0 B22R3.2033379 CCNCC(=O)N1c2ccccc2Sc3c1cccc3 2230a_100015525214_100000680705 [0,1,0,0,0,0|2,0,1]=4 1 B22R3.2033379 CNCCC(=O)N1c2ccccc2Sc3c1cccc3 2230a_106832991635_200015341630 [0,1,0,0,0,0|0,0,1]=2 2 B22R3.2033379 CNCCC(=O)N1c2ccccc2Sc3c1cccc3 7a_106832991635_200015341630 [0,1,0,0,0,0|0,0,1]=2 3 B22R3.15498781 CCC(=O)CCN1c2ccccc2Sc3c1cccc3 1458a_200000489519_100000210202 [0,1,0,0,0,0|1,0,1]=3 4 B22R3.15498781 CNC(=O)CCN1c2ccccc2Sc3c1cccc3 11a_106832991635_200000489519 [0,1,0,0,0,0|0,0,1]=2 5 B22R3.15498781 CNC(=O)CCN1c2ccccc2Sc3c1cccc3 240690a_100102657272_200000489519 [0,1,0,0,0,0|0,0,1]=2 6 B22R3.15498781 CNC(=O)CCN1c2ccccc2Sc3c1cccc3 527a_100102657272_200000489519 [0,1,0,0,0,0|0,0,1]=2 7 B22R3.15498781 CNC(=O)CCc1c2ccccc2cc3c1cccc3 11a_106832991635_100000136548 [0,1,0,0,0,0|2,0,1]=4 8 B22R3.15498781 CNC(=O)CCc1c2ccccc2cc3c1cccc3 1626a_100102657272_100000136548 [0,1,0,0,0,0|2,0,1]=4 9 B22R3.15498781 CNC(=O)CCc1c2ccccc2cc3c1cccc3 240690a_100102657272_100000136548 [0,1,0,0,0,0|2,0,1]=4 10 B22R3.15498781 CNC(=O)CCc1c2ccccc2cc3c1cccc3 527a_100102657272_100000136548 [0,1,0,0,0,0|2,0,1]=4 11 B22R3.15498781 O=C(CF)CCN1c2ccccc2Sc3c1cccc3 1458a_200000489519_100015361967 [0,1,0,0,0,0|2,0,1]=4 12 B22R3.15927150 CCCCCNC1c2ccccc2Oc3c1cccc3 2230a_200000704616_100000210326 [0,1,0,0,0,0|2,1,0]=4 13 B22R3.15927150 CCCCNCc1c2ccccc2cc3c1cccc3 207a_100000102301_100000261405 [0,1,0,0,0,0|3,0,0]=4 14 B22R3.15927150 CCCCNCc1c2ccccc2cc3c1cccc3 2230a_100000102301_100009992879 [0,1,0,0,0,0|3,0,0]=4 15 B22R3.15927150 CCCCNCc1c2ccccc2cc3c1cccc3 270004a_100000102301_100000261405 [0,1,0,0,0,0|3,0,0]=4 16 B22R3.15927150 CCCCNCc1c2ccccc2cc3c1cccc3 7a_106832991798_100009992879 [0,1,0,0,0,0|3,0,0]=4 17 B22R3.15927150 CCCCNCc1c2ccccc2nc3c1cccc3 2230a_100000102301_100009813545 [0,1,0,0,0,0|3,0,0]=4 18 B22R3.15927150 CCCCNCc1c2ccccc2nc3c1cccc3 7a_106832991798_100009813545 [0,1,0,0,0,0|3,0,0]=4 19 B22R3.15927150 CCCCOCc1c2ccccc2nc3c1cccc3 7a_100000210227_100009813545 [0,1,0,0,0,0|3,0,0]=4 20 B22R3.15927150 COCCCNC1c2ccccc2Oc3c1cccc3 2230a_200000704616_100000740836 [0,1,0,0,0,0|2,1,0]=4 21 B22R3.15927150 COCCCNc1c2ccccc2cc3c1cccc3 34a_100009882017_100000740836 [0,1,0,0,0,0|3,0,0]=4 22 B22R3.15927150 COCCCOC1c2ccccc2Oc3c1cccc3 7a_100000210167_100000740836 [0,1,0,0,0,0|2,1,0]=4 23 B22R3.15927150 COCCCSc1c2ccccc2nc3c1cccc3 62a_100000044299_100000709357 [0,1,0,0,0,0|3,0,0]=4 24 B22R3.15927150 COCCNCc1c2ccccc2cc3c1cccc3 207a_100000209980_100000261405 [0,1,0,0,0,0|3,0,0]=4 25 B22R3.15927150 COCCNCc1c2ccccc2cc3c1cccc3 2230a_100000209980_100009992879 [0,1,0,0,0,0|3,0,0]=4 26 B22R3.15927150 COCCNCc1c2ccccc2cc3c1cccc3 270004a_100000209980_100000261405 [0,1,0,0,0,0|3,0,0]=4 27 B22R3.15927150 COCCNCc1c2ccccc2nc3c1cccc3 2230a_100000209980_100009813545 [0,1,0,0,0,0|3,0,0]=4 28 B22R3.15927150 COCCOCc1c2ccccc2cc3c1cccc3 34a_100000025838_100011201679 [0,1,0,0,0,0|3,0,0]=4 29 B22R3.15927150 COCCOCc1c2ccccc2cc3c1cccc3 34a_100000210237_100009992879 [0,1,0,0,0,0|3,0,0]=4 30 B22R3.15927150 COCCOCc1c2ccccc2cc3c1cccc3 7a_100000025838_100000233755 [0,1,0,0,0,0|3,0,0]=4 31 B22R3.15927150 COCCSCc1c2ccccc2cc3c1cccc3 62a_100000233755_100009992879 [0,1,0,0,0,0|3,0,0]=4 32 B22R3.15927150 COCCSCc1c2ccccc2cc3c1cccc3 62a_100009992879_100000233755 [0,1,0,0,0,0|3,0,0]=4 33 B22R3.15927150 COCCSCc1c2ccccc2nc3c1cccc3 62a_100009813545_100000233755 [0,1,0,0,0,0|3,0,0]=4 34 B22R3.15927150 CSCCNCc1c2ccccc2cc3c1cccc3 207a_100020590264_100000261405 [0,1,0,0,0,0|3,0,0]=4 35 B22R3.15927150 CSCCNCc1c2ccccc2cc3c1cccc3 2230a_100020590264_100009992879 [0,1,0,0,0,0|3,0,0]=4 36 B22R3.15927150 CSCCNCc1c2ccccc2cc3c1cccc3 270004a_100020590264_100000261405 [0,1,0,0,0,0|3,0,0]=4 37 B22R3.15927150 CSCCNCc1c2ccccc2nc3c1cccc3 2230a_100020590264_100009813545 [0,1,0,0,0,0|3,0,0]=4 38 B22R3.15927150 CSCCOCc1c2ccccc2cc3c1cccc3 34a_100000025838_100000212216 [0,1,0,0,0,0|3,0,0]=4 39 B22R3.15927150 CSCCOCc1c2ccccc2cc3c1cccc3 34a_100000230434_100009992879 [0,1,0,0,0,0|3,0,0]=4 40 B22R3.15927150 CSCCOCc1c2ccccc2cc3c1cccc3 7a_100000025838_100000212216 [0,1,0,0,0,0|3,0,0]=4 41 B22R3.15927150 CSCCOCc1c2ccccc2cc3c1cccc3 7a_100000230434_100009992879 [0,1,0,0,0,0|3,0,0]=4 42 B22R3.15927150 CSCCOCc1c2ccccc2nc3c1cccc3 7a_100000230434_100009813545 [0,1,0,0,0,0|3,0,0]=4 43 B22R3.15927150 CSCCSCc1c2ccccc2nc3c1cccc3 62a_100009813545_100000751147 [0,1,0,0,0,0|3,0,0]=4 44 B22R3.16182945 CN(C)CCOC1c2ccccc2Oc3c1cccc3 7a_100000210167_100000755713 [0,1,0,0,0,0|2,1,0]=4 45 B22R3.16182945 CN(C)CCSc1c2ccccc2nc3c1cccc3 62a_100000044299_100000755713 [0,1,0,0,0,0|3,0,0]=4 46 B22R3.12627361 COCCOC1c2ccccc2CSc3c1cccc3 7a_100025745337_100000233755 [0,0,0,0,0,1|3,0,0]=4 47 B22R3.12627361 CSCCOC1c2ccccc2CSc3c1cccc3 7a_100025745337_100000212216 [0,0,0,0,0,1|3,0,0]=4 48 B21R2.1935 COCCCC(=O)c1ccccc1Sc2ccccc2 1458a_100000187566_100000740836 [0,1,1,0,0,0|2,0,0]=4 49 B21R2.7254 COCCCNc1cc(ccc1Oc2ccccc2)Cl 2230a_100000185534_100000740836 [0,1,1,0,0,0|1,1,0]=4 50 B21R2.7254 COCCCNc1cc(ccc1Oc2ccccc2)Cl 34a_100000185534_100000740836 [0,1,1,0,0,0|1,1,0]=4 51 B21R2.7254 COCCCNc1cc(ccc1Oc2ccccc2)Cl 7a_100000185534_100000740836 [0,1,1,0,0,0|1,1,0]=4 52 B21R2.7254 COCCCNc1cc(ccc1Oc2ccccc2)F 2230a_100000750978_100000740836 [0,1,1,0,0,0|1,1,0]=4 53 B21R2.7254 COCCCNc1cc(ccc1Oc2ccccc2)F 34a_100000750978_100000740836 [0,1,1,0,0,0|1,1,0]=4 54 B21R2.7254 COCCCNc1cc(ccc1Oc2ccccc2)F 7a_100000750978_100000740836 [0,1,1,0,0,0|1,1,0]=4 55 B21R2.7570 C=C(c1ccccc1)c2ccccc2OCCCNC 271570a_100000068269_100015186278 [0,1,1,0,0,0|2,0,0]=4 56 B21R2.7570 CCCCCNc1ccccc1C(=O)c2ccccc2 27a_100000209983_100000198044 [0,1,1,0,0,0|2,0,0]=4 57 B21R2.7570 CCCCCNc1ccccc1C(O)c2ccccc2 2230a_100000246470_100000210326 [0,1,1,0,0,0|2,0,0]=4 58 B21R2.7570 CCCCCNc1ccccc1C(O)c2ccccc2 34a_100000246470_100000718602 [0,1,1,0,0,0|2,0,0]=4 59 B21R2.7570 CCCCCNc1ccccc1C(O)c2ccccc2 7a_100000246470_100000210326 [0,1,1,0,0,0|2,0,0]=4 60 B21R2.7570 COCCCNc1ccccc1C(=O)c2ccccc2 27a_100150723488_100000198044 [0,1,1,0,0,0|2,0,0]=4 61 B21R2.7570 COCCCNc1ccccc1C(O)c2ccccc2 2230a_100000246470_100000740836 [0,1,1,0,0,0|2,0,0]=4 62 B21R2.7570 COCCCNc1ccccc1C(O)c2ccccc2 34a_100000246470_100000740836 [0,1,1,0,0,0|2,0,0]=4 63 B21R2.7570 COCCCNc1ccccc1C(O)c2ccccc2 7a_100000246470_100000740836 [0,1,1,0,0,0|2,0,0]=4 64 B21R2.7570 CSCCCNc1ccccc1C(=O)c2ccccc2 27a_100000749238_100000198044 [0,1,1,0,0,0|2,0,0]=4 65 B21R2.12800 CC(=O)CCCNc1ccccc1Cc2ccccc2 34a_100000211252_100000685027 [0,1,1,0,0,0|2,0,0]=4 66 B21R2.12800 CC(=O)CCCNc1ccccc1Cc2ccccc2 7a_100000211252_100011215641 [0,1,1,0,0,0|2,0,0]=4 67 B21R2.12800 CC(=O)CCCNc1ccccc1Oc2ccccc2 34a_100000182328_100000685027 [0,1,1,0,0,0|1,1,0]=4 68 B21R2.12800 CC(=O)NCCNc1ccccc1Sc2ccccc2 2230a_100000210917_100000189650 [0,1,1,0,0,0|2,0,0]=4 69 B21R2.12800 CC(C)OCCNc1ccccc1Sc2ccccc2 2230a_100000210917_100000211751 [0,1,1,0,0,0|2,0,0]=4 70 B21R2.12800 CC(O)CCCNc1ccccc1Cc2ccccc2 2230a_100000211252_200000718107 [0,1,1,0,0,0|2,0,0]=4 71 B21R2.12800 CC(O)CCCNc1ccccc1Cc2ccccc2 34a_100000211252_200000718107 [0,1,1,0,0,0|2,0,0]=4 72 B21R2.12800 CC(O)CCCNc1ccccc1Cc2ccccc2 7a_100000211252_200000718107 [0,1,1,0,0,0|2,0,0]=4 73 B21R2.12800 CC(O)CCCNc1ccccc1Oc2ccccc2 2230a_100000182328_200000718107 [0,1,1,0,0,0|1,1,0]=4 74 B21R2.12800 CC(O)CCCNc1ccccc1Oc2ccccc2 34a_100000182328_200000718107 [0,1,1,0,0,0|1,1,0]=4 75 B21R2.12800 CC(O)CCCNc1ccccc1Sc2ccccc2 2230a_100000210917_200000718107 [0,1,1,0,0,0|1,0,0]=3 76 B21R2.12800 CN(C)CCCNc1ccccc1Cc2ccccc2 7a_100000211252_100000757444 [0,1,1,0,0,0|1,0,0]=3 77 B21R2.12800 CN(C)CCCOc1ccccc1Cc2ccccc2 7a_100000211249_100000757444 [0,1,1,0,0,0|2,0,0]=4 78 B21R2.12800 CN(C)CCCOc1ccccc1Oc2ccccc2 7a_100000074787_100000757444 [0,1,1,0,0,0|1,1,0]=4 79 B21R2.12800 CN(C)CCCSc1ccccc1Cc2ccccc2 62a_200011216382_100000757444 [0,1,1,0,0,0|2,0,0]=4 80 B21R2.14086 CNCCCOc1ccccc1Sc2cc(=O)cc[nH]2 62a_100009817434_100015186278 [0,1,1,0,0,0|2,0,0]=4 81 B21R2.14086 CNCCCOc1ccccc1Sc2cc(ccn2)C 62a_100000750283_100015186278 [0,1,1,0,0,0|2,0,0]=4 82 B21R2.14086 CNCCCOc1ccccc1Sc2cc(ccn2)C 62a_100015186278_100000750283 [0,1,1,0,0,0|2,0,0]=4 83 B21R2.14086 CNCCCOc1ccccc1Sc2cc(ccn2)Cl 62a_100010167805_100015186278 [0,1,1,0,0,0|2,0,0]=4 84 B21R2.14086 CNCCCOc1ccccc1Sc2cc(ccn2)Cl 62a_100015186278_100010167805 [0,1,1,0,0,0|2,0,0]=4 85 B21R2.14086 CNCCCOc1ccccc1Sc2cc(ccn2)F 62a_100000764206_100015186278 [0,1,1,0,0,0|2,0,0]=4 86 B21R2.14086 CNCCCOc1ccccc1Sc2cc(ccn2)F 62a_100015186278_100000764206 [0,1,1,0,0,0|2,0,0]=4 87 B21R2.14086 CNCCCOc1ccccc1Sc2cc(ccn2)N 62a_100009814236_100015186278 [0,1,1,0,0,0|2,0,0]=4 88 B21R2.14086 CNCCCOc1ccccc1Sc2cc(ccn2)N 62a_100015186278_100009814236 [0,1,1,0,0,0|2,0,0]=4 89 B21R2.14086 CNCCCOc1ccccc1Sc2cc(ccn2)O 62a_100015186278_100000762945 [0,1,1,0,0,0|2,0,0]=4 90 B21R2.14086 CNCCCOc1ccccc1Sc2cc[nH]c(=O)c2 62a_100009816521_100015186278 [0,1,1,0,0,0|2,0,0]=4 91 B21R2.14086 CNCCCOc1ccccc1Sc2cc[nH]c(=O)c2 62a_100015186278_100009816521 [0,1,1,0,0,0|2,0,0]=4 92 B21R2.14086 CNCCCOc1ccccc1Sc2ccc[n+](c2)C 62a_100009996589_100015186278 [0,1,1,0,0,0|2,0,0]=4 93 B21R2.14086 CNCCCOc1ccccc1Sc2ccc[n+](c2)C 62a_100015186278_100009996589 [0,1,1,0,0,0|2,0,0]=4 94 B21R2.14086 CNCCCOc1ccccc1Sc2ccc[n+](c2)[O-] 62a_100015186278_100009815978 [0,1,1,0,0,0|2,0,0]=4 95 B21R2.14086 CNCCCOc1ccccc1Sc2cccc(=O)[nH]2 62a_100015186278_100000752884 [0,1,1,0,0,0|2,0,0]=4 96 B21R2.14086 CNCCCOc1ccccc1Sc2cccc(c2)Br 62a_100000691529_100015186278 [0,1,1,0,0,0|1,0,0]=3 97 B21R2.14086 CNCCCOc1ccccc1Sc2cccc(c2)Br 62a_100015186278_100000691529 [0,1,1,0,0,0|1,0,0]=3 98 B21R2.14086 CNCCCOc1ccccc1Sc2cccc(c2)C 62a_100011215228_100015186278 [0,1,1,0,0,0|1,0,0]=3 99 B21R2.14086 CNCCCOc1ccccc1Sc2cccc(c2)C 62a_100015186278_100011215228 [0,1,1,0,0,0|1,0,0]=3 100 B21R2.14086 CNCCCOc1ccccc1Sc2cccc(c2)Cl 62a_100000699651_100015186278 [0,1,1,0,0,0|1,0,0]=3 101 B21R2.14086 CNCCCOc1ccccc1Sc2cccc(c2)Cl 62a_100015186278_100000699651 [0,1,1,0,0,0|1,0,0]=3 102 B21R2.14086 CNCCCOc1ccccc1Sc2cccc(c2)F 62a_100000685547_100015186278 [0,1,1,0,0,0|1,0,0]=3 103 B21R2.14086 CNCCCOc1ccccc1Sc2cccc(c2)F 62a_100015186278_100000685547 [0,1,1,0,0,0|1,0,0]=3 104 B21R2.14086 CNCCCOc1ccccc1Sc2cccc(c2)N 62a_100000210019_100015186278 [0,1,1,0,0,0|1,0,0]=3 105 B21R2.14086 CNCCCOc1ccccc1Sc2cccc(c2)N 62a_100015186278_100000210019 [0,1,1,0,0,0|1,0,0]=3 106 B21R2.14086 CNCCCOc1ccccc1Sc2cccc(c2)O 62a_100015186278_100000211634 [0,1,1,0,0,0|1,0,0]=3 107 B21R2.14086 CNCCCOc1ccccc1Sc2cccc(c2)[S] 62a_100015186278_114929384022 [0,1,1,0,0,0|1,0,0]=3 108 B21R2.14086 CNCCCOc1ccccc1Sc2cccc(c2)[S] 62a_114929384022_100015186278 [0,1,1,0,0,0|1,0,0]=3 109 B21R2.14086 CNCCCOc1ccccc1Sc2cccc(n2)Br 62a_100000684672_100015186278 [0,1,1,0,0,0|2,0,0]=4 110 B21R2.14086 CNCCCOc1ccccc1Sc2cccc(n2)Br 62a_100015186278_100000684672 [0,1,1,0,0,0|2,0,0]=4 111 B21R2.14086 CNCCCOc1ccccc1Sc2cccc(n2)C 62a_100000742759_100015186278 [0,1,1,0,0,0|2,0,0]=4 112 B21R2.14086 CNCCCOc1ccccc1Sc2cccc(n2)C 62a_100015186278_100000742759 [0,1,1,0,0,0|2,0,0]=4 113 B21R2.14086 CNCCCOc1ccccc1Sc2cccc(n2)Cl 62a_100000051397_100015186278 [0,1,1,0,0,0|2,0,0]=4 114 B21R2.14086 CNCCCOc1ccccc1Sc2cccc(n2)Cl 62a_100015186278_100000051397 [0,1,1,0,0,0|2,0,0]=4 115 B21R2.14086 CNCCCOc1ccccc1Sc2cccc(n2)F 62a_100009815982_100015186278 [0,1,1,0,0,0|2,0,0]=4 116 B21R2.14086 CNCCCOc1ccccc1Sc2cccc(n2)F 62a_100015186278_100009815982 [0,1,1,0,0,0|2,0,0]=4 117 B21R2.14086 CNCCCOc1ccccc1Sc2cccc(n2)N 62a_100000740741_100015186278 [0,1,1,0,0,0|2,0,0]=4 118 B21R2.14086 CNCCCOc1ccccc1Sc2cccc(n2)N 62a_100015186278_100000740741 [0,1,1,0,0,0|2,0,0]=4 119 B21R2.14086 CNCCCOc1ccccc1Sc2ccnc(c2)Br 62a_100009814637_100015186278 [0,1,1,0,0,0|2,0,0]=4 120 B21R2.14086 CNCCCOc1ccccc1Sc2ccnc(c2)Br 62a_100015186278_100009814637 [0,1,1,0,0,0|2,0,0]=4 121 B21R2.14086 CNCCCOc1ccccc1Sc2ccnc(c2)C 62a_100000758586_100015186278 [0,1,1,0,0,0|2,0,0]=4 122 B21R2.14086 CNCCCOc1ccccc1Sc2ccnc(c2)C 62a_100015186278_100000758586 [0,1,1,0,0,0|2,0,0]=4 123 B21R2.14086 CNCCCOc1ccccc1Sc2ccnc(c2)Cl 62a_100000035001_100015186278 [0,1,1,0,0,0|2,0,0]=4 124 B21R2.14086 CNCCCOc1ccccc1Sc2ccnc(c2)Cl 62a_100015186278_100000035001 [0,1,1,0,0,0|2,0,0]=4 125 B21R2.14086 CNCCCOc1ccccc1Sc2ccnc(c2)F 62a_100009816116_100015186278 [0,1,1,0,0,0|2,0,0]=4 126 B21R2.14086 CNCCCOc1ccccc1Sc2ccnc(c2)F 62a_100015186278_100009816116 [0,1,1,0,0,0|2,0,0]=4 127 B21R2.14086 CNCCCOc1ccccc1Sc2ccnc(c2)N 62a_100000049665_100015186278 [0,1,1,0,0,0|2,0,0]=4 128 B21R2.14086 CNCCCOc1ccccc1Sc2ccnc(c2)N 62a_100015186278_100000049665 [0,1,1,0,0,0|2,0,0]=4 129 B21R2.14086 CNCCCOc1ccccc1Sc2cncc(c2)Br 62a_100000728054_100015186278 [0,1,1,0,0,0|2,0,0]=4 130 B21R2.14086 CNCCCOc1ccccc1Sc2cncc(c2)Br 62a_100015186278_100000728054 [0,1,1,0,0,0|2,0,0]=4 131 B21R2.14086 CNCCCOc1ccccc1Sc2cncc(c2)C 62a_100000760492_100015186278 [0,1,1,0,0,0|2,0,0]=4 132 B21R2.14086 CNCCCOc1ccccc1Sc2cncc(c2)C 62a_100015186278_100000760492 [0,1,1,0,0,0|2,0,0]=4 133 B21R2.14086 CNCCCOc1ccccc1Sc2cncc(c2)Cl 62a_100000049639_100015186278 [0,1,1,0,0,0|2,0,0]=4 134 B21R2.14086 CNCCCOc1ccccc1Sc2cncc(c2)Cl 62a_100015186278_100000049639 [0,1,1,0,0,0|2,0,0]=4 135 B21R2.14086 CNCCCOc1ccccc1Sc2cncc(c2)F 62a_100000744099_100015186278 [0,1,1,0,0,0|2,0,0]=4 136 B21R2.14086 CNCCCOc1ccccc1Sc2cncc(c2)F 62a_100015186278_100000744099 [0,1,1,0,0,0|2,0,0]=4 137 B21R2.14086 CNCCCOc1ccccc1Sc2cncc(c2)N 62a_100000687067_100015186278 [0,1,1,0,0,0|2,0,0]=4 138 B21R2.14086 CNCCCOc1ccccc1Sc2cncc(c2)N 62a_100015186278_100000687067 [0,1,1,0,0,0|2,0,0]=4 139 B21R2.14086 CNCCCOc1ccccc1Sc2cncc(c2)O 62a_100000754920_100015186278 [0,1,1,0,0,0|2,0,0]=4 140 B21R2.14086 CNCCCOc1ccccc1Sc2cncc(c2)O 62a_100015186278_100000754920 [0,1,1,0,0,0|2,0,0]=4 141 B21R2.14086 COCCCNc1ccccc1Oc2cccc(c2)C 2230a_100000184146_100000740836 [0,1,1,0,0,0|1,1,0]=4 142 B21R2.14086 COCCCNc1ccccc1Oc2cccc(c2)C 34a_100000184146_100000740836 [0,1,1,0,0,0|1,1,0]=4 143 B21R2.14086 COCCCNc1ccccc1Oc2cccc(c2)C 7a_100000184146_100000740836 [0,1,1,0,0,0|1,1,0]=4 144 B21R2.14086 COCCCNc1ccccc1Oc2cccc(c2)F 2230a_100000743720_100000740836 [0,1,1,0,0,0|1,1,0]=4 145 B21R2.14086 COCCCNc1ccccc1Oc2cccc(c2)F 34a_100000743720_100000740836 [0,1,1,0,0,0|1,1,0]=4 146 B21R2.14086 COCCCNc1ccccc1Oc2cccc(c2)F 7a_100000743720_100000740836 [0,1,1,0,0,0|1,1,0]=4 147 B21R2.16951 CCCC(=O)CNc1ccccc1Sc2ccccc2 2230a_100000210917_100000747444 [0,1,1,0,0,0|1,0,1]=4 148 B21R2.16951 COCC(O)CNc1ccccc1Cc2ccccc2 34a_100000211252_100011215053 [0,1,1,0,0,0|2,0,0]=4 149 B21R2.16951 COCC(O)CNc1ccccc1Cc2ccccc2 7a_100000211252_100011215053 [0,1,1,0,0,0|2,0,0]=4 150 B21R2.16951 COCC(O)CNc1ccccc1Oc2ccccc2 34a_100000182328_100011215053 [0,1,1,0,0,0|1,1,0]=4 151 B21R2.16951 N#CC[C@H](O)CNc1ccccc1Sc2ccccc2 2230a_100000210917_100000001066 [0,1,1,0,0,0|2,0,0]=4 152 B21R2.21331 C#CCCCNc1ccccc1Sc2ccc(cc2)F 34a_100011228964_100000695029 [0,1,1,0,0,0|1,0,1]=4 153 B21R2.21331 CCOCCNc1ccccc1Sc2ccc(cc2)Cl 2230a_100000211321_100011215890 [0,1,1,0,0,0|2,0,0]=4 154 B21R2.21331 CCOCCNc1ccccc1Sc2ccc(cc2)F 34a_100011228964_100000210147 [0,1,1,0,0,0|2,0,0]=4 155 B21R2.21331 CNCCCOc1ccccc1Sc2cc[n+](cc2)[O-] 62a_100015186278_100000039755 [0,1,1,0,0,0|2,0,0]=4 156 B21R2.21331 CNCCCOc1ccccc1Sc2ccc(=O)[nH]c2 62a_100000212171_100015186278 [0,1,1,0,0,0|2,0,0]=4 157 B21R2.21331 CNCCCOc1ccccc1Sc2ccc(=O)[nH]c2 62a_100015186278_100000212171 [0,1,1,0,0,0|2,0,0]=4 158 B21R2.21331 CNCCCOc1ccccc1Sc2ccc(cc2)Br 62a_100000752885_100015186278 [0,1,1,0,0,0|1,0,0]=3 159 B21R2.21331 CNCCCOc1ccccc1Sc2ccc(cc2)Br 62a_100015186278_100000752885 [0,1,1,0,0,0|1,0,0]=3 160 B21R2.21331 CNCCCOc1ccccc1Sc2ccc(cc2)C 62a_100000186775_100015186278 [0,1,1,0,0,0|1,0,0]=3 161 B21R2.21331 CNCCCOc1ccccc1Sc2ccc(cc2)C 62a_100015186278_100000186775 [0,1,1,0,0,0|1,0,0]=3 162 B21R2.21331 CNCCCOc1ccccc1Sc2ccc(cc2)Cl 62a_100000755918_100015186278 [0,1,1,0,0,0|1,0,0]=3 163 B21R2.21331 CNCCCOc1ccccc1Sc2ccc(cc2)Cl 62a_100015186278_100000755918 [0,1,1,0,0,0|1,0,0]=3 164 B21R2.21331 CNCCCOc1ccccc1Sc2ccc(cc2)F 62a_100000211213_100015186278 [0,1,1,0,0,0|1,0,0]=3 165 B21R2.21331 CNCCCOc1ccccc1Sc2ccc(cc2)F 62a_100015186278_100000211213 [0,1,1,0,0,0|1,0,0]=3 166 B21R2.21331 CNCCCOc1ccccc1Sc2ccc(cc2)N 62a_100000185761_100015186278 [0,1,1,0,0,0|1,0,0]=3 167 B21R2.21331 CNCCCOc1ccccc1Sc2ccc(cc2)N 62a_100015186278_100000185761 [0,1,1,0,0,0|1,0,0]=3 168 B21R2.21331 CNCCCOc1ccccc1Sc2ccc(cc2)O 62a_100015186278_100000185759 [0,1,1,0,0,0|1,0,0]=3 169 B21R2.21331 CNCCCOc1ccccc1Sc2ccc(cn2)Br 62a_100000686858_100015186278 [0,1,1,0,0,0|2,0,0]=4 170 B21R2.21331 CNCCCOc1ccccc1Sc2ccc(cn2)Br 62a_100015186278_100000686858 [0,1,1,0,0,0|2,0,0]=4 171 B21R2.21331 CNCCCOc1ccccc1Sc2ccc(cn2)C 62a_100011192072_100015186278 [0,1,1,0,0,0|2,0,0]=4 172 B21R2.21331 CNCCCOc1ccccc1Sc2ccc(cn2)C 62a_100015186278_100000754016 [0,1,1,0,0,0|2,0,0]=4 173 B21R2.21331 CNCCCOc1ccccc1Sc2ccc(cn2)Cl 62a_100011356976_100015186278 [0,1,1,0,0,0|2,0,0]=4 174 B21R2.21331 CNCCCOc1ccccc1Sc2ccc(cn2)Cl 62a_100015186278_100011356976 [0,1,1,0,0,0|2,0,0]=4 175 B21R2.21331 CNCCCOc1ccccc1Sc2ccc(cn2)F 62a_100000744514_100015186278 [0,1,1,0,0,0|2,0,0]=4 176 B21R2.21331 CNCCCOc1ccccc1Sc2ccc(cn2)F 62a_100015186278_100000744514 [0,1,1,0,0,0|2,0,0]=4 177 B21R2.21331 CNCCCOc1ccccc1Sc2ccc(cn2)N 62a_100000737798_100015186278 [0,1,1,0,0,0|2,0,0]=4 178 B21R2.21331 CNCCCOc1ccccc1Sc2ccc(cn2)N 62a_100015186278_100000737798 [0,1,1,0,0,0|2,0,0]=4 179 B21R2.21331 CNCCCOc1ccccc1Sc2ccc(cn2)O 62a_100000685995_100015186278 [0,1,1,0,0,0|2,0,0]=4 180 B21R2.21331 CNCCCOc1ccccc1Sc2ccc(cn2)O 62a_100015186278_100000744096 [0,1,1,0,0,0|2,0,0]=4 181 B21R2.21331 CNCCCOc1ccccc1Sc2ccc(nc2)Br 62a_100009814638_100015186278 [0,1,1,0,0,0|2,0,0]=4 182 B21R2.21331 CNCCCOc1ccccc1Sc2ccc(nc2)Br 62a_100015186278_100009814638 [0,1,1,0,0,0|2,0,0]=4 183 B21R2.21331 CNCCCOc1ccccc1Sc2ccc(nc2)C 62a_100000751577_100015186278 [0,1,1,0,0,0|2,0,0]=4 184 B21R2.21331 CNCCCOc1ccccc1Sc2ccc(nc2)C 62a_100015186278_100000751577 [0,1,1,0,0,0|2,0,0]=4 185 B21R2.21331 CNCCCOc1ccccc1Sc2ccc(nc2)Cl 62a_100000034144_100015186278 [0,1,1,0,0,0|2,0,0]=4 186 B21R2.21331 CNCCCOc1ccccc1Sc2ccc(nc2)Cl 62a_100015186278_100000034144 [0,1,1,0,0,0|2,0,0]=4 187 B21R2.21331 CNCCCOc1ccccc1Sc2ccc(nc2)F 62a_100000042367_100015186278 [0,1,1,0,0,0|2,0,0]=4 188 B21R2.21331 CNCCCOc1ccccc1Sc2ccc(nc2)F 62a_100015186278_100000042367 [0,1,1,0,0,0|2,0,0]=4 189 B21R2.21331 CNCCCOc1ccccc1Sc2ccc(nc2)N 62a_100000187370_100015186278 [0,1,1,0,0,0|2,0,0]=4 190 B21R2.21331 CNCCCOc1ccccc1Sc2ccc(nc2)N 62a_100015186278_100000187370 [0,1,1,0,0,0|2,0,0]=4 191 B21R2.21331 COCCCNc1ccccc1Oc2ccc(cc2)C 34a_100025771381_100000740836 [0,1,1,0,0,0|1,1,0]=4 192 B21R2.21331 COCCCNc1ccccc1Oc2ccc(cc2)Cl 2230a_100000745279_100000740836 [0,1,1,0,0,0|1,1,0]=4 193 B21R2.21331 COCCCNc1ccccc1Oc2ccc(cc2)Cl 34a_100000745279_100000740836 [0,1,1,0,0,0|1,1,0]=4 194 B21R2.21331 COCCCNc1ccccc1Oc2ccc(cc2)F 2230a_100011202611_100000740836 [0,1,1,0,0,0|1,1,0]=4 195 B21R2.21331 COCCCNc1ccccc1Oc2ccc(cc2)F 34a_100011202611_100000740836 [0,1,1,0,0,0|1,1,0]=4 196 B21R2.21331 COCCCNc1ccccc1Sc2ccc(cc2)Cl 2230a_100000211321_100000740836 [0,1,1,0,0,0|1,0,0]=3 197 B21R2.21331 COCCCNc1ccccc1Sc2ccc(cc2)F 34a_100011228964_100000740836 [0,1,1,0,0,0|1,0,0]=3 198 B21R2.21331 O=CCCCNc1ccccc1Sc2ccc(cc2)Cl 2230a_100000211321_200011292268 [0,1,1,0,0,0|2,0,0]=4 199 B21R2.21331 OCCCCNc1ccccc1Sc2ccc(cc2)Cl 2230a_100000211321_100000210776 [0,1,1,0,0,0|2,0,0]=4 200 B21R2.21331 OCCCCNc1ccccc1Sc2ccc(cc2)F 34a_100011228964_100011216708 [0,1,1,0,0,0|2,0,0]=4 201 B21R2.23057 CNC(=O)CCNc1ccccc1Cc2ccccc2 2230a_100000211252_100000737683 [0,1,1,0,0,0|1,0,1]=4 202 B21R2.23057 CNC(=O)CCNc1ccccc1Cc2ccccc2 34a_100000211252_100012179268 [0,1,1,0,0,0|1,0,1]=4 203 B21R2.23057 CNC(=O)CCNc1ccccc1Cc2ccccc2 7a_100000211252_100000737683 [0,1,1,0,0,0|1,0,1]=4 204 B21R2.23057 CNC(=O)CCNc1ccccc1Oc2ccccc2 2230a_100000182328_100000737683 [0,1,1,0,0,0|0,1,1]=4 205 B21R2.23057 CNC(=O)CCNc1ccccc1Oc2ccccc2 34a_100000182328_100012179268 [0,1,1,0,0,0|0,1,1]=4 206 B21R2.23057 CNC(=O)CCNc1ccccc1Sc2ccccc2 2230a_100000210917_100000737683 [0,1,1,0,0,0|0,0,1]=3 207 B21R2.23057 COC(=O)CCNc1ccccc1Sc2ccccc2 2230a_100000210917_100000204255 [0,1,1,0,0,0|1,0,1]=4 208 B21R2.24297 C#CCOCCNc1ccccc1Sc2ccccc2 2230a_100000210917_100010402529 [0,1,1,0,0,0|1,0,1]=4 209 B21R2.24297 CCCCCNCc1ccccc1Cc2ccccc2 207a_100000209983_100009842342 [0,1,1,0,0,0|2,0,0]=4 210 B21R2.24297 CCCCCNCc1ccccc1Cc2ccccc2 2230a_100000209983_100010254464 [0,1,1,0,0,0|2,0,0]=4 211 B21R2.24297 CCCCCNCc1ccccc1Cc2ccccc2 270004a_100000209983_100009842342 [0,1,1,0,0,0|2,0,0]=4 212 B21R2.24297 CCCCCNCc1ccccc1Oc2ccccc2 207a_100000209983_100011234122 [0,1,1,0,0,0|1,1,0]=4 213 B21R2.24297 CCCCCNCc1ccccc1Oc2ccccc2 2230a_100000209983_100000199117 [0,1,1,0,0,0|1,1,0]=4 214 B21R2.24297 CCCCCNCc1ccccc1Oc2ccccc2 2230a_100016987831_100000210326 [0,1,1,0,0,0|1,1,0]=4 215 B21R2.24297 CCCCCNCc1ccccc1Oc2ccccc2 270004a_100000209983_100011234122 [0,1,1,0,0,0|1,1,0]=4 216 B21R2.24297 CCCCCNCc1ccccc1Oc2ccccc2 34a_100016987831_100000718602 [0,1,1,0,0,0|1,1,0]=4 217 B21R2.24297 CCCCOCNc1ccccc1Cc2ccccc2 2230a_100000211252_100011995733 [0,1,1,0,0,0|2,0,0]=4 218 B21R2.24297 CCCCOCNc1ccccc1Cc2ccccc2 34a_100000211252_100011995733 [0,1,1,0,0,0|2,0,0]=4 219 B21R2.24297 CCCCOCNc1ccccc1Oc2ccccc2 2230a_100000182328_100011995733 [0,1,1,0,0,0|1,1,0]=4 220 B21R2.24297 CCCCOCNc1ccccc1Oc2ccccc2 34a_100000182328_100011995733 [0,1,1,0,0,0|1,1,0]=4 221 B21R2.24297 CCCOCCNc1ccccc1Cc2ccccc2 2230a_100000211252_100011215938 [0,1,1,0,0,0|2,0,0]=4 222 B21R2.24297 CCCOCCNc1ccccc1Cc2ccccc2 34a_100000211252_100011215938 [0,1,1,0,0,0|2,0,0]=4 223 B21R2.24297 CCCOCCNc1ccccc1Cc2ccccc2 7a_100000211252_100011215938 [0,1,1,0,0,0|2,0,0]=4 224 B21R2.24297 CCCOCCNc1ccccc1Oc2ccccc2 2230a_100000182328_100011215938 [0,1,1,0,0,0|1,1,0]=4 225 B21R2.24297 CCCOCCNc1ccccc1Oc2ccccc2 34a_100000182328_100011215938 [0,1,1,0,0,0|1,1,0]=4 226 B21R2.24297 CCCOCCNc1ccccc1Sc2ccccc2 2230a_100000210917_100011215938 [0,1,1,0,0,0|1,0,0]=3 227 B21R2.24297 CCOCCCNc1ccccc1Cc2ccccc2 2230a_100000211252_100012232248 [0,1,1,0,0,0|2,0,0]=4 228 B21R2.24297 CCOCCCNc1ccccc1Cc2ccccc2 34a_100000211252_100012232248 [0,1,1,0,0,0|2,0,0]=4 229 B21R2.24297 CCOCCCNc1ccccc1Cc2ccccc2 7a_100000211252_100012232248 [0,1,1,0,0,0|2,0,0]=4 230 B21R2.24297 CCOCCCNc1ccccc1Oc2ccccc2 2230a_100000182328_100012232248 [0,1,1,0,0,0|1,1,0]=4 231 B21R2.24297 CCOCCCNc1ccccc1Oc2ccccc2 34a_100000182328_100012232248 [0,1,1,0,0,0|1,1,0]=4 232 B21R2.24297 CCOCCCNc1ccccc1Sc2ccccc2 2230a_100000210917_100012232248 [0,1,1,0,0,0|1,0,0]=3 233 B21R2.24297 CNCCCOCc1ccccc1Cc2ccccc2 34a_100000213112_100010254464 [0,1,1,0,0,0|2,0,0]=4 234 B21R2.24297 COCCCCNc1ccccc1Cc2ccccc2 2230a_100000211252_100000730899 [0,1,1,0,0,0|2,0,0]=4 235 B21R2.24297 COCCCCNc1ccccc1Cc2ccccc2 34a_100000211252_100000755781 [0,1,1,0,0,0|2,0,0]=4 236 B21R2.24297 COCCCCNc1ccccc1Cc2ccccc2 7a_100000211252_100000730899 [0,1,1,0,0,0|2,0,0]=4 237 B21R2.24297 COCCCCNc1ccccc1Oc2ccccc2 2230a_100000182328_100000730899 [0,1,1,0,0,0|1,1,0]=4 238 B21R2.24297 COCCCCNc1ccccc1Oc2ccccc2 34a_100000182328_100000755781 [0,1,1,0,0,0|1,1,0]=4 239 B21R2.24297 COCCCCNc1ccccc1Sc2ccccc2 2230a_100000210917_100000730899 [0,1,1,0,0,0|1,0,0]=3 240 B21R2.24297 COCCCNCc1ccccc1Cc2ccccc2 207a_100150723488_100009842342 [0,1,1,0,0,0|2,0,0]=4 241 B21R2.24297 COCCCNCc1ccccc1Cc2ccccc2 270004a_100150723488_100009842342 [0,1,1,0,0,0|2,0,0]=4 242 B21R2.24297 COCCCNCc1ccccc1Cc2ccccc2 34a_100150723488_100010254464 [0,1,1,0,0,0|2,0,0]=4 243 B21R2.24297 COCCCNCc1ccccc1Oc2ccccc2 207a_100150723488_100011234122 [0,1,1,0,0,0|1,1,0]=4 244 B21R2.24297 COCCCNCc1ccccc1Oc2ccccc2 2230a_100016987831_100000740836 [0,1,1,0,0,0|1,1,0]=4 245 B21R2.24297 COCCCNCc1ccccc1Oc2ccccc2 270004a_100150723488_100011234122 [0,1,1,0,0,0|1,1,0]=4 246 B21R2.24297 COCCCNCc1ccccc1Oc2ccccc2 34a_100016987831_100000740836 [0,1,1,0,0,0|1,1,0]=4 247 B21R2.24297 COCCOCNc1ccccc1Cc2ccccc2 2230a_100000211252_100000231047 [0,1,1,0,0,0|2,0,0]=4 248 B21R2.24297 COCCOCNc1ccccc1Oc2ccccc2 2230a_100000182328_100000231047 [0,1,1,0,0,0|1,1,0]=4 249 B21R2.24297 COCCOCNc1ccccc1Sc2ccccc2 2230a_100000210917_100000231047 [0,1,1,0,0,0|1,0,0]=3 250 B21R2.24297 CSCCCNCc1ccccc1Cc2ccccc2 207a_100000749238_100009842342 [0,1,1,0,0,0|2,0,0]=4 251 B21R2.24297 CSCCCNCc1ccccc1Cc2ccccc2 2230a_100000749238_100010254464 [0,1,1,0,0,0|2,0,0]=4 252 B21R2.24297 CSCCCNCc1ccccc1Cc2ccccc2 270004a_100000749238_100009842342 [0,1,1,0,0,0|2,0,0]=4 253 B21R2.24297 CSCCCNCc1ccccc1Oc2ccccc2 207a_100000749238_100011234122 [0,1,1,0,0,0|1,1,0]=4 254 B21R2.24297 CSCCCNCc1ccccc1Oc2ccccc2 2230a_100000749238_100000199117 [0,1,1,0,0,0|1,1,0]=4 255 B21R2.24297 CSCCCNCc1ccccc1Oc2ccccc2 270004a_100000749238_100011234122 [0,1,1,0,0,0|1,1,0]=4 256 B21R2.24297 FCCCCCNc1ccccc1Cc2ccccc2 2230a_100000211252_100000729378 [0,1,1,0,0,0|2,0,0]=4 257 B21R2.24297 FCCCCCNc1ccccc1Cc2ccccc2 34a_100000211252_100000729378 [0,1,1,0,0,0|2,0,0]=4 258 B21R2.24297 FCCCCCNc1ccccc1Cc2ccccc2 7a_100000211252_100000729378 [0,1,1,0,0,0|2,0,0]=4 259 B21R2.24297 N#CCCCCNc1ccccc1Sc2ccccc2 2230a_100000210917_100000211819 [0,1,1,0,0,0|1,0,1]=4 260 B21R2.24297 N#CCOCCNc1ccccc1Sc2ccccc2 2230a_100000210917_200000047693 [0,1,1,0,0,0|2,0,0]=4 261 B21R2.24297 O=CCCCCNc1ccccc1Sc2ccccc2 2230a_100000210917_100000139335 [0,1,1,0,0,0|1,0,1]=4 262 B21R2.24297 OCCCCCNc1ccccc1Cc2ccccc2 2230a_100000211252_100000746330 [0,1,1,0,0,0|2,0,0]=4 263 B21R2.24297 OCCCCCNc1ccccc1Cc2ccccc2 34a_100000211252_100000746330 [0,1,1,0,0,0|2,0,0]=4 264 B21R2.24297 OCCCCCNc1ccccc1Cc2ccccc2 7a_100000211252_100000746330 [0,1,1,0,0,0|2,0,0]=4 265 B21R2.24297 OCCCCCNc1ccccc1Oc2ccccc2 2230a_100000182328_100000746330 [0,1,1,0,0,0|1,1,0]=4 266 B21R2.24297 OCCCCCNc1ccccc1Oc2ccccc2 34a_100000182328_100000746330 [0,1,1,0,0,0|1,1,0]=4 267 B21R2.24297 OCCCCCNc1ccccc1Sc2ccccc2 2230a_100000210917_100000746330 [0,1,1,0,0,0|1,0,0]=3 268 B21R2.24297 OCCOCCNc1ccccc1Sc2ccccc2 2230a_100000210917_100011215305 [0,1,1,0,0,0|2,0,0]=4 269 B21R2.25774 CCCCC(=O)Nc1ccccc1Sc2ccccc2 11a_100000210917_100000210183 [0,1,1,0,0,0|1,0,1]=4 270 B21R2.25774 CCCCC(=O)Nc1ccccc1Sc2ccccc2 1626a_100000210917_100000210183 [0,1,1,0,0,0|1,0,1]=4 271 B21R2.25774 CCCCC(=O)Nc1ccccc1Sc2ccccc2 22a_100000210917_100000210183 [0,1,1,0,0,0|1,0,1]=4 272 B21R2.25774 CNCCC(=O)Nc1ccccc1Oc2ccccc2 2230a_106832991635_100000594783 [0,1,1,0,0,0|0,1,1]=4 273 B21R2.25774 CNCCC(=O)Nc1ccccc1Oc2ccccc2 7a_106832991635_100000594783 [0,1,1,0,0,0|0,1,1]=4 274 B21R2.25774 COCCC(=O)Nc1ccccc1Sc2ccccc2 11a_100000210917_100000749529 [0,1,1,0,0,0|1,0,1]=4 275 B21R2.25774 COCCC(=O)Nc1ccccc1Sc2ccccc2 1626a_100000210917_100000749529 [0,1,1,0,0,0|1,0,1]=4 276 B21R2.25774 COCCC(=O)Nc1ccccc1Sc2ccccc2 22a_100000210917_100000749529 [0,1,1,0,0,0|1,0,1]=4 277 B21R2.25774 CSCCC(=O)Nc1ccccc1Sc2ccccc2 11a_100000210917_100000174002 [0,1,1,0,0,0|1,0,1]=4 278 B21R2.25774 CSCCC(=O)Nc1ccccc1Sc2ccccc2 1626a_100000210917_100000174002 [0,1,1,0,0,0|1,0,1]=4 279 B21R2.25774 CSCCC(=O)Nc1ccccc1Sc2ccccc2 22a_100000210917_100000174002 [0,1,1,0,0,0|1,0,1]=4 280 B21R2.273552 CNCCCOc1ccccc1Sc2c[nH]ccc2=O 62a_100009998708_100015186278 [0,1,1,0,0,0|2,0,0]=4 281 B21R2.273552 CNCCCOc1ccccc1Sc2c[nH]ccc2=O 62a_100015186278_100009998708 [0,1,1,0,0,0|2,0,0]=4 282 B21R2.273552 CNCCCOc1ccccc1Sc2c[nH]ccc2=S 62a_100015186278_200012280681 [0,1,1,0,0,0|2,0,0]=4 283 B21R2.273552 CNCCCOc1ccccc1Sc2c[nH]ccc2=S 62a_200012280681_100015186278 [0,1,1,0,0,0|2,0,0]=4 284 B21R2.273552 CNCCCOc1ccccc1Sc2cccc[n+]2C 62a_100015186278_100000212160 [0,1,1,0,0,0|2,0,0]=4 285 B21R2.273552 CNCCCOc1ccccc1Sc2cccc[n+]2[O-] 62a_100015186278_200000042595 [0,1,1,0,0,0|2,0,0]=4 286 B21R2.273552 CNCCCOc1ccccc1Sc2ccccc2Br 62a_100000695589_100015186278 [0,1,1,0,0,0|1,0,0]=3 287 B21R2.273552 CNCCCOc1ccccc1Sc2ccccc2Br 62a_100015186278_100000695589 [0,1,1,0,0,0|1,0,0]=3 288 B21R2.273552 CNCCCOc1ccccc1Sc2ccccc2C 62a_100000210755_100015186278 [0,1,1,0,0,0|1,0,0]=3 289 B21R2.273552 CNCCCOc1ccccc1Sc2ccccc2C 62a_100015186278_100000210755 [0,1,1,0,0,0|1,0,0]=3 290 B21R2.273552 CNCCCOc1ccccc1Sc2ccccc2Cl 62a_100000764095_100015186278 [0,1,1,0,0,0|1,0,0]=3 291 B21R2.273552 CNCCCOc1ccccc1Sc2ccccc2Cl 62a_100015186278_100000764095 [0,1,1,0,0,0|1,0,0]=3 292 B21R2.273552 CNCCCOc1ccccc1Sc2ccccc2F 62a_100011215700_100015186278 [0,1,1,0,0,0|1,0,0]=3 293 B21R2.273552 CNCCCOc1ccccc1Sc2ccccc2F 62a_100015186278_100011215700 [0,1,1,0,0,0|1,0,0]=3 294 B21R2.273552 CNCCCOc1ccccc1Sc2ccccc2N 62a_100000210017_100015186278 [0,1,1,0,0,0|1,0,0]=3 295 B21R2.273552 CNCCCOc1ccccc1Sc2ccccc2N 62a_100015186278_100000210017 [0,1,1,0,0,0|1,0,0]=3 296 B21R2.273552 CNCCCOc1ccccc1Sc2ccccc2O 62a_100000739446_100015186278 [0,1,1,0,0,0|1,0,0]=3 297 B21R2.273552 CNCCCOc1ccccc1Sc2ccccc2O 62a_100015186278_100000739446 [0,1,1,0,0,0|1,0,0]=3 298 B21R2.273552 CNCCCOc1ccccc1Sc2cccnc2Br 62a_100010202626_100015186278 [0,1,1,0,0,0|2,0,0]=4 299 B21R2.273552 CNCCCOc1ccccc1Sc2cccnc2Br 62a_100015186278_100010202626 [0,1,1,0,0,0|2,0,0]=4 300 B21R2.273552 CNCCCOc1ccccc1Sc2cccnc2C 62a_100000751574_100015186278 [0,1,1,0,0,0|2,0,0]=4 301 B21R2.273552 CNCCCOc1ccccc1Sc2cccnc2C 62a_100015186278_100000751574 [0,1,1,0,0,0|2,0,0]=4 302 B21R2.273552 CNCCCOc1ccccc1Sc2cccnc2Cl 62a_100000036424_100015186278 [0,1,1,0,0,0|2,0,0]=4 303 B21R2.273552 CNCCCOc1ccccc1Sc2cccnc2Cl 62a_100015186278_100000036424 [0,1,1,0,0,0|2,0,0]=4 304 B21R2.273552 CNCCCOc1ccccc1Sc2cccnc2F 62a_100009816115_100015186278 [0,1,1,0,0,0|2,0,0]=4 305 B21R2.273552 CNCCCOc1ccccc1Sc2cccnc2F 62a_100015186278_100009816115 [0,1,1,0,0,0|2,0,0]=4 306 B21R2.273552 CNCCCOc1ccccc1Sc2cccnc2N 62a_100000045569_100015186278 [0,1,1,0,0,0|2,0,0]=4 307 B21R2.273552 CNCCCOc1ccccc1Sc2cccnc2N 62a_100015186278_100000045569 [0,1,1,0,0,0|2,0,0]=4 308 B21R2.273552 CNCCCOc1ccccc1Sc2cccnc2O 62a_100000760158_100015186278 [0,1,1,0,0,0|2,0,0]=4 309 B21R2.273552 CNCCCOc1ccccc1Sc2cccnc2O 62a_100015186278_100000760158 [0,1,1,0,0,0|2,0,0]=4 310 B21R2.273552 CNCCCOc1ccccc1Sc2ccncc2Br 62a_100000726257_100015186278 [0,1,1,0,0,0|2,0,0]=4 311 B21R2.273552 CNCCCOc1ccccc1Sc2ccncc2Br 62a_100015186278_100000726257 [0,1,1,0,0,0|2,0,0]=4 312 B21R2.273552 CNCCCOc1ccccc1Sc2ccncc2C 62a_100000765111_100015186278 [0,1,1,0,0,0|2,0,0]=4 313 B21R2.273552 CNCCCOc1ccccc1Sc2ccncc2C 62a_100015186278_100000765111 [0,1,1,0,0,0|2,0,0]=4 314 B21R2.273552 CNCCCOc1ccccc1Sc2ccncc2Cl 62a_100000708259_100015186278 [0,1,1,0,0,0|2,0,0]=4 315 B21R2.273552 CNCCCOc1ccccc1Sc2ccncc2Cl 62a_100015186278_100000708259 [0,1,1,0,0,0|2,0,0]=4 316 B21R2.273552 CNCCCOc1ccccc1Sc2ccncc2F 62a_100000047030_100015186278 [0,1,1,0,0,0|2,0,0]=4 317 B21R2.273552 CNCCCOc1ccccc1Sc2ccncc2F 62a_100015186278_100000047030 [0,1,1,0,0,0|2,0,0]=4 318 B21R2.273552 CNCCCOc1ccccc1Sc2ccncc2N 62a_100000756074_100015186278 [0,1,1,0,0,0|2,0,0]=4 319 B21R2.273552 CNCCCOc1ccccc1Sc2ccncc2N 62a_100015186278_100000756074 [0,1,1,0,0,0|2,0,0]=4 320 B21R2.273552 CNCCCOc1ccccc1Sc2ccncc2O 62a_100009817591_100015186278 [0,1,1,0,0,0|2,0,0]=4 321 B21R2.273552 CNCCCOc1ccccc1Sc2ccncc2O 62a_100015186278_100009817591 [0,1,1,0,0,0|2,0,0]=4 322 B21R2.273552 CNCCCOc1ccccc1Sc2cnccc2Br 62a_100010138639_100015186278 [0,1,1,0,0,0|2,0,0]=4 323 B21R2.273552 CNCCCOc1ccccc1Sc2cnccc2Br 62a_100015186278_100010138639 [0,1,1,0,0,0|2,0,0]=4 324 B21R2.273552 CNCCCOc1ccccc1Sc2cnccc2C 62a_100000761580_100015186278 [0,1,1,0,0,0|2,0,0]=4 325 B21R2.273552 CNCCCOc1ccccc1Sc2cnccc2C 62a_100015186278_100000761580 [0,1,1,0,0,0|2,0,0]=4 326 B21R2.273552 CNCCCOc1ccccc1Sc2cnccc2Cl 62a_100009995489_100015186278 [0,1,1,0,0,0|2,0,0]=4 327 B21R2.273552 CNCCCOc1ccccc1Sc2cnccc2Cl 62a_100015186278_100009995489 [0,1,1,0,0,0|2,0,0]=4 328 B21R2.273552 CNCCCOc1ccccc1Sc2cnccc2F 62a_100009820683_100015186278 [0,1,1,0,0,0|2,0,0]=4 329 B21R2.273552 CNCCCOc1ccccc1Sc2cnccc2F 62a_100015186278_100009820683 [0,1,1,0,0,0|2,0,0]=4 330 B21R2.273552 CNCCCOc1ccccc1Sc2cnccc2N 62a_100000047001_100015186278 [0,1,1,0,0,0|2,0,0]=4 331 B21R2.273552 CNCCCOc1ccccc1Sc2cnccc2N 62a_100015186278_100000047001 [0,1,1,0,0,0|2,0,0]=4 332 B21R2.273552 CNCCCOc1ccccc1Sc2ncccc2Br 62a_100000696092_100015186278 [0,1,1,0,0,0|2,0,0]=4 333 B21R2.273552 CNCCCOc1ccccc1Sc2ncccc2Br 62a_100015186278_100000696092 [0,1,1,0,0,0|2,0,0]=4 334 B21R2.273552 CNCCCOc1ccccc1Sc2ncccc2C 62a_100000751373_100015186278 [0,1,1,0,0,0|2,0,0]=4 335 B21R2.273552 CNCCCOc1ccccc1Sc2ncccc2C 62a_100015186278_100000751373 [0,1,1,0,0,0|2,0,0]=4 336 B21R2.273552 CNCCCOc1ccccc1Sc2ncccc2Cl 62a_100011356963_100015186278 [0,1,1,0,0,0|2,0,0]=4 337 B21R2.273552 CNCCCOc1ccccc1Sc2ncccc2Cl 62a_100015186278_100011356963 [0,1,1,0,0,0|2,0,0]=4 338 B21R2.273552 CNCCCOc1ccccc1Sc2ncccc2F 62a_100000685392_100015186278 [0,1,1,0,0,0|2,0,0]=4 339 B21R2.273552 CNCCCOc1ccccc1Sc2ncccc2F 62a_100015186278_100000685392 [0,1,1,0,0,0|2,0,0]=4 340 B21R2.273552 CNCCCOc1ccccc1Sc2ncccc2N 62a_100000688686_100015186278 [0,1,1,0,0,0|2,0,0]=4 341 B21R2.273552 CNCCCOc1ccccc1Sc2ncccc2N 62a_100015186278_100000688686 [0,1,1,0,0,0|2,0,0]=4 342 B21R2.273552 CNCCCOc1ccccc1Sc2ncccc2O 62a_100000034122_100015186278 [0,1,1,0,0,0|2,0,0]=4 343 B21R2.273552 CNCCCOc1ccccc1Sc2ncccc2O 62a_100015186278_100000034122 [0,1,1,0,0,0|2,0,0]=4 344 B21R2.273552 COCCCNc1ccccc1Oc2ccccc2C 2230a_100000188859_100000740836 [0,1,1,0,0,0|1,1,0]=4 345 B21R2.273552 COCCCNc1ccccc1Oc2ccccc2C 34a_100000188859_100000740836 [0,1,1,0,0,0|1,1,0]=4 346 B21R2.273552 COCCCNc1ccccc1Oc2ccccc2C 7a_100000188859_100000740836 [0,1,1,0,0,0|1,1,0]=4 347 B23R3.25657126 COCCCOC1c2ccccc2CSc3c1cccc3 7a_100025745337_100000740836 [0,1,0,0,0,1|2,0,0]=4 348 B23R3.26139327 CN(C)CCOC1c2ccccc2CSc3c1cccc3 7a_100025745337_100000755713 [0,1,0,0,0,1|2,0,0]=4 349 B23R3.32306063 CNCCC(=O)N1c2ccccc2CCc3c1cccc3 2230a_106832991635_200020598663 [0,1,0,0,0,1|1,0,1]=4 350 B23R3.32306063 CNCCC(=O)N1c2ccccc2CCc3c1cccc3 7a_106832991635_200020598663 [0,1,0,0,0,1|1,0,1]=4 351 B23R3.3346798 CCNCCC(=O)N1c2ccccc2Sc3c1cccc3 2230a_100015525214_200015341630 [0,2,0,0,0,0|0,0,1]=3 352 B23R3.32306484 CNCCC(=O)N1c2ccccc2Sc3c1cc(cc3)Cl 2230a_106832991635_200025748283 [0,2,0,0,0,0|0,0,1]=3 353 B23R3.32306484 CNCCC(=O)N1c2ccccc2Sc3c1cc(cc3)Cl 7a_106832991635_200025748283 [0,2,0,0,0,0|0,0,1]=3 354 B23R3.41925352 CC(=O)CCC(=O)N1c2ccccc2Sc3c1cccc3 1458a_100000070787_200015341630 [0,2,0,0,0,0|1,0,1]=4 355 B23R3.41925352 CN(C)CCC(=O)N1c2ccccc2Sc3c1cccc3 2230a_100102631434_200015341630 [0,2,0,0,0,0|0,0,1]=3 356 B23R3.41925352 CN(C)CCC(=O)N1c2ccccc2Sc3c1cccc3 269982a_100102631434_200015341630 [0,2,0,0,0,0|0,0,1]=3 357 B23R3.21302088 C#CCC(=O)CCN1c2ccccc2Sc3c1cccc3 1458a_200000489519_100000184674 [0,2,0,0,0,0|1,0,1]=4 358 B23R3.21302088 C=CCC(=O)CCN1c2ccccc2Sc3c1cccc3 1458a_200000489519_100000210623 [0,2,0,0,0,0|1,0,1]=4 359 B23R3.21302088 CCNC(=O)CCN1c2ccccc2Sc3c1cccc3 11a_100015525214_200000489519 [0,2,0,0,0,0|0,0,1]=3 360 B23R3.21302088 CCNC(=O)CCN1c2ccccc2Sc3c1cccc3 240690a_100015525214_200000489519 [0,2,0,0,0,0|0,0,1]=3 361 B23R3.21302088 CCNC(=O)CCN1c2ccccc2Sc3c1cccc3 527a_100015525214_200000489519 [0,2,0,0,0,0|0,0,1]=3 362 B23R3.21302088 CNNC(=O)CCN1c2ccccc2Sc3c1cccc3 22a_100016993582_200000489519 [0,2,0,0,0,0|0,0,1]=3 363 B23R3.21302088 N#CCC(=O)CCN1c2ccccc2Sc3c1cccc3 1458a_200000489519_100011214920 [0,2,0,0,0,0|2,0,0]=4 364 B23R3.21302088 O=C(CCF)CCN1c2ccccc2Sc3c1cccc3 1458a_200000489519_100011217306 [0,2,0,0,0,0|1,0,1]=4 365 B23R3.21302088 O=C(CCO)CCN1c2ccccc2Sc3c1cccc3 1458a_200000489519_100000211926 [0,2,0,0,0,0|1,0,1]=4 366 B23R3.38550080 CC(C)C(=O)CCN1c2ccccc2Sc3c1cccc3 1458a_200000489519_100000210206 [0,2,0,0,0,0|1,0,1]=4 367 B23R3.38550080 CN(C)C(=O)CCN1c2ccccc2Sc3c1cccc3 11a_100102631434_200000489519 [0,2,0,0,0,0|0,0,1]=3 368 B23R3.38550080 CN(C)C(=O)CCN1c2ccccc2Sc3c1cccc3 240690a_100102631434_200000489519 [0,2,0,0,0,0|0,0,1]=3 369 B23R3.38550080 CN(C)C(=O)CCN1c2ccccc2Sc3c1cccc3 527a_100102631434_200000489519 [0,2,0,0,0,0|0,0,1]=3 370 B23R3.19159989 CN(C)CCCOC1c2ccccc2Oc3c1cccc3 7a_100000210167_100000757444 [0,2,0,0,0,0|1,1,0]=4 371 B23R3.19159989 CN(C)CCCSc1c2ccccc2nc3c1cccc3 62a_100000044299_100000757444 [0,2,0,0,0,0|2,0,0]=4 372 B23R3.19159989 CN(C)CCNCc1c2ccccc2cc3c1cccc3 207a_100000210585_100000261405 [0,2,0,0,0,0|2,0,0]=4 373 B23R3.19159989 CN(C)CCNCc1c2ccccc2cc3c1cccc3 270004a_100000210585_100000261405 [0,2,0,0,0,0|2,0,0]=4 374 B23R3.19159989 CN(C)CCOCc1c2ccccc2cc3c1cccc3 7a_100000025838_100000755713 [0,2,0,0,0,0|2,0,0]=4 375 B23R3.19159989 CN(C)CCSCc1c2ccccc2cc3c1cccc3 62a_100009992879_100000755713 [0,2,0,0,0,0|2,0,0]=4 376 B23R3.19159989 CN(C)CCSCc1c2ccccc2nc3c1cccc3 62a_100009813545_100000755713 [0,2,0,0,0,0|2,0,0]=4 377 B23R3.31995510 CNCCCOCc1c2ccccc2cc3c1cccc3 34a_100000213112_100009992879 [0,2,0,0,0,0|2,0,0]=4 378 B21R2.14087 C#CCCCNc1ccccc1SCc2ccccc2 34a_100000198535_100000695029 [0,0,1,0,0,1|1,0,1]=4 379 B21R2.14087 C#CCCCNc1ccccc1SCc2ccccc2 7a_100000198535_100011215417 [0,0,1,0,0,1|1,0,1]=4 380 B21R2.14087 CCCCCNc1ccccc1C#Cc2ccccc2 2230a_100000044502_100000210326 [0,0,1,0,0,1|2,0,0]=4 381 B21R2.14087 CCCCCNc1ccccc1C#Cc2ccccc2 34a_100000044502_100000718602 [0,0,1,0,0,1|2,0,0]=4 382 B21R2.14087 CCCCCNc1ccccc1COc2ccccc2 2230a_100000742786_100000210326 [0,0,1,0,0,1|1,1,0]=4 383 B21R2.14087 CCCCCNc1ccccc1COc2ccccc2 34a_100000742786_100000718602 [0,0,1,0,0,1|1,1,0]=4 384 B21R2.14087 CCCCCNc1ccccc1COc2ccccc2 7a_100000742786_100000210326 [0,0,1,0,0,1|1,1,0]=4 385 B21R2.14087 CCCCCNc1ccccc1OCc2ccccc2 34a_100011193923_100000718602 [0,0,1,0,0,1|1,1,0]=4 386 B21R2.14087 CCOCCNc1ccccc1SCc2ccccc2 34a_100000198535_100000210147 [0,0,1,0,0,1|2,0,0]=4 387 B21R2.14087 CCOCCNc1ccccc1SCc2ccccc2 7a_100000198535_100011215890 [0,0,1,0,0,1|2,0,0]=4 388 B21R2.14087 CNCCCOc1ccccc1C#Cc2ccccc2 271570a_100000069678_100015186278 [0,0,1,0,0,1|2,0,0]=4 389 B21R2.14087 CNCCCOc1ccccc1C=Cc2ccccc2 271570a_100102527694_100015186278 [0,0,1,0,0,1|2,0,0]=4 390 B21R2.14087 CNCCCOc1ccccc1SCc2ccccc2 62a_100000211182_100015186278 [0,0,1,0,0,1|1,0,0]=3 391 B21R2.14087 CNCCCOc1ccccc1SCc2ccccc2 62a_100015186278_100015291786 [0,0,1,0,0,1|1,0,0]=3 392 B21R2.14087 CNCCCOc1ccccc1SCc2ccccn2 62a_100000721315_100015186278 [0,0,1,0,0,1|2,0,0]=4 393 B21R2.14087 CNCCCOc1ccccc1SCc2ccccn2 62a_100015186278_100000721315 [0,0,1,0,0,1|2,0,0]=4 394 B21R2.14087 CNCCCOc1ccccc1SCc2cccnc2 62a_100000741622_100015186278 [0,0,1,0,0,1|2,0,0]=4 395 B21R2.14087 CNCCCOc1ccccc1SCc2cccnc2 62a_100015186278_100000741622 [0,0,1,0,0,1|2,0,0]=4 396 B21R2.14087 CNCCCOc1ccccc1SCc2ccncc2 62a_100015186278_100015193705 [0,0,1,0,0,1|2,0,0]=4 397 B21R2.14087 CNCCCOc1ccccc1SCc2ccncc2 62a_100015193705_100015186278 [0,0,1,0,0,1|2,0,0]=4 398 B21R2.14087 COCCCNc1ccccc1C#Cc2ccccc2 2230a_100000044502_100000740836 [0,0,1,0,0,1|2,0,0]=4 399 B21R2.14087 COCCCNc1ccccc1C#Cc2ccccc2 34a_100000044502_100000740836 [0,0,1,0,0,1|2,0,0]=4 400 B21R2.14087 COCCCNc1ccccc1COc2ccccc2 2230a_100000742786_100000740836 [0,0,1,0,0,1|1,1,0]=4 401 B21R2.14087 COCCCNc1ccccc1COc2ccccc2 34a_100000742786_100000740836 [0,0,1,0,0,1|1,1,0]=4 402 B21R2.14087 COCCCNc1ccccc1COc2ccccc2 7a_100000742786_100000740836 [0,0,1,0,0,1|1,1,0]=4 403 B21R2.14087 COCCCNc1ccccc1OCc2ccccc2 34a_100011193923_100000740836 [0,0,1,0,0,1|1,1,0]=4 404 B21R2.14087 COCCCNc1ccccc1SCc2ccccc2 34a_100000198535_100000740836 [0,0,1,0,0,1|1,0,0]=3 405 B21R2.14087 COCCCNc1ccccc1SCc2ccccc2 7a_100000198535_100000740836 [0,0,1,0,0,1|1,0,0]=3 406 B21R2.14087 N#CCCCNc1ccccc1SCc2ccccc2 7a_100000198535_100000687738 [0,0,1,0,0,1|2,0,0]=4 407 B21R2.14087 O=CCCCNc1ccccc1SCc2ccccc2 7a_100000198535_200011292268 [0,0,1,0,0,1|2,0,0]=4 408 B21R2.14087 OCCCCNc1ccccc1SCc2ccccc2 34a_100000198535_100011216708 [0,0,1,0,0,1|2,0,0]=4 409 B21R2.14087 OCCCCNc1ccccc1SCc2ccccc2 7a_100000198535_100000210776 [0,0,1,0,0,1|2,0,0]=4 410 B21R2.2372 COCCCN(Cc1ccccc1)c2ccccc2C 2230a_100102946366_100000740836 [0,0,1,0,0,1|2,0,0]=4 411 B21R2.2372 COCCCN(Cc1ccccc1)c2ccccc2C 269982a_100102946366_100000740836 [0,0,1,0,0,1|2,0,0]=4 412 B21R2.2372 COCCCN(Cc1ccccc1)c2ccccc2C 34a_100102946366_100000740836 [0,0,1,0,0,1|2,0,0]=4 413 B21R2.2372 COCCCN(Cc1ccccc1)c2ccccc2F 2230a_100025753533_100000740836 [0,0,1,0,0,1|2,0,0]=4 414 B21R2.2372 COCCCN(Cc1ccccc1)c2ccccc2F 269982a_100025753533_100000740836 [0,0,1,0,0,1|2,0,0]=4 415 B21R2.2372 COCCCN(Cc1ccccc1)c2ccccc2F 34a_100025753533_100000740836 [0,0,1,0,0,1|2,0,0]=4 416 B21R2.2433 COCCCN(Cc1ccccc1F)c2ccccc2 2230a_100000224004_100000740836 [0,0,1,0,0,1|2,0,0]=4 417 B21R2.2433 COCCCN(Cc1ccccc1F)c2ccccc2 269982a_100000224004_100000740836 [0,0,1,0,0,1|2,0,0]=4 418 B21R2.2433 COCCCN(Cc1ccccc1F)c2ccccc2 34a_100000224004_100000740836 [0,0,1,0,0,1|2,0,0]=4