_100000106463_100011257792 [0,1,1,0,0,0|2,0,0]=4 635 B17R1.25717 CCSCCNCc1cccc(c1)NC(=O)C 2230a_100000740035_100000757381 [0,1,1,0,0,0|2,0,0]=4 636 B17R1.25717 CCSCCNCc1cccc(c1)NC(=O)C 270004a_100000106463_100011257792 [0,1,1,0,0,0|2,0,0]=4 637 B17R1.25717 CCSCCNCc1cccc(c1)NC(=O)C 34a_100000740035_100000757381 [0,1,1,0,0,0|2,0,0]=4 638 B17R1.25717 COCCCCNc1cccc(c1)NC(=O)C 34a_100000749408_100000755781 [0,1,1,0,0,0|2,0,0]=4 639 B17R1.25717 COCCCCOc1cccc(c1)NC(=O)C 34a_100000158604_100000755781 [0,1,1,0,0,0|2,0,0]=4 640 B17R1.25717 COCCCCOc1cccc(c1)NC(=O)C 7a_100000158604_100000730899 [0,1,1,0,0,0|2,0,0]=4 641 B17R1.25717 COCCCCSc1cccc(c1)NC(=O)C 62a_100000730899_100000153616 [0,1,1,0,0,0|2,0,0]=4 642 B17R1.25717 COCCCNCc1cccc(c1)NC(=O)C 207a_100150723488_100011257792 [0,1,1,0,0,0|2,0,0]=4 643 B17R1.25717 COCCCNCc1cccc(c1)NC(=O)C 2230a_100000740035_100000740836 [0,1,1,0,0,0|2,0,0]=4 644 B17R1.25717 COCCCNCc1cccc(c1)NC(=O)C 270004a_100150723488_100011257792 [0,1,1,0,0,0|2,0,0]=4 645 B17R1.25717 COCCCNCc1cccc(c1)NC(=O)C 34a_100000740035_100000740836 [0,1,1,0,0,0|2,0,0]=4 646 B17R1.25717 COCCOCSc1cccc(c1)NC(=O)C 62a_100000231047_100000153616 [0,1,1,0,0,0|2,0,0]=4 647 B17R1.25717 CSCCCNCc1cccc(c1)NC(=O)C 207a_100000749238_100011257792 [0,1,1,0,0,0|2,0,0]=4 648 B17R1.25717 CSCCCNCc1cccc(c1)NC(=O)C 270004a_100000749238_100011257792 [0,1,1,0,0,0|2,0,0]=4 649 B17R1.26303 CC(=O)Nc1cccc(c1)C=NNCC(C)O 4a_200000730056_100011257792 [0,1,1,0,0,0|1,0,1]=4 650 B17R1.26303 CC(=O)Nc1cccc(c1)CNCCC(C)C 207a_100000210545_100011257792 [0,1,1,0,0,0|2,0,0]=4 651 B17R1.26303 CC(=O)Nc1cccc(c1)CNCCC(C)C 2230a_100000740035_100000210312 [0,1,1,0,0,0|2,0,0]=4 652 B17R1.26303 CC(=O)Nc1cccc(c1)CNCCC(C)C 269862a_100000740035_100000185833 [0,1,1,0,0,0|2,0,0]=4 653 B17R1.26303 CC(=O)Nc1cccc(c1)CNCCC(C)C 270004a_100000210545_100011257792 [0,1,1,0,0,0|2,0,0]=4 654 B17R1.26303 CC(=O)Nc1cccc(c1)CNCCC(C)C 34a_100000740035_100000210312 [0,1,1,0,0,0|2,0,0]=4 655 B17R1.26303 CC(=O)Nc1cccc(c1)CNCCC(C)O 207a_200000755665_100011257792 [0,1,1,0,0,0|2,0,0]=4 656 B17R1.26303 CC(=O)Nc1cccc(c1)CNCCC(C)O 2230a_100000740035_100012276601 [0,1,1,0,0,0|2,0,0]=4 657 B17R1.26303 CC(=O)Nc1cccc(c1)CNCCC(C)O 270004a_200000755665_100011257792 [0,1,1,0,0,0|2,0,0]=4 658 B17R1.26303 CC(=O)Nc1cccc(c1)CNCCC(C)O 34a_100000740035_100012276601 [0,1,1,0,0,0|2,0,0]=4 659 B17R1.26303 CC(=O)Nc1cccc(c1)NCCCC(C)C 34a_100000749408_100011214892 [0,1,1,0,0,0|2,0,0]=4 660 B17R1.26303 CC(=O)Nc1cccc(c1)NCCCC(C)O 34a_100000749408_200000718107 [0,1,1,0,0,0|2,0,0]=4 661 B17R1.26303 CC(=O)Nc1cccc(c1)OCCCC(C)C 34a_100000158604_100011214892 [0,1,1,0,0,0|2,0,0]=4 662 B17R1.26303 CC(=O)Nc1cccc(c1)OCCCC(C)C 7a_100000158604_100011214892 [0,1,1,0,0,0|2,0,0]=4 663 B17R1.26303 CC(=O)Nc1cccc(c1)OCCCC(C)O 34a_100000158604_200000718107 [0,1,1,0,0,0|2,0,0]=4 664 B17R1.26303 CC(=O)Nc1cccc(c1)OCCCC(C)O 7a_100000158604_200000718107 [0,1,1,0,0,0|2,0,0]=4 665 B17R1.26303 CC(=O)Nc1cccc(c1)SCCCC(C)C 62a_100011214892_100000153616 [0,1,1,0,0,0|2,0,0]=4 666 B17R1.26303 CC(=O)Nc1cccc(c1)SCCCC(C)O 62a_200000718107_100000153616 [0,1,1,0,0,0|2,0,0]=4 667 B17R1.323 CCCCCNc1ccccc1CC(=O)NC 2230a_100000738506_100000210326 [0,1,1,0,0,0|2,0,0]=4 668 B17R1.323 CCCCCNc1ccccc1CC(=O)NC 34a_100000738506_100000718602 [0,1,1,0,0,0|2,0,0]=4 669 B17R1.323 CCCCCOc1ccccc1CC(=O)NN 34a_200012021708_100000718602 [0,1,1,0,0,0|2,0,0]=4 670 B17R1.323 CCCCCSc1ccccc1CC(=O)NC 62a_100000210326_200009816160 [0,1,1,0,0,0|2,0,0]=4 671 B17R1.323 CCCCCSc1ccccc1CC(=O)NC 62a_200009816160_100000210326 [0,1,1,0,0,0|2,0,0]=4 672 B17R1.323 CCCCCSc1ccccc1CC(=O)NN 62a_100000210326_200010210069 [0,1,1,0,0,0|2,0,0]=4 673 B17R1.323 CCCCCSc1ccccc1CC(=O)NN 62a_200010210069_100000210326 [0,1,1,0,0,0|2,0,0]=4 674 B17R1.4154 CC/C=C\CCSc1ccccc1CC(=O)N 62a_100015370543_200009814924 [0,1,1,0,0,0|1,0,1]=4 675 B17R1.4154 CC/C=C\CCSc1ccccc1CC(=O)N 62a_200009814924_100015370543 [0,1,1,0,0,0|1,0,1]=4 676 B17R1.4154 CCCCCC=Cc1ccccc1CC(=O)N 271570a_100000062253_200009814924 [0,1,1,0,0,0|1,0,1]=4 677 B17R1.4154 CCCCCCSc1ccccc1CC(=O)C 62a_100000210314_100011350739 [0,1,1,0,0,0|2,0,0]=4 678 B17R1.4154 CCCCCCSc1ccccc1CC(=O)C 62a_100011350739_100000210757 [0,1,1,0,0,0|2,0,0]=4 679 B17R1.4154 CCCCCCSc1ccccc1CC(=O)N 62a_100000210314_200009814924 [0,1,1,0,0,0|1,0,0]=3 680 B17R1.4154 CCCCCCSc1ccccc1CC(=O)N 62a_200009814924_100000210757 [0,1,1,0,0,0|1,0,0]=3 681 B17R1.4154 CCCCCCSc1ccccc1NC(=O)N 62a_100000210314_100000742221 [0,1,1,0,0,0|2,0,0]=4 682 B17R1.4154 CCCCCNCc1ccccc1CC(=O)O 269956a_100000688124_100000210326 [0,1,1,0,0,0|2,0,0]=4 683 B17R1.4154 CCCCOCSc1ccccc1CC(=O)N 62a_100011995733_200009814924 [0,1,1,0,0,0|2,0,0]=4 684 B17R1.4154 CCCCOCSc1ccccc1CC(=O)N 62a_200009814924_100011995733 [0,1,1,0,0,0|2,0,0]=4 685 B17R1.4154 CCCOCCSc1ccccc1CC(=O)C 62a_100011215938_100011350739 [0,1,1,0,0,0|2,0,0]=4 686 B17R1.4154 CCCOCCSc1ccccc1CC(=O)C 62a_100011350739_100011215938 [0,1,1,0,0,0|2,0,0]=4 687 B17R1.4154 CCCOCCSc1ccccc1CC(=O)N 62a_100011215938_200009814924 [0,1,1,0,0,0|1,0,0]=3 688 B17R1.4154 CCCOCCSc1ccccc1CC(=O)N 62a_200009814924_100011215938 [0,1,1,0,0,0|1,0,0]=3 689 B17R1.4154 CCCOCCSc1ccccc1NC(=O)N 62a_100011215938_100000742221 [0,1,1,0,0,0|2,0,0]=4 690 B17R1.4154 CCOCCCSc1ccccc1CC(=O)N 62a_100012232248_200009814924 [0,1,1,0,0,0|2,0,0]=4 691 B17R1.4154 CCOCCCSc1ccccc1CC(=O)N 62a_200009814924_100012232248 [0,1,1,0,0,0|2,0,0]=4 692 B17R1.4154 COCCCCSc1ccccc1CC(=O)N 62a_100000730899_200009814924 [0,1,1,0,0,0|2,0,0]=4 693 B17R1.4154 COCCCCSc1ccccc1CC(=O)N 62a_200009814924_100000730899 [0,1,1,0,0,0|2,0,0]=4 694 B17R1.4154 COCCOCSc1ccccc1CC(=O)N 62a_100000231047_200009814924 [0,1,1,0,0,0|2,0,0]=4 695 B17R1.4154 COCCOCSc1ccccc1CC(=O)N 62a_200009814924_100000231047 [0,1,1,0,0,0|2,0,0]=4 696 B17R1.4154 NC(=O)Cc1ccccc1SCCCCCF 62a_100000729378_200009814924 [0,1,1,0,0,0|2,0,0]=4 697 B17R1.4154 NC(=O)Cc1ccccc1SCCCCCF 62a_200009814924_100000729378 [0,1,1,0,0,0|2,0,0]=4 698 B17R1.4154 NC(=O)Cc1ccccc1SCCCCCO 62a_100000746330_200009814924 [0,1,1,0,0,0|2,0,0]=4 699 B17R1.4154 NC(=O)Cc1ccccc1SCCCCCO 62a_200009814924_100000746330 [0,1,1,0,0,0|2,0,0]=4 700 B17R1.4154 NC(=O)Cc1ccccc1SCCOCCO 62a_100011215305_200009814924 [0,1,1,0,0,0|2,0,0]=4 701 B17R1.4154 NC(=O)Cc1ccccc1SCCOCCO 62a_200009814924_100011215305 [0,1,1,0,0,0|2,0,0]=4 702 B17R1.4856 CCCC(=O)CSc1ccccc1CC(=O)N 62a_100000747444_200009814924 [0,1,1,0,0,0|2,0,0]=4 703 B17R1.4856 CCCC(=O)CSc1ccccc1CC(=O)N 62a_200009814924_100000747444 [0,1,1,0,0,0|2,0,0]=4 704 B17R1.4856 CCCC(C)CSc1ccccc1CC(=O)N 62a_100011216630_200009814924 [0,1,1,0,0,0|2,0,0]=4 705 B17R1.4856 CCCC(C)CSc1ccccc1CC(=O)N 62a_200009814924_100011216630 [0,1,1,0,0,0|2,0,0]=4 706 B17R1.4919 CCCCC(C)Sc1ccccc1CC(=O)N 62a_200009814924_200011215066 [0,1,1,0,0,0|2,0,0]=4 707 B17R1.4919 CCCCC(C)Sc1ccccc1CC(=O)N 62a_200011215066_200009814924 [0,1,1,0,0,0|2,0,0]=4 708 B17R1.16277 CC(C)CCCSc1ccccc1CC(=O)N 62a_100011214892_200009814924 [0,1,1,0,0,0|2,0,0]=4 709 B17R1.16277 CC(C)CCCSc1ccccc1CC(=O)N 62a_200009814924_100011214892 [0,1,1,0,0,0|2,0,0]=4 710 B17R1.16277 CC(O)CCCSc1ccccc1CC(=O)N 62a_200000718107_200009814924 [0,1,1,0,0,0|2,0,0]=4 711 B17R1.16277 CC(O)CCCSc1ccccc1CC(=O)N 62a_200009814924_200000718107 [0,1,1,0,0,0|2,0,0]=4 712 B17R1.16894 CCCCCSc1c(cccc1CC(=O)N)C 62a_100000210326_100011096275 [0,1,1,0,0,0|2,0,0]=4 713 B17R1.16894 CCCCCSc1c(cccc1CC(=O)N)C 62a_100011096275_100000210326 [0,1,1,0,0,0|2,0,0]=4 714 B17R2.5261 C=C(C)CCSc1cccc2c1CC(=O)N2 62a_100000730704_100009816812 [1,1,0,0,0,0|1,0,1]=4 715 B17R2.5261 CC(=O)CCSc1cccc2c1CC(=O)N2 62a_100000053229_100009816812 [1,1,0,0,0,0|1,0,1]=4 716 B17R2.5261 CC(C)CC=Cc1cccc2c1CC(=O)N2 271570a_100016259101_100009816812 [1,1,0,0,0,0|0,0,2]=4 717 B17R2.5261 CC(C)CCSc1cccc2c1CC(=O)C2 62a_100010205903_100000210312 [1,1,0,0,0,0|2,0,0]=4 718 B17R2.5261 CC(C)CCSc1cccc2c1CC(=O)N2 62a_100000210312_100009816812 [1,1,0,0,0,0|1,0,0]=3 719 B17R2.5261 CC(C)CCSc1ccnc2c1CC(=O)N2 62a_100000210312_100000104061 [1,1,0,0,0,0|2,0,0]=4 720 B17R2.5261 CC(C)OCSc1cccc2c1CC(=O)N2 62a_100000709892_100009816812 [1,1,0,0,0,0|2,0,0]=4 721 B17R2.5261 CC(O)CCSc1cccc2c1CC(=O)C2 62a_100010205903_100012276601 [1,1,0,0,0,0|2,0,0]=4 722 B17R2.5261 CC(O)CCSc1cccc2c1CC(=O)N2 62a_100012276601_100009816812 [1,1,0,0,0,0|1,0,0]=3 723 B17R2.5261 CC(O)CCSc1ccnc2c1CC(=O)N2 62a_100012276601_100000104061 [1,1,0,0,0,0|2,0,0]=4 724 B17R2.49546 CC(CCO)Sc1cccc2c1CC(=O)N2 62a_100009893172_100009816812 [1,1,0,0,0,0|2,0,0]=4 725 B17R2.49546 CCCC(C)Sc1cccc2c1CC(=O)C2 62a_100010205903_100000766640 [1,1,0,0,0,0|2,0,0]=4 726 B17R2.49546 CCCC(C)Sc1cccc2c1CC(=O)N2 62a_100000766640_100009816812 [1,1,0,0,0,0|1,0,0]=3 727 B17R2.49546 CCCC(C)Sc1ccnc2c1CC(=O)N2 62a_100000766640_100000104061 [1,1,0,0,0,0|2,0,0]=4 728 B17R2.49546 COCC(C)Sc1cccc2c1CC(=O)N2 62a_100000765312_100009816812 [1,1,0,0,0,0|2,0,0]=4 729 B17R2.57657 CCC(=O)CSc1cccc2c1CC(=O)N2 62a_100000747405_100009816812 [1,1,0,0,0,0|1,0,1]=4 730 B17R2.57657 CCC(C)CSc1cccc2c1CC(=O)C2 62a_100010205903_100000748023 [1,1,0,0,0,0|2,0,0]=4 731 B17R2.57657 CCC(C)CSc1cccc2c1CC(=O)N2 62a_100000748023_100009816812 [1,1,0,0,0,0|1,0,0]=3 732 B17R2.57657 CCC(C)CSc1ccnc2c1CC(=O)N2 62a_100000748023_100000104061 [1,1,0,0,0,0|2,0,0]=4 733 B17R2.57657 CCC(O)CSc1cccc2c1CC(=O)C2 62a_100010205903_100011218378 [1,1,0,0,0,0|2,0,0]=4 734 B17R2.57657 CCC(O)CSc1cccc2c1CC(=O)N2 62a_100011218378_100009816812 [1,1,0,0,0,0|1,0,0]=3 735 B17R2.57657 CCC(O)CSc1ccnc2c1CC(=O)N2 62a_100011218378_100000104061 [1,1,0,0,0,0|2,0,0]=4 736 B17R2.57657 CC[C@H](C)CSc1cccc2c1CC(=O)C2 62a_100010205903_100009816398 [1,1,0,0,0,0|2,0,0]=4 737 B17R2.57657 CC[C@H](C)CSc1cccc2c1CC(=O)N2 62a_100009816398_100009816812 [1,1,0,0,0,0|1,0,0]=3 738 B17R2.57657 CC[C@H](C)CSc1ccnc2c1CC(=O)N2 62a_100009816398_100000104061 [1,1,0,0,0,0|2,0,0]=4 739 B17R2.57657 C[C@@H](CO)CSc1cccc2c1CC(=O)N2 62a_100000059175_100009816812 [1,1,0,0,0,0|2,0,0]=4 740 B17R2.57657 O=C1Cc2c(cccc2SCC(O)CO)N1 62a_100011219619_100009816812 [1,1,0,0,0,0|2,0,0]=4 741 B17R2.57657 O=C1Cc2c(cccc2SC[C@@H](O)CF)N1 62a_100015614560_100009816812 [1,1,0,0,0,0|2,0,0]=4 742 B17R2.57657 O=C1Cc2c(cccc2SC[C@@H](O)CO)N1 62a_100009815848_100009816812 [1,1,0,0,0,0|2,0,0]=4 743 B17R2.74646 CCCNC(=O)c1cccc2c1CC(=O)N2 240690a_100020643023_100000098511 [1,1,0,0,0,0|0,0,1]=3 744 B17R2.74646 CCCNC(=O)c1cccc2c1CC(=O)N2 527a_100020643023_100000098511 [1,1,0,0,0,0|0,0,1]=3 745 B17R2.74646 CCNNC(=O)c1cccc2c1CC(=O)N2 22a_100000756455_100000098511 [1,1,0,0,0,0|1,0,1]=4 746 B17R2.74646 O=C1Cc2c(cccc2C(=O)NCCF)N1 240690a_100000724931_100000098511 [1,1,0,0,0,0|1,0,1]=4 747 B17R2.74646 O=C1Cc2c(cccc2C(=O)NCCF)N1 527a_100000724931_100000098511 [1,1,0,0,0,0|1,0,1]=4 748 B17R2.74646 O=C1Cc2c(cccc2C(=O)NCCO)N1 240690a_100000210304_100000098511 [1,1,0,0,0,0|1,0,1]=4 749 B17R2.74646 O=C1Cc2c(cccc2C(=O)NCCO)N1 527a_100000210304_100000098511 [1,1,0,0,0,0|1,0,1]=4 750 B17R2.86719 CCCCSc1cccc2c1cc([nH]2)C=O 62a_100000210211_200010333833 [1,1,0,0,0,0|1,0,1]=4 751 B17R2.86763 CCCCSc1cccc2c1C(=O)C(=O)N2 62a_100000210211_100000697038 [1,1,0,0,0,0|1,0,1]=4 752 B17R2.86763 CCCCSc1cccc2c1C(=O)C(=O)N2 62a_100000697038_100000210210 [1,1,0,0,0,0|1,0,1]=4 753 B17R2.86763 CCCCSc1cccc2c1n(c(=O)[nH]2)C 62a_100000210211_100010994120 [1,1,0,0,0,0|2,0,0]=4 754 B17R2.86927 CCCC=Cc1ccc(c2c1CC(=O)N2)F 271570a_100016258520_100012355367 [1,1,0,0,0,0|0,0,2]=4 755 B17R2.86927 CCCCSc1ccc(c2c1CC(=O)N2)F 62a_100000210211_100012355367 [1,1,0,0,0,0|1,0,0]=3 756 B17R2.86927 CCOCSc1ccc(c2c1CC(=O)N2)F 62a_100000739092_100012355367 [1,1,0,0,0,0|2,0,0]=4 757 B17R2.86927 COCCSc1ccc(c2c1CC(=O)N2)F 62a_100000233755_100012355367 [1,1,0,0,0,0|2,0,0]=4 758 B17R2.86927 CSCCSc1ccc(c2c1CC(=O)N2)F 62a_100000212216_100012355367 [1,1,0,0,0,0|2,0,0]=4 759 B17R2.86927 O=C1Cc2c(ccc(c2N1)F)SCCCF 62a_100011934791_100012355367 [1,1,0,0,0,0|2,0,0]=4 760 B17R2.86927 O=C1Cc2c(ccc(c2N1)F)SCCCO 62a_100011215043_100012355367 [1,1,0,0,0,0|2,0,0]=4 761 B17R2.92163 CCCC=Cc1c(ccc2c1CC(=O)N2)C 271570a_100016258520_100015548004 [1,1,0,0,0,0|0,0,2]=4 762 B17R2.92163 CCCCSc1c(ccc2c1CC(=O)N2)C 62a_100000210211_100015548004 [1,1,0,0,0,0|1,0,0]=3 763 B17R2.92163 CCOCSc1c(ccc2c1CC(=O)N2)C 62a_100000739092_100015548004 [1,1,0,0,0,0|2,0,0]=4 764 B17R2.92163 COCCSc1c(ccc2c1CC(=O)N2)C 62a_100000233755_100015548004 [1,1,0,0,0,0|2,0,0]=4 765 B17R2.92163 CSCCSc1c(ccc2c1CC(=O)N2)C 62a_100000212216_100015548004 [1,1,0,0,0,0|2,0,0]=4 766 B17R2.92163 Cc1ccc2c(c1SCCCF)CC(=O)N2 62a_100011934791_100015548004 [1,1,0,0,0,0|2,0,0]=4 767 B17R2.92163 Cc1ccc2c(c1SCCCO)CC(=O)N2 62a_100011215043_100015548004 [1,1,0,0,0,0|2,0,0]=4 768 B17R2.10878 CCCCCCOc1cccc2c1CCN2 34a_100000703684_100000210314 [1,1,0,0,0,0|1,0,1]=4 769 B17R2.10878 CCCCCCOc1cccc2c1cc[nH]2 34a_100000763377_100000210314 [1,1,0,0,0,0|1,0,1]=4 770 B17R2.10878 CCCCCCSc1cccc2c1CC=C2 62a_100000210314_100009844718 [1,1,0,0,0,0|2,0,0]=4 771 B17R2.10878 CCCCCCSc1cccc2c1CC=C2 62a_100009844718_100000210757 [1,1,0,0,0,0|2,0,0]=4 772 B17R2.10878 CCCCCCSc1cccc2c1CCN2 62a_100000210314_100009817896 [1,1,0,0,0,0|1,0,1]=4 773 B17R2.10878 CCCCCCSc1cccc2c1CCN2 62a_100009817896_100000210757 [1,1,0,0,0,0|1,0,1]=4 774 B17R2.10878 CCCCCCSc1cccc2c1cc[nH]2 62a_100000210314_100000685724 [1,1,0,0,0,0|1,0,1]=4 775 B17R2.10878 CCCCCCSc1cccc2c1nc[nH]2 62a_100000210314_100011935113 [1,1,0,0,0,0|2,0,0]=4 776 B17R2.10878 CCCCCNCc1cccc2c1cc[nH]2 207a_100000209983_100000750904 [1,1,0,0,0,0|1,0,1]=4 777 B17R2.10878 CCCOCCOc1cccc2c1CCN2 34a_100000703684_100011215938 [1,1,0,0,0,0|1,0,1]=4 778 B17R2.10878 CCCOCCOc1cccc2c1cc[nH]2 34a_100000763377_100011215938 [1,1,0,0,0,0|1,0,1]=4 779 B17R2.10878 CCCOCCSc1cccc2c1CC=C2 62a_100009844718_100011215938 [1,1,0,0,0,0|2,0,0]=4 780 B17R2.10878 CCCOCCSc1cccc2c1CC=C2 62a_100011215938_100009844718 [1,1,0,0,0,0|2,0,0]=4 781 B17R2.10878 CCCOCCSc1cccc2c1CCN2 62a_100009817896_100011215938 [1,1,0,0,0,0|1,0,1]=4 782 B17R2.10878 CCCOCCSc1cccc2c1CCN2 62a_100011215938_100009817896 [1,1,0,0,0,0|1,0,1]=4 783 B17R2.10878 CCCOCCSc1cccc2c1cc[nH]2 62a_100011215938_100000685724 [1,1,0,0,0,0|1,0,1]=4 784 B17R2.10878 CCCOCCSc1cccc2c1nc[nH]2 62a_100011215938_100011935113 [1,1,0,0,0,0|2,0,0]=4 785 B17R2.74423 CCCNC(=O)Cc1cccc2c1cc[nH]2 11a_100020643023_100000094506 [1,1,0,0,0,0|0,0,2]=4 786 B17R2.74423 CCCNC(=O)Cc1cccc2c1cc[nH]2 527a_100020643023_100000094506 [1,1,0,0,0,0|0,0,2]=4 787 B19R2.4513 CC(C)CCCOc1cccc2c1CCC(=O)N2 34a_100000066681_100011214892 [0,1,0,0,0,1|2,0,0]=4 788 B19R2.4513 CC(C)CCCOc1cccc2c1CCC(=O)N2 7a_100000066681_100011214892 [0,1,0,0,0,1|2,0,0]=4 789 B19R2.4513 CC(C)CCCSc1cccc2c1CCC(=O)N2 62a_100010232564_100011214892 [0,1,0,0,0,1|2,0,0]=4 790 B19R2.4513 CC(C)CCCSc1cccc2c1CCC(=O)N2 62a_100011214892_100010232564 [0,1,0,0,0,1|2,0,0]=4 791 B19R2.4513 CC(O)CCCOc1cccc2c1CCC(=O)N2 34a_100000066681_200000718107 [0,1,0,0,0,1|2,0,0]=4 792 B19R2.4513 CC(O)CCCOc1cccc2c1CCC(=O)N2 7a_100000066681_200000718107 [0,1,0,0,0,1|2,0,0]=4 793 B19R2.4513 CC(O)CCCSc1cccc2c1CCC(=O)N2 62a_100010232564_200000718107 [0,1,0,0,0,1|2,0,0]=4 794 B19R2.4513 CC(O)CCCSc1cccc2c1CCC(=O)N2 62a_200000718107_100010232564 [0,1,0,0,0,1|2,0,0]=4 795 B19R2.15237 CCCCCC(=O)c1cccc2c1OCC(=O)N2 1458a_100000060354_100000210326 [0,1,0,0,0,1|1,0,1]=4 796 B19R2.15237 CCCNNC(=O)c1cccc2c1OCC(=O)N2 22a_100000740057_100000060354 [0,1,0,0,0,1|1,0,1]=4 797 B19R2.23518 CC/C=C\CCOc1cccc2c1CCC(=O)N2 34a_100000066681_100015370543 [0,1,0,0,0,1|1,0,1]=4 798 B19R2.23518 CC/C=C\CCOc1cccc2c1CCC(=O)N2 7a_100000066681_100015370543 [0,1,0,0,0,1|1,0,1]=4 799 B19R2.23518 CC/C=C\CCSc1cccc2c1CCC(=O)N2 62a_100010232564_100015370543 [0,1,0,0,0,1|1,0,1]=4 800 B19R2.23518 CC/C=C\CCSc1cccc2c1CCC(=O)N2 62a_100015370543_100010232564 [0,1,0,0,0,1|1,0,1]=4 801 B19R2.23518 CCCCCC=Cc1cccc2c1CCC(=O)N2 271570a_100000062253_100010232564 [0,1,0,0,0,1|1,0,1]=4 802 B19R2.23518 CCCCCC=Cc1cccc2c1OCC(=O)N2 271570a_100000062253_100012355675 [0,1,0,0,0,1|1,0,1]=4 803 B19R2.23518 CCCCCCOc1cccc2c1CCC(=O)N2 34a_100000066681_100000210314 [0,1,0,0,0,1|1,0,0]=3 804 B19R2.23518 CCCCCCOc1cccc2c1CCC(=O)N2 7a_100000066681_100000210314 [0,1,0,0,0,1|1,0,0]=3 805 B19R2.23518 CCCCCCSc1cccc2c1CCC(=O)C2 62a_100000210314_100010138409 [0,1,0,0,0,1|2,0,0]=4 806 B19R2.23518 CCCCCCSc1cccc2c1CCC(=O)C2 62a_100010138409_100000210757 [0,1,0,0,0,1|2,0,0]=4 807 B19R2.23518 CCCCCCSc1cccc2c1CCC(=O)N2 62a_100000210314_100010232564 [0,1,0,0,0,1|1,0,0]=3 808 B19R2.23518 CCCCCCSc1cccc2c1CCC(=O)N2 62a_100010232564_100000210757 [0,1,0,0,0,1|1,0,0]=3 809 B19R2.23518 CCCCCCSc1cccc2c1CCC(=O)O2 62a_100000210314_200015620928 [0,1,0,0,0,1|2,0,0]=4 810 B19R2.23518 CCCCCCSc1cccc2c1CCC(=O)O2 62a_200015620928_100000210757 [0,1,0,0,0,1|2,0,0]=4 811 B19R2.23518 CCCCCCSc1cccc2c1ccc(=O)[nH]2 62a_100000210314_100000726145 [0,1,0,0,0,1|1,0,1]=4 812 B19R2.23518 CCCCCCSc1nccc2c1OCC(=O)N2 62a_100000210314_100009863569 [0,1,0,0,0,1|2,0,0]=4 813 B19R2.23518 CCCCOCOc1cccc2c1CCC(=O)N2 34a_100000066681_100011995733 [0,1,0,0,0,1|2,0,0]=4 814 B19R2.23518 CCCCOCSc1cccc2c1CCC(=O)N2 62a_100010232564_100011995733 [0,1,0,0,0,1|2,0,0]=4 815 B19R2.23518 CCCCOCSc1cccc2c1CCC(=O)N2 62a_100011995733_100010232564 [0,1,0,0,0,1|2,0,0]=4 816 B19R2.23518 CCCOCCOc1cccc2c1CCC(=O)N2 34a_100000066681_100011215938 [0,1,0,0,0,1|1,0,0]=3 817 B19R2.23518 CCCOCCOc1cccc2c1CCC(=O)N2 7a_100000066681_100011215938 [0,1,0,0,0,1|1,0,0]=3 818 B19R2.23518 CCCOCCSc1cccc2c1CCC(=O)C2 62a_100010138409_100011215938 [0,1,0,0,0,1|2,0,0]=4 819 B19R2.23518 CCCOCCSc1cccc2c1CCC(=O)C2 62a_100011215938_100010138409 [0,1,0,0,0,1|2,0,0]=4 820 B19R2.23518 CCCOCCSc1cccc2c1CCC(=O)N2 62a_100010232564_100011215938 [0,1,0,0,0,1|1,0,0]=3 821 B19R2.23518 CCCOCCSc1cccc2c1CCC(=O)N2 62a_100011215938_100010232564 [0,1,0,0,0,1|1,0,0]=3 822 B19R2.23518 CCCOCCSc1cccc2c1CCC(=O)O2 62a_100011215938_200015620928 [0,1,0,0,0,1|2,0,0]=4 823 B19R2.23518 CCCOCCSc1cccc2c1CCC(=O)O2 62a_200015620928_100011215938 [0,1,0,0,0,1|2,0,0]=4 824 B19R2.23518 CCCOCCSc1cccc2c1ccc(=O)[nH]2 62a_100011215938_100000726145 [0,1,0,0,0,1|1,0,1]=4 825 B19R2.23518 CCCOCCSc1nccc2c1OCC(=O)N2 62a_100011215938_100009863569 [0,1,0,0,0,1|2,0,0]=4 826 B19R2.23518 CCOCCCOc1cccc2c1CCC(=O)N2 34a_100000066681_100012232248 [0,1,0,0,0,1|2,0,0]=4 827 B19R2.23518 CCOCCCOc1cccc2c1CCC(=O)N2 7a_100000066681_100012232248 [0,1,0,0,0,1|2,0,0]=4 828 B19R2.23518 CCOCCCSc1cccc2c1CCC(=O)N2 62a_100010232564_100012232248 [0,1,0,0,0,1|2,0,0]=4 829 B19R2.23518 CCOCCCSc1cccc2c1CCC(=O)N2 62a_100012232248_100010232564 [0,1,0,0,0,1|2,0,0]=4 830 B19R2.23518 COCCCCOc1cccc2c1CCC(=O)N2 34a_100000066681_100000755781 [0,1,0,0,0,1|2,0,0]=4 831 B19R2.23518 COCCCCOc1cccc2c1CCC(=O)N2 7a_100000066681_100000730899 [0,1,0,0,0,1|2,0,0]=4 832 B19R2.23518 COCCCCSc1cccc2c1CCC(=O)N2 62a_100000730899_100010232564 [0,1,0,0,0,1|2,0,0]=4 833 B19R2.23518 COCCCCSc1cccc2c1CCC(=O)N2 62a_100010232564_100000730899 [0,1,0,0,0,1|2,0,0]=4 834 B19R2.23518 COCCOCSc1cccc2c1CCC(=O)N2 62a_100000231047_100010232564 [0,1,0,0,0,1|2,0,0]=4 835 B19R2.23518 COCCOCSc1cccc2c1CCC(=O)N2 62a_100010232564_100000231047 [0,1,0,0,0,1|2,0,0]=4 836 B19R2.23518 O=C1CCc2c(cccc2OCCCCCF)N1 34a_100000066681_100000729378 [0,1,0,0,0,1|2,0,0]=4 837 B19R2.23518 O=C1CCc2c(cccc2OCCCCCF)N1 7a_100000066681_100000729378 [0,1,0,0,0,1|2,0,0]=4 838 B19R2.23518 O=C1CCc2c(cccc2OCCCCCO)N1 34a_100000066681_100000746330 [0,1,0,0,0,1|2,0,0]=4 839 B19R2.23518 O=C1CCc2c(cccc2OCCCCCO)N1 7a_100000066681_100000746330 [0,1,0,0,0,1|2,0,0]=4 840 B19R2.23518 O=C1CCc2c(cccc2OCCOCCO)N1 34a_100000066681_100000692535 [0,1,0,0,0,1|2,0,0]=4 841 B19R2.23518 O=C1CCc2c(cccc2OCCOCCO)N1 7a_100000066681_100011215305 [0,1,0,0,0,1|2,0,0]=4 842 B19R2.23518 O=C1CCc2c(cccc2SCCCCCF)N1 62a_100000729378_100010232564 [0,1,0,0,0,1|2,0,0]=4 843 B19R2.23518 O=C1CCc2c(cccc2SCCCCCF)N1 62a_100010232564_100000729378 [0,1,0,0,0,1|2,0,0]=4 844 B19R2.23518 O=C1CCc2c(cccc2SCCCCCO)N1 62a_100000746330_100010232564 [0,1,0,0,0,1|2,0,0]=4 845 B19R2.23518 O=C1CCc2c(cccc2SCCCCCO)N1 62a_100010232564_100000746330 [0,1,0,0,0,1|2,0,0]=4 846 B19R2.23518 O=C1CCc2c(cccc2SCCOCCO)N1 62a_100010232564_100011215305 [0,1,0,0,0,1|2,0,0]=4 847 B19R2.23518 O=C1CCc2c(cccc2SCCOCCO)N1 62a_100011215305_100010232564 [0,1,0,0,0,1|2,0,0]=4 848 B19R2.199557 CCCCC(C)Oc1cccc2c1CCC(=O)N2 34a_100000066681_200011215066 [0,1,0,0,0,1|2,0,0]=4 849 B19R2.199557 CCCCC(C)Oc1cccc2c1CCC(=O)N2 7a_100000066681_200011215066 [0,1,0,0,0,1|2,0,0]=4 850 B19R2.199557 CCCCC(C)Sc1cccc2c1CCC(=O)N2 62a_100010232564_200011215066 [0,1,0,0,0,1|2,0,0]=4 851 B19R2.199557 CCCCC(C)Sc1cccc2c1CCC(=O)N2 62a_200011215066_100010232564 [0,1,0,0,0,1|2,0,0]=4 852 B19R2.199557 CCCNC(=O)Nc1cccc2c1OCC(=O)N2 2430a_100000685337_100020643023 [0,1,0,0,0,1|1,0,1]=4 853 B19R2.199557 CCCNC(=O)Nc1cccc2c1OCC(=O)N2 512a_100000685337_100020643023 [0,1,0,0,0,1|1,0,1]=4 854 B19R2.202032 CCCC(=O)COc1cccc2c1CCC(=O)N2 7a_100000066681_100000747444 [0,1,0,0,0,1|2,0,0]=4 855 B19R2.202032 CCCC(=O)CSc1cccc2c1CCC(=O)N2 62a_100000747444_100010232564 [0,1,0,0,0,1|2,0,0]=4 856 B19R2.202032 CCCC(=O)CSc1cccc2c1CCC(=O)N2 62a_100010232564_100000747444 [0,1,0,0,0,1|2,0,0]=4 857 B19R2.202032 CCCC(C)COc1cccc2c1CCC(=O)N2 34a_100000066681_100011216630 [0,1,0,0,0,1|2,0,0]=4 858 B19R2.202032 CCCC(C)COc1cccc2c1CCC(=O)N2 7a_100000066681_100011216630 [0,1,0,0,0,1|2,0,0]=4 859 B19R2.202032 CCCC(C)CSc1cccc2c1CCC(=O)N2 62a_100010232564_100011216630 [0,1,0,0,0,1|2,0,0]=4 860 B19R2.202032 CCCC(C)CSc1cccc2c1CCC(=O)N2 62a_100011216630_100010232564 [0,1,0,0,0,1|2,0,0]=4 861 B19R2.4427898 CCCCCSc1cccc2c1CN(C(=O)N2)C 62a_200010992586_100000210326 [0,1,0,0,0,1|2,0,0]=4 862 B19R2.279200 CCCCCCSc1cccc2c1CC(=O)CC2 62a_100010006498_100000210757 [0,1,0,0,0,1|2,0,0]=4 863 B19R2.279200 CCCOCCSc1cccc2c1CC(=O)CC2 62a_100010006498_100011215938 [0,1,0,0,0,1|2,0,0]=4 864 B19R2.7658 CC(C)CCC(C)Sc1cccc2c1CC(=O)N2 62a_100011261404_100009816812 [0,2,0,0,0,0|2,0,0]=4 865 B19R2.101050 CC(C)CNNC(=O)c1cccc2c1CC(=O)N2 22a_100000696102_100000098511 [0,2,0,0,0,0|1,0,1]=4 866 B19R2.101050 CC(O)CNNC(=O)c1cccc2c1CC(=O)N2 22a_200000730056_100000098511 [0,2,0,0,0,0|1,0,1]=4 867 B19R2.101072 CC(C)(O)CCCSc1cccc2c1CC(=O)N2 62a_100009888830_100009816812 [0,2,0,0,0,0|2,0,0]=4 868 B19R2.488789 Cc1ccc2c(c1SCCCC(C)C)CC(=O)N2 62a_100011214892_100015548004 [0,2,0,0,0,0|2,0,0]=4 869 B19R2.488789 Cc1ccc2c(c1SCCCC(C)O)CC(=O)N2 62a_200000718107_100015548004 [0,2,0,0,0,0|2,0,0]=4 870 B19R2.923121 CC(C)CCCSc1ccc(c2c1CC(=O)N2)F 62a_100011214892_100012355367 [0,2,0,0,0,0|2,0,0]=4 871 B19R2.923121 CC(O)CCCSc1ccc(c2c1CC(=O)N2)F 62a_200000718107_100012355367 [0,2,0,0,0,0|2,0,0]=4 872 B19R2.260768 CCCCCNC(=O)c1cccc2c1CC(=O)N2 240690a_100000209983_100000098511 [0,2,0,0,0,0|1,0,1]=4 873 B19R2.260768 CCCCCNC(=O)c1cccc2c1CC(=O)N2 527a_100000209983_100000098511 [0,2,0,0,0,0|1,0,1]=4 874 B19R2.260768 CCCCNNC(=O)c1cccc2c1CC(=O)N2 22a_100025702795_100000098511 [0,2,0,0,0,0|1,0,1]=4 875 B19R2.260768 COCCNNC(=O)c1cccc2c1CC(=O)N2 22a_100000741390_100000098511 [0,2,0,0,0,0|1,0,1]=4 876 B19R2.505848 CCC(C)NNC(=O)c1cccc2c1CC(=O)N2 22a_100000718999_100000098511 [0,2,0,0,0,0|1,0,1]=4 877 B19R2.7657 CC(=O)CCCCSc1cccc2c1CC(=O)N2 62a_100000735457_100009816812 [0,2,0,0,0,0|1,0,1]=4 878 B19R2.7657 CC(C)CCCCSc1cccc2c1CC(=O)C2 62a_100010205903_100011216152 [0,2,0,0,0,0|2,0,0]=4 879 B19R2.7657 CC(C)CCCCSc1cccc2c1CC(=O)N2 62a_100011216152_100009816812 [0,2,0,0,0,0|1,0,0]=3 880 B19R2.7657 CC(C)CCCCSc1ccnc2c1CC(=O)N2 62a_100011216152_100000104061 [0,2,0,0,0,0|2,0,0]=4 881 B19R2.7657 O=C1Cc2c(cccc2SCCOCC(F)F)N1 62a_200012177212_100009816812 [0,2,0,0,0,0|2,0,0]=4 882 B19R2.14775 CCCCCC(C)Sc1cccc2c1CC(=O)C2 62a_100010205903_200011218191 [0,2,0,0,0,0|2,0,0]=4 883 B19R2.14775 CCCCCC(C)Sc1cccc2c1CC(=O)N2 62a_200011218191_100009816812 [0,2,0,0,0,0|1,0,0]=3 884 B19R2.14775 CCCCCC(C)Sc1ccnc2c1CC(=O)N2 62a_200011218191_100000104061 [0,2,0,0,0,0|2,0,0]=4 885 B19R2.116118 C#CCCCCCSc1cccc2c1CC(=O)N2 62a_100012094781_100009816812 [0,2,0,0,0,0|1,0,1]=4 886 B19R2.116118 C=CCCCCCSc1cccc2c1CC(=O)N2 62a_100000700193_100009816812 [0,2,0,0,0,0|1,0,1]=4 887 B19R2.116118 CCCCCCC=Cc1cccc2c1CC(=O)C2 271570a_200015348155_100010205903 [0,2,0,0,0,0|2,0,0]=4 888 B19R2.116118 CCCCCCC=Cc1cccc2c1CC(=O)N2 271570a_200015348155_100009816812 [0,2,0,0,0,0|1,0,0]=3 889 B19R2.116118 CCCCCCC=Cc1cccc2c1oc(=O)[nH]2 271570a_200015348155_100012360093 [0,2,0,0,0,0|2,0,0]=4 890 B19R2.116118 CCCCCCC=Cc1ccnc2c1CC(=O)N2 271570a_200015348155_100000104061 [0,2,0,0,0,0|2,0,0]=4 891 B19R2.116118 CCCCCCCSc1cccc2c1CC(=O)C2 62a_100010205903_100000210316 [0,2,0,0,0,0|2,0,0]=4 892 B19R2.116118 CCCCCCCSc1cccc2c1CC(=O)N2 62a_100000210614_100009816812 [0,2,0,0,0,0|1,0,0]=3 893 B19R2.116118 CCCCCCCSc1ccnc2c1CC(=O)N2 62a_100000210614_100000104061 [0,2,0,0,0,0|2,0,0]=4 894 B19R2.116118 CCCCOCCSc1cccc2c1CC(=O)C2 62a_100010205903_100000743108 [0,2,0,0,0,0|2,0,0]=4 895 B19R2.116118 CCCCOCCSc1cccc2c1CC(=O)N2 62a_100000743108_100009816812 [0,2,0,0,0,0|1,0,0]=3 896 B19R2.116118 CCCCOCCSc1ccnc2c1CC(=O)N2 62a_100000743108_100000104061 [0,2,0,0,0,0|2,0,0]=4 897 B19R2.116118 COCCOCCSc1cccc2c1CC(=O)C2 62a_100010205903_100000695917 [0,2,0,0,0,0|2,0,0]=4 898 B19R2.116118 COCCOCCSc1cccc2c1CC(=O)N2 62a_100000695917_100009816812 [0,2,0,0,0,0|1,0,0]=3 899 B19R2.116118 COCCOCCSc1ccnc2c1CC(=O)N2 62a_100000695917_100000104061 [0,2,0,0,0,0|2,0,0]=4 900 B19R2.116118 N#CCCCCCSc1cccc2c1CC(=O)N2 62a_100009813376_100009816812 [0,2,0,0,0,0|1,0,1]=4 901 B19R2.116118 O=C1Cc2c(cccc2SCCCCCCF)N1 62a_100015922095_100009816812 [0,2,0,0,0,0|1,0,0]=3 902 B19R2.116118 O=C1Cc2c(cccc2SCCCCCCO)N1 62a_100000766143_100009816812 [0,2,0,0,0,0|1,0,0]=3 903 B19R2.116118 O=C1Cc2c(ccnc2N1)SCCCCCCF 62a_100015922095_100000104061 [0,2,0,0,0,0|2,0,0]=4 904 B19R2.116118 O=C1Cc2c(ccnc2N1)SCCCCCCO 62a_100000766143_100000104061 [0,2,0,0,0,0|2,0,0]=4 905 B19R2.116118 O=C1Cc2cccc(c2C1)SCCCCCCF 62a_100010205903_100015922095 [0,2,0,0,0,0|2,0,0]=4 906 B19R2.116118 O=C1Cc2cccc(c2C1)SCCCCCCO 62a_100010205903_100000766143 [0,2,0,0,0,0|2,0,0]=4 907 B19R2.116118 O=CCCCCCSc1cccc2c1CC(=O)N2 62a_100000139337_100009816812 [0,2,0,0,0,0|1,0,1]=4 908 B19R2.131605 CCNC(=O)CCSc1cccc2c1CC(=O)N2 62a_100000737597_100009816812 [0,2,0,0,0,0|2,0,0]=4 909 B19R2.131605 CCOC(=O)CCSc1cccc2c1CC(=O)N2 62a_100000765890_100009816812 [0,2,0,0,0,0|2,0,0]=4 910 B19R2.199789 CCCNC(=O)CSc1cccc2c1CC(=O)C2 62a_100010205903_100000183358 [0,2,0,0,0,0|1,0,1]=4 911 B19R2.199789 CCCNC(=O)CSc1cccc2c1CC(=O)N2 62a_100000183358_100009816812 [0,2,0,0,0,0|0,0,1]=3 912 B19R2.199789 CCCNC(=O)CSc1ccnc2c1CC(=O)N2 62a_100000183358_100000104061 [0,2,0,0,0,0|1,0,1]=4 913 B19R2.199789 CCCOC(=O)CSc1cccc2c1CC(=O)N2 62a_200011215008_100009816812 [0,2,0,0,0,0|1,0,1]=4 914 B19R2.279160 CCCCCCSc1cccc2c1cc([nH]2)C=O 62a_100000210314_200010333833 [0,2,0,0,0,0|1,0,1]=4 915 B19R2.279160 CCCOCCSc1cccc2c1cc([nH]2)C=O 62a_100011215938_200010333833 [0,2,0,0,0,0|1,0,1]=4 916 B19R2.279207 CCCCCCSc1cccc2c1C(=O)C(=O)N2 62a_100000210314_100000697038 [0,2,0,0,0,0|1,0,1]=4 917 B19R2.279207 CCCCCCSc1cccc2c1C(=O)C(=O)N2 62a_100000697038_100000210757 [0,2,0,0,0,0|1,0,1]=4 918 B19R2.279207 CCCCCCSc1cccc2c1n(c(=O)[nH]2)C 62a_100000210314_100010994120 [0,2,0,0,0,0|2,0,0]=4 919 B19R2.279207 CCCOCCSc1cccc2c1C(=O)C(=O)N2 62a_100000697038_100011215938 [0,2,0,0,0,0|1,0,1]=4 920 B19R2.279207 CCCOCCSc1cccc2c1C(=O)C(=O)N2 62a_100011215938_100000697038 [0,2,0,0,0,0|1,0,1]=4 921 B19R2.279207 CCCOCCSc1cccc2c1n(c(=O)[nH]2)C 62a_100011215938_100010994120 [0,2,0,0,0,0|2,0,0]=4 922 B19R2.279402 CC/C=C\CCSc1ccc(c2c1CC(=O)N2)F 62a_100015370543_100012355367 [0,2,0,0,0,0|1,0,1]=4 923 B19R2.279402 CCCCCC=Cc1ccc(c2c1CC(=O)N2)F 271570a_100000062253_100012355367 [0,2,0,0,0,0|1,0,1]=4 924 B19R2.279402 CCCCCCSc1ccc(c2c1CC(=O)N2)F 62a_100000210314_100012355367 [0,2,0,0,0,0|1,0,0]=3 925 B19R2.279402 CCCCOCSc1ccc(c2c1CC(=O)N2)F 62a_100011995733_100012355367 [0,2,0,0,0,0|2,0,0]=4 926 B19R2.279402 CCCOCCSc1ccc(c2c1CC(=O)N2)F 62a_100011215938_100012355367 [0,2,0,0,0,0|1,0,0]=3 927 B19R2.279402 CCOCCCSc1ccc(c2c1CC(=O)N2)F 62a_100012232248_100012355367 [0,2,0,0,0,0|2,0,0]=4 928 B19R2.279402 COCCCCSc1ccc(c2c1CC(=O)N2)F 62a_100000730899_100012355367 [0,2,0,0,0,0|2,0,0]=4 929 B19R2.279402 COCCOCSc1ccc(c2c1CC(=O)N2)F 62a_100000231047_100012355367 [0,2,0,0,0,0|2,0,0]=4 930 B19R2.279402 O=C1Cc2c(ccc(c2N1)F)SCCCCCF 62a_100000729378_100012355367 [0,2,0,0,0,0|2,0,0]=4 931 B19R2.279402 O=C1Cc2c(ccc(c2N1)F)SCCCCCO 62a_100000746330_100012355367 [0,2,0,0,0,0|2,0,0]=4 932 B19R2.279402 O=C1Cc2c(ccc(c2N1)F)SCCOCCO 62a_100011215305_100012355367 [0,2,0,0,0,0|2,0,0]=4 933 B19R2.1353929 CC/C=C\CCSc1c(ccc2c1CC(=O)N2)C 62a_100015370543_100015548004 [0,2,0,0,0,0|1,0,1]=4 934 B19R2.1353929 CCCCCC=Cc1c(ccc2c1CC(=O)N2)C 271570a_100000062253_100015548004 [0,2,0,0,0,0|1,0,1]=4 935 B19R2.1353929 CCCCCCSc1c(ccc2c1CC(=O)N2)C 62a_100000210314_100015548004 [0,2,0,0,0,0|1,0,0]=3 936 B19R2.1353929 CCCCOCSc1c(ccc2c1CC(=O)N2)C 62a_100011995733_100015548004 [0,2,0,0,0,0|2,0,0]=4 937 B19R2.1353929 CCCOCCSc1c(ccc2c1CC(=O)N2)C 62a_100011215938_100015548004 [0,2,0,0,0,0|1,0,0]=3 938 B19R2.1353929 CCOCCCSc1c(ccc2c1CC(=O)N2)C 62a_100012232248_100015548004 [0,2,0,0,0,0|2,0,0]=4 939 B19R2.1353929 COCCCCSc1c(ccc2c1CC(=O)N2)C 62a_100000730899_100015548004 [0,2,0,0,0,0|2,0,0]=4 940 B19R2.1353929 COCCOCSc1c(ccc2c1CC(=O)N2)C 62a_100000231047_100015548004 [0,2,0,0,0,0|2,0,0]=4 941 B19R2.1353929 Cc1ccc2c(c1SCCCCCF)CC(=O)N2 62a_100000729378_100015548004 [0,2,0,0,0,0|2,0,0]=4 942 B19R2.1353929 Cc1ccc2c(c1SCCCCCO)CC(=O)N2 62a_100000746330_100015548004 [0,2,0,0,0,0|2,0,0]=4 943 B19R2.1353929 Cc1ccc2c(c1SCCOCCO)CC(=O)N2 62a_100011215305_100015548004 [0,2,0,0,0,0|2,0,0]=4 944 B19R2.218780 CCCCC(CC)Sc1cccc2c1CC(=O)N2 62a_200011216223_100009816812 [0,2,0,0,0,0|2,0,0]=4 945 B19R2.1679843 CCCCC(C)Sc1ccc(c2c1CC(=O)N2)F 62a_200011215066_100012355367 [0,2,0,0,0,0|2,0,0]=4 946 B19R2.2865337 CCCCC(C)Sc1c(ccc2c1CC(=O)N2)C 62a_200011215066_100015548004 [0,2,0,0,0,0|2,0,0]=4 947 B19R2.1700541 CCCC(=O)CSc1ccc(c2c1CC(=O)N2)F 62a_100000747444_100012355367 [0,2,0,0,0,0|2,0,0]=4 948 B19R2.1700541 CCCC(C)CSc1ccc(c2c1CC(=O)N2)F 62a_100011216630_100012355367 [0,2,0,0,0,0|2,0,0]=4 949 B19R2.6647133 CCCC(=O)CSc1c(ccc2c1CC(=O)N2)C 62a_100000747444_100015548004 [0,2,0,0,0,0|2,0,0]=4 950 B19R2.6647133 CCCC(C)CSc1c(ccc2c1CC(=O)N2)C 62a_100011216630_100015548004 [0,2,0,0,0,0|2,0,0]=4 951 B17R2.247 CC(=O)Nc1cccc(c1)N2CCCCC2 11a_100000215675_100015343762 [0,0,1,1,0,0|2,0,0]=4 952 B17R2.247 CC(=O)Nc1cccc(c1)N2CCCCC2 1626a_100000215675_100015343762 [0,0,1,1,0,0|2,0,0]=4 953 B17R2.247 CC(=O)Nc1cccc(c1)N2CCCCC2 22a_100000215675_100000070787 [0,0,1,1,0,0|2,0,0]=4 954 B17R2.247 CC(=O)Nc1cccc(c1)N2CCCCC2 527a_100000215675_100103153847 [0,0,1,1,0,0|2,0,0]=4 955 B17R2.845 CC(=O)Nc1cccc(c1)CN2CCCC2 11a_100000738244_100015343762 [0,0,1,1,0,0|2,0,0]=4 956 B17R2.845 CC(=O)Nc1cccc(c1)CN2CCCC2 1626a_100000738244_100015343762 [0,0,1,1,0,0|2,0,0]=4 957 B17R2.845 CC(=O)Nc1cccc(c1)CN2CCCC2 22a_100000738244_100000070787 [0,0,1,1,0,0|2,0,0]=4 958 B17R2.845 CC(=O)Nc1cccc(c1)CN2CCCC2 270004a_100000188435_100011257792 [0,0,1,1,0,0|2,0,0]=4 959 B17R2.845 CC(=O)Nc1cccc(c1)CN2CCCC2 527a_100000738244_100103153847 [0,0,1,1,0,0|2,0,0]=4 960 B17R2.845 CC(=O)Nc1cccc(c1)NC2CCCC2 34a_100000749408_100000179811 [0,0,1,1,0,0|2,0,0]=4 961 B17R2.845 CC(=O)Nc1cccc(c1)OC2CCCC2 11a_200000736819_100015343762 [0,0,1,1,0,0|2,0,0]=4 962 B17R2.845 CC(=O)Nc1cccc(c1)OC2CCCC2 1626a_200000736819_100015343762 [0,0,1,1,0,0|2,0,0]=4 963 B17R2.845 CC(=O)Nc1cccc(c1)OC2CCCC2 22a_200000736819_100000070787 [0,0,1,1,0,0|2,0,0]=4 964 B17R2.845 CC(=O)Nc1cccc(c1)OC2CCCC2 34a_100000158604_100000179811 [0,0,1,1,0,0|2,0,0]=4 965 B17R2.845 CC(=O)Nc1cccc(c1)OC2CCCC2 527a_200000736819_100103153847 [0,0,1,1,0,0|2,0,0]=4 966 B17R2.845 CC(=O)Nc1cccc(c1)OC2CCCC2 7a_100000158604_100000179811 [0,0,1,1,0,0|2,0,0]=4 967 B17R2.845 CC(=O)Nc1cccc(c1)SC2CCCC2 62a_100011217020_100000153616 [0,0,1,1,0,0|2,0,0]=4 968 B17R2.22331 CCCCCSc1ccc2c(c1)NC(=O)C2 62a_100000210326_100000760487 [0,0,1,1,0,0|2,0,0]=4 969 B17R2.27437 CCCn1cnc2c1ccc(c2)NC(=O)C 11a_100015185579_100015343762 [0,0,1,1,0,0|1,0,1]=4 970 B17R2.27437 CCCn1cnc2c1ccc(c2)NC(=O)C 1626a_100015185579_100015343762 [0,0,1,1,0,0|1,0,1]=4 971 B17R2.27437 CCCn1cnc2c1ccc(c2)NC(=O)C 22a_100015185579_100000070787 [0,0,1,1,0,0|1,0,1]=4 972 B17R2.27437 CCCn1cnc2c1ccc(c2)NC(=O)C 527a_100015185579_100103153847 [0,0,1,1,0,0|1,0,1]=4 973 B17R2.27437 CCNC1CCc2c1ccc(c2)NC(=O)C 269862a_100015525214_100000015031 [0,0,1,1,0,0|2,0,0]=4 974 B17R2.60515 CC(=O)Nc1cccc(c1)C=NNC2CC2 4a_100000701032_100011257792 [0,0,1,1,0,0|1,0,1]=4 975 B17R2.60515 CC(=O)Nc1cccc(c1)CNCC2CC2 207a_100000735609_100011257792 [0,0,1,1,0,0|2,0,0]=4 976 B17R2.60515 CC(=O)Nc1cccc(c1)CNCC2CC2 2230a_100000740035_100000742324 [0,0,1,1,0,0|2,0,0]=4 977 B17R2.60515 CC(=O)Nc1cccc(c1)CNCC2CC2 269862a_100000740035_100000741477 [0,0,1,1,0,0|2,0,0]=4 978 B17R2.60515 CC(=O)Nc1cccc(c1)CNCC2CC2 270004a_100000735609_100011257792 [0,0,1,1,0,0|2,0,0]=4 979 B17R2.60515 CC(=O)Nc1cccc(c1)CNCC2CC2 34a_100000740035_100000742324 [0,0,1,1,0,0|2,0,0]=4 980 B17R2.60515 CC(=O)Nc1cccc(c1)COCC2CC2 11a_100000745843_100015343762 [0,0,1,1,0,0|2,0,0]=4 981 B17R2.60515 CC(=O)Nc1cccc(c1)COCC2CC2 1626a_100000745843_100015343762 [0,0,1,1,0,0|2,0,0]=4 982 B17R2.60515 CC(=O)Nc1cccc(c1)COCC2CC2 22a_100000745843_100000070787 [0,0,1,1,0,0|2,0,0]=4 983 B17R2.60515 CC(=O)Nc1cccc(c1)COCC2CC2 527a_100000745843_100103153847 [0,0,1,1,0,0|2,0,0]=4 984 B17R2.60515 CC(=O)Nc1cccc(c1)NCCC2CC2 34a_100000749408_100000694398 [0,0,1,1,0,0|2,0,0]=4 985 B17R2.60515 CC(=O)Nc1cccc(c1)OCCC2CC2 34a_100000158604_100000694398 [0,0,1,1,0,0|2,0,0]=4 986 B17R2.60515 CC(=O)Nc1cccc(c1)OCCC2CC2 7a_100000158604_100000764125 [0,0,1,1,0,0|2,0,0]=4 987 B17R2.60515 CC(=O)Nc1cccc(c1)SCCC2CC2 62a_100000764125_100000153616 [0,0,1,1,0,0|2,0,0]=4 988 B17R2.60516 CC(=O)Nc1cccc(c1)CNC2CCC2 270004a_100000740035_100000241760 [0,0,1,1,0,0|2,0,0]=4 989 B17R2.60516 CC(=O)Nc1cccc(c1)CNC2CCC2 34a_100000740035_100000749161 [0,0,1,1,0,0|2,0,0]=4 990 B17R2.60516 CC(=O)Nc1cccc(c1)NCC2CCC2 34a_100000749408_100000763275 [0,0,1,1,0,0|2,0,0]=4 991 B17R2.60516 CC(=O)Nc1cccc(c1)OCC2CCC2 34a_100000158604_100000763275 [0,0,1,1,0,0|2,0,0]=4 992 B17R2.60516 CC(=O)Nc1cccc(c1)OCC2CCC2 7a_100000158604_100000763275 [0,0,1,1,0,0|2,0,0]=4 993 B17R2.60516 CC(=O)Nc1cccc(c1)SCC2CCC2 62a_100000763275_100000153616 [0,0,1,1,0,0|2,0,0]=4 994 B17R2.63310 CNC1CCCc2c1ccc(c2)NC(=O)C 269862a_106832991636_100000043750 [0,0,1,1,0,0|2,0,0]=4 995 B17R2.855 NC(=O)Cc1ccccc1SC2CCCC2 62a_100011217020_200009814924 [0,0,1,1,0,0|2,0,0]=4 996 B17R2.855 NC(=O)Cc1ccccc1SC2CCCC2 62a_200009814924_100000179811 [0,0,1,1,0,0|2,0,0]=4 997 B17R2.10039 CCCN1CCc2ccccc2[C@@H]1C(=O)O 269956a_103496528863_100000210207 [0,0,1,1,0,0|1,0,0]=3 998 B17R2.10039 COCN1CCc2ccccc2[C@@H]1C(=O)O 269956a_103496528863_100000766300 [0,0,1,1,0,0|2,0,0]=4 999 B17R2.10039 CSCN1CCc2ccccc2[C@@H]1C(=O)O 269956a_103496528863_100011218213 [0,0,1,1,0,0|2,0,0]=4 1000 B17R2.10039 O=C(O)[C@H]1c2ccccc2CCN1CCF 269956a_103496528863_100011217306 [0,0,1,1,0,0|2,0,0]=4 1001 B17R2.10039 O=C(O)[C@H]1c2ccccc2CCN1CCO 269956a_103496528863_100000211926 [0,0,1,1,0,0|2,0,0]=4 1002 B17R2.60647 NC(=O)Cc1ccccc1SCCC2CC2 62a_100000764125_200009814924 [0,0,1,1,0,0|2,0,0]=4 1003 B17R2.60647 NC(=O)Cc1ccccc1SCCC2CC2 62a_200009814924_100000764125 [0,0,1,1,0,0|2,0,0]=4 1004 B17R2.60657 NC(=O)Cc1ccccc1SCC2CCC2 62a_100000763275_200009814924 [0,0,1,1,0,0|2,0,0]=4 1005 B17R2.60657 NC(=O)Cc1ccccc1SCC2CCC2 62a_200009814924_100000763275 [0,0,1,1,0,0|2,0,0]=4 1006 B17R3.135 O=C1Cc2c(cccc2C3=CCCC3)N1 271570a_100000089523_100009816812 [1,0,0,1,0,0|0,0,2]=4 1007 B17R3.5234 O=C1Cc2cccc(c2C1)SC3CCC3 62a_100010205903_100000749161 [1,0,0,1,0,0|2,0,0]=4 1008 B17R3.5236 O=C1Cc2c(cccc2N1)C#CC3CC3 271570a_200009880635_100009816812 [1,0,0,1,0,0|0,0,2]=4 1009 B17R3.5236 O=C1Cc2c(cccc2N1)C=CC3CC3 271570a_100102526188_100009816812 [1,0,0,1,0,0|0,0,2]=4 1010 B17R3.5236 O=C1Cc2c(cccc2SCC3CC3)N1 62a_100000756562_100009816812 [1,0,0,1,0,0|1,0,0]=3 1011 B17R3.5236 O=C1Cc2c(cccc2SCC3CO3)N1 62a_102125554688_100009816812 [1,0,0,1,0,0|2,0,0]=4 1012 B17R3.5236 O=C1Cc2c(cccc2SCC3CS3)N1 62a_100000031435_100009816812 [1,0,0,1,0,0|2,0,0]=4 1013 B17R3.5236 O=C1Cc2c(cccc2SC[C@@H]3CO3)N1 62a_100000745022_100009816812 [1,0,0,1,0,0|2,0,0]=4 1014 B17R3.5236 O=C1Cc2c(ccnc2N1)SCC3CC3 62a_100000756562_100000104061 [1,0,0,1,0,0|2,0,0]=4 1015 B17R3.5236 O=C1Cc2cccc(c2C1)SCC3CC3 62a_100010205903_100000742324 [1,0,0,1,0,0|2,0,0]=4 1016 B19R3.4206 O=C1CCc2c(cccc2OC3CCCC3)N1 34a_100000066681_100000179811 [0,0,0,1,0,1|2,0,0]=4 1017 B19R3.4206 O=C1CCc2c(cccc2OC3CCCC3)N1 7a_100000066681_100000179811 [0,0,0,1,0,1|2,0,0]=4 1018 B19R3.4206 O=C1CCc2c(cccc2SC3CCCC3)N1 62a_100010232564_100000179811 [0,0,0,1,0,1|2,0,0]=4 1019 B19R3.4206 O=C1CCc2c(cccc2SC3CCCC3)N1 62a_100011217020_100010232564 [0,0,0,1,0,1|2,0,0]=4 1020 B19R3.4215 O=C1CCc2c(cccc2OCCC3CC3)N1 34a_100000066681_100000694398 [0,0,0,1,0,1|2,0,0]=4 1021 B19R3.4215 O=C1CCc2c(cccc2OCCC3CC3)N1 7a_100000066681_100000764125 [0,0,0,1,0,1|2,0,0]=4 1022 B19R3.4215 O=C1CCc2c(cccc2SCCC3CC3)N1 62a_100000764125_100010232564 [0,0,0,1,0,1|2,0,0]=4 1023 B19R3.4215 O=C1CCc2c(cccc2SCCC3CC3)N1 62a_100010232564_100000764125 [0,0,0,1,0,1|2,0,0]=4 1024 B19R3.59498 O=C1CCc2c(cccc2OCC3CCC3)N1 34a_100000066681_100000763275 [0,0,0,1,0,1|2,0,0]=4 1025 B19R3.59498 O=C1CCc2c(cccc2OCC3CCC3)N1 7a_100000066681_100000763275 [0,0,0,1,0,1|2,0,0]=4 1026 B19R3.59498 O=C1CCc2c(cccc2SCC3CCC3)N1 62a_100000763275_100010232564 [0,0,0,1,0,1|2,0,0]=4 1027 B19R3.59498 O=C1CCc2c(cccc2SCC3CCC3)N1 62a_100010232564_100000763275 [0,0,0,1,0,1|2,0,0]=4 1028 B19R3.181434 O=C1Cc2c(cccc2SCC#CC3CC3)N1 62a_100009895102_100009816812 [0,1,0,1,0,0|1,0,1]=4 1029 B19R3.181434 O=C1Cc2c(cccc2SCCCC3CO3)N1 62a_100000733510_100009816812 [0,1,0,1,0,0|2,0,0]=4 1030 B19R3.181097 O=C1Cc2c(cccc2C3=CCCCCC3)N1 271570a_200009888920_100009816812 [0,1,0,1,0,0|1,0,1]=4 1031 B19R3.181407 O=C1Cc2c(cccc2C(=O)NNC3CC3)N1 22a_100000701032_100000098511 [0,1,0,1,0,0|1,0,1]=4 1032 B19R3.329 O=C1Cc2c(cccc2SC3C=CCCC3)N1 62a_100000751183_100009816812 [0,1,0,1,0,0|1,0,1]=4 1033 B19R3.329 O=C1Cc2c(cccc2SC3CCCCC3)N1 62a_100000210327_100009816812 [0,1,0,1,0,0|1,0,0]=3 1034 B19R3.329 O=C1Cc2c(ccnc2N1)SC3CCCCC3 62a_100000210327_100000104061 [0,1,0,1,0,0|2,0,0]=4 1035 B19R3.329 O=C1Cc2cccc(c2C1)SC3CCCCC3 62a_100010205903_100000210327 [0,1,0,1,0,0|2,0,0]=4 1036 B19R3.329 O=C1Cc2cccc(c2C1)SC3CCCOC3 62a_100010205903_100000693364 [0,1,0,1,0,0|2,0,0]=4 1037 B19R3.5313 O=C1Cc2c(cccc2SC3CCCC3=O)N1 62a_100000211823_100009816812 [0,1,0,1,0,0|2,0,0]=4 1038 B19R3.5313 O=C1Cc2c(cccc2SC3COCC3O)N1 62a_200000725654_100009816812 [0,1,0,1,0,0|2,0,0]=4 1039 B19R3.5313 O=C1Cc2c(cccc2S[C@@H]3CCC[C@H]3O)N1 62a_200016002552_100009816812 [0,1,0,1,0,0|2,0,0]=4 1040 B19R3.9758 O=C1Cc2c(cccc2SCC3=NCCN3)N1 62a_100000737910_100009816812 [0,1,0,1,0,0|1,0,1]=4 1041 B19R3.9758 O=C1Cc2c(cccc2SCC3CCCC3)N1 62a_100000740388_100009816812 [0,1,0,1,0,0|1,0,0]=3 1042 B19R3.9758 O=C1Cc2c(cccc2SCC3CCCO3)N1 62a_100000203698_100009816812 [0,1,0,1,0,0|1,0,0]=3 1043 B19R3.9758 O=C1Cc2c(cccc2SCC3CCOC3)N1 62a_100000702531_100009816812 [0,1,0,1,0,0|2,0,0]=4 1044 B19R3.9758 O=C1Cc2c(cccc2SCC3OCCO3)N1 62a_100000755774_100009816812 [0,1,0,1,0,0|2,0,0]=4 1045 B19R3.9758 O=C1Cc2c(ccnc2N1)SCC3CCCC3 62a_100000740388_100000104061 [0,1,0,1,0,0|2,0,0]=4 1046 B19R3.9758 O=C1Cc2c(ccnc2N1)SCC3CCCO3 62a_100000203698_100000104061 [0,1,0,1,0,0|2,0,0]=4 1047 B19R3.9758 O=C1Cc2cccc(c2C1)SCC3CCCC3 62a_100010205903_100000740388 [0,1,0,1,0,0|2,0,0]=4 1048 B19R3.9758 O=C1Cc2cccc(c2C1)SCC3CCCO3 62a_100010205903_100000203698 [0,1,0,1,0,0|2,0,0]=4 1049 B19R3.181112 CC1(CCC1)CSc2cccc3c2CC(=O)N3 62a_100000726658_100009816812 [0,1,0,1,0,0|2,0,0]=4 1050 B19R3.181416 O=C1Cc2c(cccc2SCC(=O)C3CC3)N1 62a_100000746382_100009816812 [0,1,0,1,0,0|2,0,0]=4 1051 B19R3.167035 O=C1Cc2c(ccc(c2N1)F)SC3CCCC3 62a_100011217020_100012355367 [0,1,0,1,0,0|2,0,0]=4 1052 B19R3.419729 O=C1Cc2c(ccc(c2N1)F)SCCC3CC3 62a_100000764125_100012355367 [0,1,0,1,0,0|2,0,0]=4 1053 B19R3.427574 O=C1Cc2c(ccc(c2N1)F)SCC3CCC3 62a_100000763275_100012355367 [0,1,0,1,0,0|2,0,0]=4 1054 B19R3.55752 Cc1ccc2c(c1SCC3CCC3)CC(=O)N2 62a_100000763275_100015548004 [0,1,0,1,0,0|2,0,0]=4 1055 B19R3.55753 Cc1ccc2c(c1SCCC3CC3)CC(=O)N2 62a_100000764125_100015548004 [0,1,0,1,0,0|2,0,0]=4 1056 B19R3.55756 Cc1ccc2c(c1SC3CCCC3)CC(=O)N2 62a_100011217020_100015548004 [0,1,0,1,0,0|2,0,0]=4 1057 B15R1.237 C=C(C)c1cccc(c1)CCCCCC 271570a_100000694244_100009816010 [0,0,1,0,1,0|2,0,0]=4 1058 B15R1.237 CCCCCOc1cccc(c1)C(=O)C 34a_100000211620_100000718602 [0,0,1,0,1,0|2,0,0]=4 1059 B15R1.237 CCCCCOc1cccc(c1)C(=O)C 7a_100000211620_100000210326 [0,0,1,0,1,0|2,0,0]=4 1060 B15R1.237 CCCCCSc1cccc(c1)C(=O)C 62a_100000210093_100000210326 [0,0,1,0,1,0|2,0,0]=4 1061 B15R1.237 CCCCCSc1cccc(c1)C(=O)C 62a_100000210326_100000210093 [0,0,1,0,1,0|2,0,0]=4 1062 B15R1.237 CCCCNCc1cccc(c1)C(=O)C 2230a_100000102301_100000084091 [0,0,1,0,1,0|2,0,0]=4 1063 B15R1.237 CCCCNCc1cccc(c1)C(=O)C 7a_106832991798_100000084091 [0,0,1,0,1,0|2,0,0]=4 1064 B15R1.237 CCCCOCc1cccc(c1)C(=O)C 34a_100000210227_100000084091 [0,0,1,0,1,0|2,0,0]=4 1065 B15R1.237 CCCCOCc1cccc(c1)C(=O)C 7a_100000210227_100000084091 [0,0,1,0,1,0|2,0,0]=4 1066 B15R1.237 CCCCSCc1cccc(c1)C(=O)C 62a_100000084091_100000210210 [0,0,1,0,1,0|2,0,0]=4 1067 B15R1.237 CCCCSCc1cccc(c1)C(=O)C 62a_100000210211_100000084091 [0,0,1,0,1,0|2,0,0]=4 1068 B15R1.237 CCCNCCc1cccc(c1)[N+](=O)[O-] 2230a_100000694159_100000210303 [0,0,1,0,1,0|2,0,0]=4 1069 B15R1.237 CCCNCCc1cccc(c1)[N+](=O)[O-] 34a_100000694159_100000210303 [0,0,1,0,1,0|2,0,0]=4 1070 B15R1.241 CCCCCNc1ccccc1C(=O)N 34a_100000185089_100000718602 [0,0,1,0,1,0|2,0,0]=4 1071 B15R1.241 CCCCCOc1ccccc1C(=O)N 34a_100000192804_100000718602 [0,0,1,0,1,0|2,0,0]=4 1072 B15R1.241 CCCCCOc1ccccc1C(=O)N 7a_100000192804_100000210326 [0,0,1,0,1,0|2,0,0]=4 1073 B15R1.241 CCCCCSc1ccccc1C(=O)N 62a_100000162227_100000210326 [0,0,1,0,1,0|2,0,0]=4 1074 B15R1.241 CCCCCSc1ccccc1C(=O)N 62a_100000210326_100000162227 [0,0,1,0,1,0|2,0,0]=4 1075 B15R1.241 CCCNCCc1ccccc1[N+](=O)[O-] 2230a_100000723993_100000210303 [0,0,1,0,1,0|2,0,0]=4 1076 B17R1.305 CCCCCSc1cccc(c1)CNC(=O)C 62a_100000210326_100000766983 [0,0,1,0,0,1|2,0,0]=4 1077 B17R1.305 CCCCCSc1cccc(c1)CNC(=O)C 62a_100000766983_100000210326 [0,0,1,0,0,1|2,0,0]=4 1078 B17R1.321 CCCCCNc1ccccc1SCC(=O)N 7a_100000187061_100000210326 [0,0,1,0,0,1|2,0,0]=4 1079 B17R1.321 CCCCCOc1ccccc1CCC(=O)N 34a_100011200845_100000718602 [0,0,1,0,0,1|2,0,0]=4 1080 B17R1.321 CCCCCOc1ccccc1CCC(=O)N 7a_100011200845_100000210326 [0,0,1,0,0,1|2,0,0]=4 1081 B17R1.321 CCCCCOc1ccccc1OCC(=O)N 7a_100000162348_100000210326 [0,0,1,0,0,1|2,0,0]=4 1082 B17R1.321 CCCCCSc1ccccc1CCC(=O)N 62a_100000210326_100009814947 [0,0,1,0,0,1|2,0,0]=4 1083 B17R1.321 CCCCCSc1ccccc1CCC(=O)N 62a_100009814947_100000210326 [0,0,1,0,0,1|2,0,0]=4 1084 B17R1.321 CCCCCSc1ccccc1OCC(=O)N 62a_200000148491_100000210326 [0,0,1,0,0,1|2,0,0]=4 1085 B17R1.321 CCCCNCc1ccccc1OCC(=O)N 207a_100000102301_100000150104 [0,0,1,0,0,1|2,0,0]=4 1086 B17R1.321 CCCCNCc1ccccc1OCC(=O)N 270004a_100000102301_100000150104 [0,0,1,0,0,1|2,0,0]=4 1087 B17R1.321 CCCCSCc1ccccc1SCC(=O)N 62a_100000747473_200011870348 [0,0,1,0,0,1|2,0,0]=4 1088 B17R1.321 CCCCSCc1ccccc1SCC(=O)N 62a_200011870348_100000747473 [0,0,1,0,0,1|2,0,0]=4 1089 B17R1.321 CCCNN=Cc1ccccc1OCC(=O)N 4a_100000740057_100000150104 [0,0,1,0,0,1|1,0,1]=4 1090 B17R2.9365 CCCC=Cc1cccc2c1CCC(=O)N2 271570a_100016258520_100010232564 [1,0,0,0,0,1|0,0,2]=4 1091 B17R2.9365 CCCC=Cc1cccc2c1OCC(=O)N2 271570a_100016258520_100012355675 [1,0,0,0,0,1|0,0,2]=4 1092 B17R2.9365 CCCCOc1cccc2c1CCC(=O)N2 34a_100000066681_100000210210 [1,0,0,0,0,1|1,0,0]=3 1093 B17R2.9365 CCCCOc1cccc2c1CCC(=O)N2 7a_100000066681_100000210211 [1,0,0,0,0,1|1,0,0]=3 1094 B17R2.9365 CCCCSc1cccc2c1CCC(=O)C2 62a_100000210211_100010138409 [1,0,0,0,0,1|2,0,0]=4 1095 B17R2.9365 CCCCSc1cccc2c1CCC(=O)C2 62a_100010138409_100000210210 [1,0,0,0,0,1|2,0,0]=4 1096 B17R2.9365 CCCCSc1cccc2c1CCC(=O)N2 62a_100000210211_100010232564 [1,0,0,0,0,1|1,0,0]=3 1097 B17R2.9365 CCCCSc1cccc2c1CCC(=O)N2 62a_100010232564_100000210210 [1,0,0,0,0,1|1,0,0]=3 1098 B17R2.9365 CCCCSc1cccc2c1CCC(=O)O2 62a_100000210211_200015620928 [1,0,0,0,0,1|2,0,0]=4 1099 B17R2.9365 CCCCSc1cccc2c1CCC(=O)O2 62a_200015620928_100000210210 [1,0,0,0,0,1|2,0,0]=4 1100 B17R2.9365 CCCCSc1cccc2c1ccc(=O)[nH]2 62a_100000210211_100000726145 [1,0,0,0,0,1|1,0,1]=4 1101 B17R2.9365 CCCCSc1nccc2c1OCC(=O)N2 62a_100000210211_100009863569 [1,0,0,0,0,1|2,0,0]=4 1102 B17R2.9365 CCOCSc1cccc2c1CCC(=O)N2 62a_100000739092_100010232564 [1,0,0,0,0,1|2,0,0]=4 1103 B17R2.9365 CCOCSc1cccc2c1CCC(=O)N2 62a_100010232564_100000739092 [1,0,0,0,0,1|2,0,0]=4 1104 B17R2.9365 COCCOc1cccc2c1CCC(=O)N2 34a_100000066681_100011201679 [1,0,0,0,0,1|2,0,0]=4 1105 B17R2.9365 COCCOc1cccc2c1CCC(=O)N2 7a_100000066681_100000233755 [1,0,0,0,0,1|2,0,0]=4 1106 B17R2.9365 COCCSc1cccc2c1CCC(=O)N2 62a_100000233755_100010232564 [1,0,0,0,0,1|2,0,0]=4 1107 B17R2.9365 COCCSc1cccc2c1CCC(=O)N2 62a_100010232564_100000233755 [1,0,0,0,0,1|2,0,0]=4 1108 B17R2.9365 CSCCOc1cccc2c1CCC(=O)N2 34a_100000066681_100000212216 [1,0,0,0,0,1|2,0,0]=4 1109 B17R2.9365 CSCCOc1cccc2c1CCC(=O)N2 7a_100000066681_100000212216 [1,0,0,0,0,1|2,0,0]=4 1110 B17R2.9365 CSCCSc1cccc2c1CCC(=O)N2 62a_100000212216_100010232564 [1,0,0,0,0,1|2,0,0]=4 1111 B17R2.9365 CSCCSc1cccc2c1CCC(=O)N2 62a_100010232564_100000751147 [1,0,0,0,0,1|2,0,0]=4 1112 B17R2.9365 O=C1CCc2c(cccc2OCCCF)N1 34a_100000066681_100011934791 [1,0,0,0,0,1|2,0,0]=4 1113 B17R2.9365 O=C1CCc2c(cccc2OCCCF)N1 7a_100000066681_100011934791 [1,0,0,0,0,1|2,0,0]=4 1114 B17R2.9365 O=C1CCc2c(cccc2OCCCO)N1 34a_100000066681_100000230001 [1,0,0,0,0,1|2,0,0]=4 1115 B17R2.9365 O=C1CCc2c(cccc2OCCCO)N1 7a_100000066681_100011215043 [1,0,0,0,0,1|2,0,0]=4 1116 B17R2.9365 O=C1CCc2c(cccc2SCCCF)N1 62a_100010232564_100011934791 [1,0,0,0,0,1|2,0,0]=4 1117 B17R2.9365 O=C1CCc2c(cccc2SCCCF)N1 62a_100011934791_100010232564 [1,0,0,0,0,1|2,0,0]=4 1118 B17R2.9365 O=C1CCc2c(cccc2SCCCO)N1 62a_100010232564_100011215043 [1,0,0,0,0,1|2,0,0]=4 1119 B17R2.9365 O=C1CCc2c(cccc2SCCCO)N1 62a_100011215043_100010232564 [1,0,0,0,0,1|2,0,0]=4 1120 B17R2.86756 CCCCSc1cccc2c1CC(=O)CC2 62a_100010006498_100000210210 [1,0,0,0,0,1|2,0,0]=4 1121 B19R2.473738 CCCCCSc1cccc2c1CCCC(=O)N2 62a_100000210326_200000700058 [0,0,0,0,0,2|2,0,0]=4 1122 B19R2.473738 CCCCCSc1cccc2c1CCCC(=O)N2 62a_200000700058_100000210326 [0,0,0,0,0,2|2,0,0]=4