0 B20R2.7554664 C#CCCC(=O)Nc1cc(cc2c1nccc2)OC 11a_100000014381_100000692101 [0,0,0,0,0,0|2,0,2]=4 1 B20R2.7554664 C#CCCC(=O)Nc1cc(cc2c1nccc2)OC 1626a_100000014381_100000692101 [0,0,0,0,0,0|2,0,2]=4 2 B20R2.7554664 C#CCCC(=O)Nc1cc(cc2c1nccc2)OC 22a_100000014381_100000692101 [0,0,0,0,0,0|2,0,2]=4 3 B20R2.7554664 C#CCCC(=O)Nc1cc(cc2c1nccc2)OC 527a_100000014381_100000692101 [0,0,0,0,0,0|2,0,2]=4 4 B20R2.7554664 C=CCCC(=O)Nc1cc(cc2c1nccc2)OC 11a_100000014381_100000749702 [0,0,0,0,0,0|2,0,2]=4 5 B20R2.7554664 C=CCCC(=O)Nc1cc(cc2c1nccc2)OC 1626a_100000014381_100000749702 [0,0,0,0,0,0|2,0,2]=4 6 B20R2.7554664 C=CCCC(=O)Nc1cc(cc2c1nccc2)OC 22a_100000014381_100000749702 [0,0,0,0,0,0|2,0,2]=4 7 B20R2.7554664 C=CCCC(=O)Nc1cc(cc2c1nccc2)OC 527a_100000014381_100000749702 [0,0,0,0,0,0|2,0,2]=4 8 B20R2.7554664 CCCCC(=O)Nc1cc(cc2c1nccc2)OC 11a_100000014381_100000210183 [0,0,0,0,0,0|2,0,1]=3 9 B20R2.7554664 CCCCC(=O)Nc1cc(cc2c1nccc2)OC 1626a_100000014381_100000210183 [0,0,0,0,0,0|2,0,1]=3 10 B20R2.7554664 CCCCC(=O)Nc1cc(cc2c1nccc2)OC 22a_100000014381_100000210183 [0,0,0,0,0,0|2,0,1]=3 11 B20R2.7554664 CCCCC(=O)Nc1cc(cc2c1nccc2)OC 527a_100000014381_100000210183 [0,0,0,0,0,0|2,0,1]=3 12 B20R2.7554664 CCCCC(C)Nc1cc(cc2c1cccn2)OC 27a_100000126638_100010248855 [0,0,0,0,0,0|3,0,0]=3 13 B20R2.7554664 CCCCC(C)Nc1cc(cc2c1nccc2)OC 34a_100000014381_200011215066 [0,0,0,0,0,0|1,0,0]=1 14 B20R2.7554664 CCCCC(C)Oc1cc(cc2c1cccc2)OC 34a_200000076035_200011215066 [0,0,0,0,0,0|3,0,0]=3 15 B20R2.7554664 CCCCC(C)Oc1cc(cc2c1cccc2)OC 7a_200000076035_200011215066 [0,0,0,0,0,0|3,0,0]=3 16 B20R2.7554664 CCCCC(C)Sc1cc(cc2c1cccn2)OC 62a_100010248855_200011215066 [0,0,0,0,0,0|4,0,0]=4 17 B20R2.7554664 CCCCC(C)Sc1cc(cc2c1cccn2)OC 62a_200011215066_100010248855 [0,0,0,0,0,0|4,0,0]=4 18 B20R2.7554664 CCCCC(C)Sc1cc(cc2c1nccc2)OC 62a_200011215066_200010235761 [0,0,0,0,0,0|2,0,0]=2 19 B20R2.7554664 CCCNC(=O)Nc1cc(cc2c1nccc2)OC 2430a_100000014381_100020643023 [0,0,0,0,0,0|3,0,1]=4 20 B20R2.7554664 CCCNC(=O)Nc1cc(cc2c1nccc2)OC 512a_100000014381_100020643023 [0,0,0,0,0,0|3,0,1]=4 21 B20R2.7554664 CCOCC(=O)Nc1cc(cc2c1nccc2)OC 11a_100000014381_100000211967 [0,0,0,0,0,0|3,0,1]=4 22 B20R2.7554664 CCOCC(=O)Nc1cc(cc2c1nccc2)OC 1626a_100000014381_100000211967 [0,0,0,0,0,0|3,0,1]=4 23 B20R2.7554664 CCOCC(=O)Nc1cc(cc2c1nccc2)OC 22a_100000014381_100000211967 [0,0,0,0,0,0|3,0,1]=4 24 B20R2.7554664 CCOCC(=O)Nc1cc(cc2c1nccc2)OC 527a_100000014381_100000211967 [0,0,0,0,0,0|3,0,1]=4 25 B20R2.7554664 CCSCC(=O)Nc1cc(cc2c1nccc2)OC 11a_100000014381_100000230394 [0,0,0,0,0,0|3,0,1]=4 26 B20R2.7554664 CCSCC(=O)Nc1cc(cc2c1nccc2)OC 1626a_100000014381_100000230394 [0,0,0,0,0,0|3,0,1]=4 27 B20R2.7554664 CCSCC(=O)Nc1cc(cc2c1nccc2)OC 22a_100000014381_100000230394 [0,0,0,0,0,0|3,0,1]=4 28 B20R2.7554664 CCSCC(=O)Nc1cc(cc2c1nccc2)OC 527a_100000014381_100000230394 [0,0,0,0,0,0|3,0,1]=4 29 B20R2.7554664 COCCC(=O)Nc1cc(cc2c1nccc2)OC 11a_100000014381_100000749529 [0,0,0,0,0,0|3,0,1]=4 30 B20R2.7554664 COCCC(=O)Nc1cc(cc2c1nccc2)OC 1626a_100000014381_100000749529 [0,0,0,0,0,0|3,0,1]=4 31 B20R2.7554664 COCCC(=O)Nc1cc(cc2c1nccc2)OC 22a_100000014381_100000749529 [0,0,0,0,0,0|3,0,1]=4 32 B20R2.7554664 COCCC(=O)Nc1cc(cc2c1nccc2)OC 527a_100000014381_100000749529 [0,0,0,0,0,0|3,0,1]=4 33 B20R2.7554664 COc1cc(c2ncccc2c1)NC(=O)CCC#N 11a_100000014381_100011934036 [0,0,0,0,0,0|1,0,3]=4 34 B20R2.7554664 COc1cc(c2ncccc2c1)NC(=O)CCC#N 1626a_100000014381_100011934036 [0,0,0,0,0,0|1,0,3]=4 35 B20R2.7554664 COc1cc(c2ncccc2c1)NC(=O)CCC#N 22a_100000014381_100011934036 [0,0,0,0,0,0|1,0,3]=4 36 B20R2.7554664 COc1cc(c2ncccc2c1)NC(=O)CCC#N 527a_100000014381_100011934036 [0,0,0,0,0,0|1,0,3]=4 37 B20R2.7554664 COc1cc(c2ncccc2c1)NC(=O)CCSC 11a_100000014381_100000174002 [0,0,0,0,0,0|3,0,1]=4 38 B20R2.7554664 COc1cc(c2ncccc2c1)NC(=O)CCSC 1626a_100000014381_100000174002 [0,0,0,0,0,0|3,0,1]=4 39 B20R2.7554664 COc1cc(c2ncccc2c1)NC(=O)CCSC 22a_100000014381_100000174002 [0,0,0,0,0,0|3,0,1]=4 40 B20R2.7554664 COc1cc(c2ncccc2c1)NC(=O)CCSC 527a_100000014381_100000174002 [0,0,0,0,0,0|3,0,1]=4 41 B20R2.7554664 COc1cc(c2ncccc2c1)NC(=O)NCCF 2430a_100000014381_100000724931 [0,0,0,0,0,0|3,0,1]=4 42 B20R2.7554664 COc1cc(c2ncccc2c1)NC(=O)NCCF 512a_100000014381_100000724931 [0,0,0,0,0,0|3,0,1]=4 43 B20R2.7554664 COc1cc(c2ncccc2c1)NC(=O)NCCO 2430a_100000014381_100000210304 [0,0,0,0,0,0|3,0,1]=4 44 B20R2.7554664 COc1cc(c2ncccc2c1)NC(=O)NCCO 512a_100000014381_100000210304 [0,0,0,0,0,0|3,0,1]=4 45 B19R2.514244 CCCCC(=O)Nc1cc(cc2c1nccc2)O 527a_100000083691_100000210183 [1,0,0,0,0,0|2,0,1]=4 46 B19R2.514244 CCCCC(C)Nc1cc(cc2c1nccc2)Br 27a_100000126638_100010090713 [1,0,0,0,0,0|2,0,0]=3 47 B19R2.514244 CCCCC(C)Nc1cc(cc2c1nccc2)Br 34a_100009814519_200011215066 [1,0,0,0,0,0|2,0,0]=3 48 B19R2.514244 CCCCC(C)Nc1cc(cc2c1nccc2)Cl 34a_100000026717_200011215066 [1,0,0,0,0,0|2,0,0]=3 49 B19R2.514244 CCCCC(C)Nc1cc(cc2c1nccc2)F 27a_100000126638_100010214460 [1,0,0,0,0,0|2,0,0]=3 50 B19R2.514244 CCCCC(C)Nc1cc(cc2c1nccc2)F 34a_100000088212_200011215066 [1,0,0,0,0,0|2,0,0]=3 51 B19R2.514244 CCCCC(C)Nc1cc(cc2c1nccc2)O 34a_100000083691_200011215066 [1,0,0,0,0,0|1,0,0]=2 52 B19R2.514244 CCCCC(C)Nc1cc(cc2c1nccn2)F 27a_100000126638_100011083936 [1,0,0,0,0,0|3,0,0]=4 53 B19R2.514244 CCCCC(C)Nc1cc(nc2c1cccc2)C 27a_100000126638_100000735862 [1,0,0,0,0,0|3,0,0]=4 54 B19R2.514244 CCCCC(C)Nc1nc(cc2c1cccc2)C 27a_100000126638_100000698243 [1,0,0,0,0,0|3,0,0]=4 55 B19R2.514244 CCCCC(C)Nc1nc(cc2c1nccc2)N 27a_100000126638_100010205410 [1,0,0,0,0,0|3,0,0]=4 56 B19R2.514244 CCCCC(C)Oc1cc(cc2c1nccc2)Br 34a_100010248853_200011215066 [1,0,0,0,0,0|3,0,0]=4 57 B19R2.514244 CCCCC(C)Oc1cc(cc2c1nccc2)Br 7a_100010248853_200011215066 [1,0,0,0,0,0|3,0,0]=4 58 B19R2.514244 CCCCC(C)Oc1cc(cc2c1nccc2)C 34a_100009888445_200011215066 [1,0,0,0,0,0|2,0,0]=3 59 B19R2.514244 CCCCC(C)Oc1cc(cc2c1nccc2)C 7a_100009888445_200011215066 [1,0,0,0,0,0|2,0,0]=3 60 B19R2.514244 CCCCC(C)Oc1cc(cc2c1nccc2)Cl 34a_200000089624_200011215066 [1,0,0,0,0,0|3,0,0]=4 61 B19R2.514244 CCCCC(C)Oc1cc(cc2c1nccc2)Cl 7a_200000089624_200011215066 [1,0,0,0,0,0|3,0,0]=4 62 B19R2.1069697 C#CCCCNc1cc(cc2c1nccc2)OC 34a_100000014381_100000695029 [1,0,0,0,0,0|1,0,1]=3 63 B19R2.1069697 C#CCCCSc1cc(cc2c1nccc2)OC 62a_100011215417_200010235761 [1,0,0,0,0,0|2,0,1]=4 64 B19R2.1069697 C=CCCCNc1cc(cc2c1nccc2)OC 34a_100000014381_100000757094 [1,0,0,0,0,0|1,0,1]=3 65 B19R2.1069697 C=CCCCSc1cc(cc2c1nccc2)OC 62a_100011713584_200010235761 [1,0,0,0,0,0|2,0,1]=4 66 B19R2.1069697 C=COCCNc1cc(cc2c1nccc2)OC 34a_100000014381_100000039644 [1,0,0,0,0,0|2,0,1]=4 67 B19R2.1069697 CC/C=C\CNc1cc(cc2c1nccc2)OC 34a_100000014381_100103147603 [1,0,0,0,0,0|1,0,2]=4 68 B19R2.1069697 CCC#CCNc1cc(cc2c1nccc2)OC 34a_100000014381_100009813939 [1,0,0,0,0,0|1,0,2]=4 69 B19R2.1069697 CCCCC=Cc1cc(cc2c1nccc2)OC 271570a_100016275911_200010235761 [1,0,0,0,0,0|2,0,1]=4 70 B19R2.1069697 CCCCCNc1cc(cc2c1cccn2)OC 27a_100000209983_100010248855 [1,0,0,0,0,0|3,0,0]=4 71 B19R2.1069697 CCCCCNc1cc(cc2c1nccc2)OC 34a_100000014381_100000718602 [1,0,0,0,0,0|1,0,0]=2 72 B19R2.1069697 CCCCCOc1cc(cc2c1cccc2)OC 34a_200000076035_100000718602 [1,0,0,0,0,0|3,0,0]=4 73 B19R2.1069697 CCCCCOc1cc(cc2c1cccc2)OC 7a_200000076035_100000210326 [1,0,0,0,0,0|3,0,0]=4 74 B19R2.1069697 CCCCCSc1cc(cc2c1nccc2)OC 62a_100000210326_200010235761 [1,0,0,0,0,0|2,0,0]=3 75 B19R2.1069697 CCOCCNc1cc(cc2c1nccc2)OC 34a_100000014381_100000210147 [1,0,0,0,0,0|2,0,0]=3 76 B19R2.1069697 CCOCCSc1cc(cc2c1nccc2)OC 62a_100000210147_200010235761 [1,0,0,0,0,0|3,0,0]=4 77 B19R2.1069697 CCSCCNc1cc(cc2c1nccc2)OC 34a_100000014381_100000757381 [1,0,0,0,0,0|2,0,0]=3 78 B19R2.1069697 CCSCCSc1cc(cc2c1nccc2)OC 62a_100000757381_200010235761 [1,0,0,0,0,0|3,0,0]=4 79 B19R2.1069697 COCCCNc1cc(cc2c1nccc2)OC 34a_100000014381_100000740836 [1,0,0,0,0,0|2,0,0]=3 80 B19R2.1069697 COCCCSc1cc(cc2c1nccc2)OC 62a_100000709357_200010235761 [1,0,0,0,0,0|3,0,0]=4 81 B19R2.1069697 COc1cc(c2ccccc2c1)OCCCCF 34a_200000076035_100000729493 [1,0,0,0,0,0|3,0,0]=4 82 B19R2.1069697 COc1cc(c2ccccc2c1)OCCCCF 7a_200000076035_100000729493 [1,0,0,0,0,0|3,0,0]=4 83 B19R2.1069697 COc1cc(c2ccccc2c1)OCCCCO 34a_200000076035_100011216708 [1,0,0,0,0,0|3,0,0]=4 84 B19R2.1069697 COc1cc(c2ccccc2c1)OCCCCO 7a_200000076035_100000210776 [1,0,0,0,0,0|3,0,0]=4 85 B19R2.1069697 COc1cc(c2ccccc2c1)SCCCCF 62a_100000729493_100010152498 [1,0,0,0,0,0|3,0,0]=4 86 B19R2.1069697 COc1cc(c2ccccc2c1)SCCCCO 62a_100000210776_100010152498 [1,0,0,0,0,0|3,0,0]=4 87 B19R2.1069697 COc1cc(c2cccnc2c1)NCCCCO 27a_100000750430_100010248855 [1,0,0,0,0,0|3,0,0]=4 88 B19R2.1069697 COc1cc(c2ncccc2c1)NCC#CCO 34a_100000014381_200000047223 [1,0,0,0,0,0|1,0,2]=4 89 B19R2.1069697 COc1cc(c2ncccc2c1)NCCCCF 34a_100000014381_100000729493 [1,0,0,0,0,0|1,0,0]=2 90 B19R2.1069697 COc1cc(c2ncccc2c1)NCCCCO 34a_100000014381_100011216708 [1,0,0,0,0,0|1,0,0]=2 91 B19R2.1069697 COc1cc(c2ncccc2c1)SCCCC#N 62a_100000687738_200010235761 [1,0,0,0,0,0|1,0,2]=4 92 B19R2.1069697 COc1cc(c2ncccc2c1)SCCCC=O 62a_200011292268_200010235761 [1,0,0,0,0,0|2,0,1]=4 93 B19R2.1069697 COc1cc(c2ncccc2c1)SCCCCF 62a_100000729493_200010235761 [1,0,0,0,0,0|2,0,0]=3 94 B19R2.1069697 COc1cc(c2ncccc2c1)SCCCCO 62a_100000210776_200010235761 [1,0,0,0,0,0|2,0,0]=3 95 B19R2.1707326 CCCC(=O)Nc1cc(cc2c1nccc2)OC 11a_100000014381_100000211992 [1,0,0,0,0,0|1,0,1]=3 96 B19R2.1707326 CCCC(=O)Nc1cc(cc2c1nccc2)OC 1626a_100000014381_100000211992 [1,0,0,0,0,0|1,0,1]=3 97 B19R2.1707326 CCCC(=O)Nc1cc(cc2c1nccc2)OC 22a_100000014381_100000211992 [1,0,0,0,0,0|1,0,1]=3 98 B19R2.1707326 CCCC(=O)Nc1cc(cc2c1nccc2)OC 527a_100000014381_100000211992 [1,0,0,0,0,0|1,0,1]=3 99 B19R2.1707326 CCCC(C)Nc1cc(cc2c1cccn2)OC 27a_100000741246_100010248855 [1,0,0,0,0,0|2,0,0]=3 100 B19R2.1707326 CCCC(C)Nc1cc(cc2c1nccc2)OC 34a_100000014381_100000766640 [1,0,0,0,0,0|0,0,0]=1 101 B19R2.1707326 CCCC(C)Oc1cc(cc2c1cccc2)OC 34a_200000076035_100000766640 [1,0,0,0,0,0|2,0,0]=3 102 B19R2.1707326 CCCC(C)Oc1cc(cc2c1cccc2)OC 7a_200000076035_100000766640 [1,0,0,0,0,0|2,0,0]=3 103 B19R2.1707326 CCCC(C)Sc1cc(cc2c1cccn2)OC 62a_100000766640_100010248855 [1,0,0,0,0,0|3,0,0]=4 104 B19R2.1707326 CCCC(C)Sc1cc(cc2c1cccn2)OC 62a_100010248855_100000766640 [1,0,0,0,0,0|3,0,0]=4 105 B19R2.1707326 CCCC(C)Sc1cc(cc2c1nccc2)OC 62a_100000766640_200010235761 [1,0,0,0,0,0|1,0,0]=2 106 B19R2.1707326 CCNC(=O)Nc1cc(cc2c1nccc2)OC 2430a_100000014381_100015525214 [1,0,0,0,0,0|2,0,1]=4 107 B19R2.1707326 CCNC(=O)Nc1cc(cc2c1nccc2)OC 512a_100000014381_100015525214 [1,0,0,0,0,0|2,0,1]=4 108 B19R2.1707326 COCC(=O)Nc1cc(cc2c1nccc2)OC 11a_100000014381_100000210968 [1,0,0,0,0,0|2,0,1]=4 109 B19R2.1707326 COCC(=O)Nc1cc(cc2c1nccc2)OC 1626a_100000014381_100000210968 [1,0,0,0,0,0|2,0,1]=4 110 B19R2.1707326 COCC(=O)Nc1cc(cc2c1nccc2)OC 22a_100000014381_100000210968 [1,0,0,0,0,0|2,0,1]=4 111 B19R2.1707326 COCC(=O)Nc1cc(cc2c1nccc2)OC 527a_100000014381_100000210968 [1,0,0,0,0,0|2,0,1]=4 112 B19R2.1707326 COCC(C)Nc1cc(cc2c1nccc2)OC 34a_100000014381_100000765312 [1,0,0,0,0,0|1,0,0]=2 113 B19R2.1707326 COCC(C)Oc1cc(cc2c1cccc2)OC 34a_200000076035_100000765312 [1,0,0,0,0,0|3,0,0]=4 114 B19R2.1707326 COCC(C)Oc1cc(cc2c1cccc2)OC 7a_200000076035_100000765312 [1,0,0,0,0,0|3,0,0]=4 115 B19R2.1707326 COCC(C)Sc1cc(cc2c1cccc2)OC 62a_100000765312_100010152498 [1,0,0,0,0,0|3,0,0]=4 116 B19R2.1707326 COCC(C)Sc1cc(cc2c1nccc2)OC 62a_100000765312_200010235761 [1,0,0,0,0,0|2,0,0]=3 117 B19R2.1707326 COC[C@@H](C)Nc1cc(cc2c1cccn2)OC 27a_100000764878_100010248855 [1,0,0,0,0,0|3,0,0]=4 118 B19R2.1707326 COc1cc(c2ccccc2c1)OC(C)CCO 34a_200000076035_100009893172 [1,0,0,0,0,0|3,0,0]=4 119 B19R2.1707326 COc1cc(c2ccccc2c1)OC(C)CCO 7a_200000076035_100009893172 [1,0,0,0,0,0|3,0,0]=4 120 B19R2.1707326 COc1cc(c2ccccc2c1)SC(C)CCO 62a_100009893172_100010152498 [1,0,0,0,0,0|3,0,0]=4 121 B19R2.1707326 COc1cc(c2cccnc2c1)N[C@H](C)CCO 27a_100000706166_100010248855 [1,0,0,0,0,0|3,0,0]=4 122 B19R2.1707326 COc1cc(c2ncccc2c1)NC(=O)CCO 22a_100000014381_100011216618 [1,0,0,0,0,0|2,0,1]=4 123 B19R2.1707326 COc1cc(c2ncccc2c1)NC(=O)CSC 11a_100000014381_100000184570 [1,0,0,0,0,0|2,0,1]=4 124 B19R2.1707326 COc1cc(c2ncccc2c1)NC(=O)CSC 1626a_100000014381_100000184570 [1,0,0,0,0,0|2,0,1]=4 125 B19R2.1707326 COc1cc(c2ncccc2c1)NC(=O)CSC 22a_100000014381_100000184570 [1,0,0,0,0,0|2,0,1]=4 126 B19R2.1707326 COc1cc(c2ncccc2c1)NC(=O)CSC 527a_100000014381_100000184570 [1,0,0,0,0,0|2,0,1]=4 127 B19R2.1707326 COc1cc(c2ncccc2c1)NC(C)CCO 34a_100000014381_100009893172 [1,0,0,0,0,0|1,0,0]=2 128 B19R2.1707326 COc1cc(c2ncccc2c1)SC(C)CC#N 62a_100009813641_200010235761 [1,0,0,0,0,0|1,0,2]=4 129 B19R2.1707326 COc1cc(c2ncccc2c1)SC(C)CCO 62a_100009893172_200010235761 [1,0,0,0,0,0|2,0,0]=3 130 B21R3.1031 COc1cc(c2ccccc2c1)OC3CCCCC3 34a_200000076035_100000210327 [0,0,0,1,0,0|3,0,0]=4 131 B21R3.1031 COc1cc(c2ccccc2c1)OC3CCCCC3 7a_200000076035_100000210327 [0,0,0,1,0,0|3,0,0]=4 132 B21R3.1031 COc1cc(c2ccccc2c1)OC3CCCOC3 34a_200000076035_100000693364 [0,0,0,1,0,0|3,0,0]=4 133 B21R3.1031 COc1cc(c2ccccc2c1)OC3CCCOC3 7a_200000076035_100000693364 [0,0,0,1,0,0|3,0,0]=4 134 B21R3.1031 COc1cc(c2cccnc2c1)NC3CCCCC3 27a_100000182618_100010248855 [0,0,0,1,0,0|3,0,0]=4 135 B21R3.1031 COc1cc(c2cccnc2c1)NC3CCCOC3 27a_100000719290_100010248855 [0,0,0,1,0,0|3,0,0]=4 136 B21R3.1031 COc1cc(c2ncccc2c1)NC3CCCCC3 34a_100000014381_100000210327 [0,0,0,1,0,0|1,0,0]=2 137 B21R3.1031 COc1cc(c2ncccc2c1)NC3CCCOC3 34a_100000014381_100000693364 [0,0,0,1,0,0|1,0,0]=2 138 B21R3.1031 COc1cc(c2ncccc2c1)NC3CCSCC3 34a_100000014381_100000069128 [0,0,0,1,0,0|2,0,0]=3 139 B21R3.1031 COc1cc(c2ncccc2c1)SC3C=CCCC3 62a_100000751183_200010235761 [0,0,0,1,0,0|2,0,1]=4 140 B21R3.1031 COc1cc(c2ncccc2c1)SC3CCCCC3 62a_100000210327_200010235761 [0,0,0,1,0,0|2,0,0]=3 141 B21R3.35834 COc1cc(c2cccnc2c1)N3CCCCC3C 27a_100000211376_100010248855 [0,0,0,1,0,0|3,0,0]=4 142 B21R3.752183 COc1cc(c2cccnc2c1)NC(C)C3CCC3 27a_100016994624_100010248855 [0,0,0,1,0,0|3,0,0]=4 143 B21R3.752183 COc1cc(c2ncccc2c1)NC(=O)C3CCC3 11a_100000014381_100000209988 [0,0,0,1,0,0|2,0,1]=4 144 B21R3.752183 COc1cc(c2ncccc2c1)NC(=O)C3CCC3 1626a_100000014381_100000209988 [0,0,0,1,0,0|2,0,1]=4 145 B21R3.752183 COc1cc(c2ncccc2c1)NC(=O)C3CCC3 22a_100000014381_100000209988 [0,0,0,1,0,0|2,0,1]=4 146 B21R3.752183 COc1cc(c2ncccc2c1)NC(=O)C3CCC3 527a_100000014381_100000209988 [0,0,0,1,0,0|2,0,1]=4 147 B21R3.752183 COc1cc(c2ncccc2c1)NC(=O)C3CCO3 11a_100000014381_100000089072 [0,0,0,1,0,0|2,0,1]=4 148 B21R3.752183 COc1cc(c2ncccc2c1)NC(=O)C3CCO3 1626a_100000014381_100000089072 [0,0,0,1,0,0|2,0,1]=4 149 B21R3.752183 COc1cc(c2ncccc2c1)NC(=O)C3CCO3 22a_100000014381_100000089072 [0,0,0,1,0,0|2,0,1]=4 150 B21R3.752183 COc1cc(c2ncccc2c1)NC(=O)C3CCO3 527a_100000014381_100000089072 [0,0,0,1,0,0|2,0,1]=4 151 B21R3.752184 COc1cc(c2ncccc2c1)NC(=O)CC3CC3 11a_100000014381_100000738066 [0,0,0,1,0,0|2,0,1]=4 152 B21R3.752184 COc1cc(c2ncccc2c1)NC(=O)CC3CC3 1626a_100000014381_100000738066 [0,0,0,1,0,0|2,0,1]=4 153 B21R3.752184 COc1cc(c2ncccc2c1)NC(=O)CC3CC3 22a_100000014381_100000738066 [0,0,0,1,0,0|2,0,1]=4 154 B21R3.752184 COc1cc(c2ncccc2c1)NC(=O)CC3CC3 527a_100000014381_100000738066 [0,0,0,1,0,0|2,0,1]=4 155 B21R3.752197 COc1cc(c2ccccc2c1)SC3CC(C3)CO 62a_100009874164_100010152498 [0,0,0,1,0,0|3,0,0]=4 156 B21R3.752197 COc1cc(c2cccnc2c1)NC3CC(C3)CO 27a_100000095622_100010248855 [0,0,0,1,0,0|3,0,0]=4 157 B21R3.752197 COc1cc(c2ncccc2c1)SC3CC(C3)CO 62a_100009874164_200010235761 [0,0,0,1,0,0|2,0,0]=3 158 B21R3.752225 COc1cc(c2cccnc2c1)N[C@H]3CC[C@H](C3)O 27a_100015195300_100010248855 [0,0,0,1,0,0|3,0,0]=4 159 B21R3.10578484 COc1cc(c2cccnc2c1)N3C(CCC3C)C 27a_100000687148_100010248855 [0,0,0,1,0,0|3,0,0]=4 160 B21R3.10578521 COc1cc(c2ncccc2c1)NC(=O)C3CC3C 11a_100000014381_100000211227 [0,0,0,1,0,0|2,0,1]=4 161 B21R3.10578521 COc1cc(c2ncccc2c1)NC(=O)C3CC3C 1626a_100000014381_100000211227 [0,0,0,1,0,0|2,0,1]=4 162 B21R3.10578521 COc1cc(c2ncccc2c1)NC(=O)C3CC3C 22a_100000014381_100000211227 [0,0,0,1,0,0|2,0,1]=4 163 B21R3.10578521 COc1cc(c2ncccc2c1)NC(=O)C3CC3C 527a_100000014381_100000211227 [0,0,0,1,0,0|2,0,1]=4 164 B21R3.10578521 COc1cc(c2ncccc2c1)NC(=O)[C@@H]3C[C@@H]3F 11a_100000014381_100015396687 [0,0,0,1,0,0|2,0,1]=4 165 B21R3.10578521 COc1cc(c2ncccc2c1)NC(=O)[C@@H]3C[C@@H]3F 22a_100000014381_100015396687 [0,0,0,1,0,0|2,0,1]=4 166 B21R3.10578521 COc1cc(c2ncccc2c1)NC(=O)[C@@H]3C[C@@H]3F 527a_100000014381_100015396687 [0,0,0,1,0,0|2,0,1]=4 167 B19R2.4580418 CCCCC(C)Sc1cc(cc2c1cc[nH]2)OC 62a_200011215066_100010006585 [0,0,0,0,1,0|3,0,0]=4 168 B19R2.4580418 CCCCC(C)Sc1cc(cc2c1nc[nH]2)OC 62a_200011215066_100102526192 [0,0,0,0,1,0|3,0,0]=4 169 B18R2.75342 C#CCCCNc1cc(cc2c1nccc2)O 34a_100000083691_100000695029 [2,0,0,0,0,0|1,0,1]=4 170 B18R2.75342 C=CCCCNc1cc(cc2c1nccc2)O 34a_100000083691_100000757094 [2,0,0,0,0,0|1,0,1]=4 171 B18R2.75342 CCCCCNc1cc(cc2c1nccc2)Br 27a_100000209983_100010090713 [2,0,0,0,0,0|2,0,0]=4 172 B18R2.75342 CCCCCNc1cc(cc2c1nccc2)Br 34a_100009814519_100000718602 [2,0,0,0,0,0|2,0,0]=4 173 B18R2.75342 CCCCCNc1cc(cc2c1nccc2)Cl 34a_100000026717_100000718602 [2,0,0,0,0,0|2,0,0]=4 174 B18R2.75342 CCCCCNc1cc(cc2c1nccc2)F 27a_100000209983_100010214460 [2,0,0,0,0,0|2,0,0]=4 175 B18R2.75342 CCCCCNc1cc(cc2c1nccc2)F 34a_100000088212_100000718602 [2,0,0,0,0,0|2,0,0]=4 176 B18R2.75342 CCCCCNc1cc(cc2c1nccc2)O 34a_100000083691_100000718602 [2,0,0,0,0,0|1,0,0]=3 177 B18R2.75342 CCCCCOc1cc(cc2c1nccc2)C 34a_100009888445_100000718602 [2,0,0,0,0,0|2,0,0]=4 178 B18R2.75342 CCCCCOc1cc(cc2c1nccc2)C 7a_100009888445_100000210326 [2,0,0,0,0,0|2,0,0]=4 179 B18R2.75342 CCCCCSc1cc(cc2c1nccc2)C 62a_100000210326_100010113427 [2,0,0,0,0,0|2,0,0]=4 180 B18R2.75342 CCOCCNc1cc(cc2c1nccc2)O 34a_100000083691_100000210147 [2,0,0,0,0,0|2,0,0]=4 181 B18R2.75342 CCSCCNc1cc(cc2c1nccc2)O 34a_100000083691_100000757381 [2,0,0,0,0,0|2,0,0]=4 182 B18R2.75342 COCCCNc1cc(cc2c1nccc2)O 34a_100000083691_100000740836 [2,0,0,0,0,0|2,0,0]=4 183 B18R2.75342 Cc1cc(c2ncccc2c1)OCCCCF 34a_100009888445_100000729493 [2,0,0,0,0,0|2,0,0]=4 184 B18R2.75342 Cc1cc(c2ncccc2c1)OCCCCF 7a_100009888445_100000729493 [2,0,0,0,0,0|2,0,0]=4 185 B18R2.75342 Cc1cc(c2ncccc2c1)OCCCCO 34a_100009888445_100011216708 [2,0,0,0,0,0|2,0,0]=4 186 B18R2.75342 Cc1cc(c2ncccc2c1)OCCCCO 7a_100009888445_100000210776 [2,0,0,0,0,0|2,0,0]=4 187 B18R2.75342 Cc1cc(c2ncccc2c1)SCCCCF 62a_100000729493_100010113427 [2,0,0,0,0,0|2,0,0]=4 188 B18R2.75342 Cc1cc(c2ncccc2c1)SCCCCO 62a_100000210776_100010113427 [2,0,0,0,0,0|2,0,0]=4 189 B18R2.75342 FCCCCNc1cc(cc2c1nccc2)Br 34a_100009814519_100000729493 [2,0,0,0,0,0|2,0,0]=4 190 B18R2.75342 FCCCCNc1cc(cc2c1nccc2)Cl 34a_100000026717_100000729493 [2,0,0,0,0,0|2,0,0]=4 191 B18R2.75342 FCCCCNc1cc(cc2c1nccc2)F 34a_100000088212_100000729493 [2,0,0,0,0,0|2,0,0]=4 192 B18R2.75342 OCCCCNc1cc(cc2c1nccc2)Br 27a_100000750430_100010090713 [2,0,0,0,0,0|2,0,0]=4 193 B18R2.75342 OCCCCNc1cc(cc2c1nccc2)Br 34a_100009814519_100011216708 [2,0,0,0,0,0|2,0,0]=4 194 B18R2.75342 OCCCCNc1cc(cc2c1nccc2)Cl 34a_100000026717_100011216708 [2,0,0,0,0,0|2,0,0]=4 195 B18R2.75342 OCCCCNc1cc(cc2c1nccc2)F 27a_100000750430_100010214460 [2,0,0,0,0,0|2,0,0]=4 196 B18R2.75342 OCCCCNc1cc(cc2c1nccc2)F 34a_100000088212_100011216708 [2,0,0,0,0,0|2,0,0]=4 197 B18R2.75342 OCCCCNc1cc(cc2c1nccc2)O 34a_100000083691_100011216708 [2,0,0,0,0,0|1,0,0]=3 198 B18R2.75342 Oc1cc(c2ncccc2c1)NCCCCF 34a_100000083691_100000729493 [2,0,0,0,0,0|1,0,0]=3 199 B18R2.124786 CC(CCO)Nc1cc(cc2c1nccc2)Br 34a_100009814519_100009893172 [2,0,0,0,0,0|2,0,0]=4 200 B18R2.124786 CC(CCO)Nc1cc(cc2c1nccc2)Cl 34a_100000026717_100009893172 [2,0,0,0,0,0|2,0,0]=4 201 B18R2.124786 CC(CCO)Nc1cc(cc2c1nccc2)F 34a_100000088212_100009893172 [2,0,0,0,0,0|2,0,0]=4 202 B18R2.124786 CC(CCO)Nc1cc(cc2c1nccc2)O 34a_100000083691_100009893172 [2,0,0,0,0,0|1,0,0]=3 203 B18R2.124786 CCCC(=O)Nc1cc(cc2c1nccc2)O 527a_100000083691_100000211992 [2,0,0,0,0,0|1,0,1]=4 204 B18R2.124786 CCCC(C)Nc1cc(cc2c1nccc2)Br 27a_100000741246_100010090713 [2,0,0,0,0,0|1,0,0]=3 205 B18R2.124786 CCCC(C)Nc1cc(cc2c1nccc2)Br 34a_100009814519_100000766640 [2,0,0,0,0,0|1,0,0]=3 206 B18R2.124786 CCCC(C)Nc1cc(cc2c1nccc2)Cl 34a_100000026717_100000766640 [2,0,0,0,0,0|1,0,0]=3 207 B18R2.124786 CCCC(C)Nc1cc(cc2c1nccc2)F 27a_100000741246_100010214460 [2,0,0,0,0,0|1,0,0]=3 208 B18R2.124786 CCCC(C)Nc1cc(cc2c1nccc2)F 34a_100000088212_100000766640 [2,0,0,0,0,0|1,0,0]=3 209 B18R2.124786 CCCC(C)Nc1cc(cc2c1nccc2)O 34a_100000083691_100000766640 [2,0,0,0,0,0|0,0,0]=2 210 B18R2.124786 CCCC(C)Nc1cc(cc2c1nccn2)F 27a_100000741246_100011083936 [2,0,0,0,0,0|2,0,0]=4 211 B18R2.124786 CCCC(C)Nc1cc(nc2c1cccc2)C 27a_100000741246_100000735862 [2,0,0,0,0,0|2,0,0]=4 212 B18R2.124786 CCCC(C)Nc1nc(cc2c1cccc2)C 27a_100000741246_100000698243 [2,0,0,0,0,0|2,0,0]=4 213 B18R2.124786 CCCC(C)Nc1nc(cc2c1nccc2)N 27a_100000741246_100010205410 [2,0,0,0,0,0|2,0,0]=4 214 B18R2.124786 CCCC(C)Oc1cc(cc2c1nccc2)Br 34a_100010248853_100000766640 [2,0,0,0,0,0|2,0,0]=4 215 B18R2.124786 CCCC(C)Oc1cc(cc2c1nccc2)Br 7a_100010248853_100000766640 [2,0,0,0,0,0|2,0,0]=4 216 B18R2.124786 CCCC(C)Oc1cc(cc2c1nccc2)C 34a_100009888445_100000766640 [2,0,0,0,0,0|1,0,0]=3 217 B18R2.124786 CCCC(C)Oc1cc(cc2c1nccc2)C 7a_100009888445_100000766640 [2,0,0,0,0,0|1,0,0]=3 218 B18R2.124786 CCCC(C)Oc1cc(cc2c1nccc2)Cl 34a_200000089624_100000766640 [2,0,0,0,0,0|2,0,0]=4 219 B18R2.124786 CCCC(C)Oc1cc(cc2c1nccc2)Cl 7a_200000089624_100000766640 [2,0,0,0,0,0|2,0,0]=4 220 B18R2.124786 CCCC(C)Sc1cc(cc2c1cccc2)O 62a_100000766640_100010001680 [2,0,0,0,0,0|2,0,0]=4 221 B18R2.124786 CCCC(C)Sc1cc(cc2c1nccc2)C 62a_100000766640_100010113427 [2,0,0,0,0,0|1,0,0]=3 222 B18R2.124786 CCCC(C)Sc1cc(cc2c1nccc2)F 62a_100000766640_100010214460 [2,0,0,0,0,0|2,0,0]=4 223 B18R2.124786 CCCC(C)Sc1cc(cc2c1nccc2)F 62a_100010214460_100000766640 [2,0,0,0,0,0|2,0,0]=4 224 B18R2.124786 COCC(C)Nc1cc(cc2c1nccc2)Br 34a_100009814519_100000765312 [2,0,0,0,0,0|2,0,0]=4 225 B18R2.124786 COCC(C)Nc1cc(cc2c1nccc2)Cl 34a_100000026717_100000765312 [2,0,0,0,0,0|2,0,0]=4 226 B18R2.124786 COCC(C)Nc1cc(cc2c1nccc2)F 34a_100000088212_100000765312 [2,0,0,0,0,0|2,0,0]=4 227 B18R2.124786 COCC(C)Nc1cc(cc2c1nccc2)O 34a_100000083691_100000765312 [2,0,0,0,0,0|1,0,0]=3 228 B18R2.124786 COCC(C)Oc1cc(cc2c1nccc2)C 34a_100009888445_100000765312 [2,0,0,0,0,0|2,0,0]=4 229 B18R2.124786 COCC(C)Oc1cc(cc2c1nccc2)C 7a_100009888445_100000765312 [2,0,0,0,0,0|2,0,0]=4 230 B18R2.124786 COCC(C)Sc1cc(cc2c1nccc2)C 62a_100000765312_100010113427 [2,0,0,0,0,0|2,0,0]=4 231 B18R2.124786 COC[C@@H](C)Nc1cc(cc2c1nccc2)Br 27a_100000764878_100010090713 [2,0,0,0,0,0|2,0,0]=4 232 B18R2.124786 COC[C@@H](C)Nc1cc(cc2c1nccc2)F 27a_100000764878_100010214460 [2,0,0,0,0,0|2,0,0]=4 233 B18R2.124786 C[C@H](CCO)Nc1cc(cc2c1nccc2)Br 27a_100000706166_100010090713 [2,0,0,0,0,0|2,0,0]=4 234 B18R2.124786 C[C@H](CCO)Nc1cc(cc2c1nccc2)F 27a_100000706166_100010214460 [2,0,0,0,0,0|2,0,0]=4 235 B18R2.124786 Cc1cc(c2ncccc2c1)OC(C)CCO 34a_100009888445_100009893172 [2,0,0,0,0,0|2,0,0]=4 236 B18R2.124786 Cc1cc(c2ncccc2c1)OC(C)CCO 7a_100009888445_100009893172 [2,0,0,0,0,0|2,0,0]=4 237 B18R2.124786 Cc1cc(c2ncccc2c1)SC(C)CCO 62a_100009893172_100010113427 [2,0,0,0,0,0|2,0,0]=4 238 B18R2.883208 CCCCC(C)Nc1cccc2c1cccc2 34a_100000185869_200011215066 [2,0,0,0,0,0|2,0,0]=4 239 B18R2.883208 CCCCC(C)Nc1cccc2c1nccc2 34a_100000181377_200011215066 [2,0,0,0,0,0|1,0,0]=3 240 B18R2.883208 CCCCC(C)Nc1cccc2c1nccn2 27a_100000126638_100010003881 [2,0,0,0,0,0|2,0,0]=4 241 B18R2.883208 CCCCC(C)Nc1cccc2c1ncnc2 27a_100000126638_100010246313 [2,0,0,0,0,0|2,0,0]=4 242 B18R2.883208 CCCCC(C)Nc1nccc2c1nccc2 27a_100000126638_100010063729 [2,0,0,0,0,0|2,0,0]=4 243 B18R2.883208 CCCCC(C)Oc1cccc2c1nccc2 34a_100000056035_200011215066 [2,0,0,0,0,0|2,0,0]=4 244 B18R2.883208 CCCCC(C)Sc1cccc2c1nccc2 62a_200011215066_100011215545 [2,0,0,0,0,0|2,0,0]=4 245 B18R2.179959 C#CCCNc1cc(cc2c1nccc2)OC 34a_100000014381_100000688953 [2,0,0,0,0,0|0,0,2]=4 246 B18R2.179959 C/C=C/CNc1cc(cc2c1nccc2)OC 34a_100000014381_100102629194 [2,0,0,0,0,0|0,0,2]=4 247 B18R2.179959 C=CCCNc1cc(cc2c1nccc2)OC 34a_100000014381_100000754431 [2,0,0,0,0,0|0,0,2]=4 248 B18R2.179959 CC#CCNc1cc(cc2c1nccc2)OC 34a_100000014381_100000748600 [2,0,0,0,0,0|0,0,2]=4 249 B18R2.179959 CC=CCNc1cc(cc2c1nccc2)OC 34a_100000014381_100000070051 [2,0,0,0,0,0|0,0,2]=4 250 B18R2.179959 CCCC=Cc1cc(cc2c1nccc2)OC 271570a_100016258520_200010235761 [2,0,0,0,0,0|1,0,1]=4 251 B18R2.179959 CCCCNc1cc(cc2c1cccn2)OC 27a_100000102301_100010248855 [2,0,0,0,0,0|2,0,0]=4 252 B18R2.179959 CCCCNc1cc(cc2c1nccc2)OC 34a_100000014381_100000210210 [2,0,0,0,0,0|0,0,0]=2 253 B18R2.179959 CCCCOc1cc(cc2c1cccc2)OC 34a_200000076035_100000210210 [2,0,0,0,0,0|2,0,0]=4 254 B18R2.179959 CCCCOc1cc(cc2c1cccc2)OC 7a_200000076035_100000210211 [2,0,0,0,0,0|2,0,0]=4 255 B18R2.179959 CCCCSc1cc(cc2c1cccc2)OC 62a_100000210211_100010152498 [2,0,0,0,0,0|2,0,0]=4 256 B18R2.179959 CCCCSc1cc(cc2c1nccc2)OC 62a_100000210211_200010235761 [2,0,0,0,0,0|1,0,0]=3 257 B18R2.179959 CCOCSc1cc(cc2c1nccc2)OC 62a_100000739092_200010235761 [2,0,0,0,0,0|2,0,0]=4 258 B18R2.179959 COCCNc1cc(cc2c1nccc2)OC 34a_100000014381_100011201679 [2,0,0,0,0,0|1,0,0]=3 259 B18R2.179959 COCCSc1cc(cc2c1nccc2)OC 62a_100000233755_200010235761 [2,0,0,0,0,0|2,0,0]=4 260 B18R2.179959 COc1cc(c2ncccc2c1)NCCCF 34a_100000014381_100011934791 [2,0,0,0,0,0|1,0,0]=3 261 B18R2.179959 COc1cc(c2ncccc2c1)NCCCO 34a_100000014381_100000230001 [2,0,0,0,0,0|1,0,0]=3 262 B18R2.179959 COc1cc(c2ncccc2c1)NCCSC 34a_100000014381_100000212216 [2,0,0,0,0,0|1,0,0]=3 263 B18R2.179959 COc1cc(c2ncccc2c1)SCCCF 62a_100011934791_200010235761 [2,0,0,0,0,0|2,0,0]=4 264 B18R2.179959 COc1cc(c2ncccc2c1)SCCCO 62a_100011215043_200010235761 [2,0,0,0,0,0|2,0,0]=4 265 B18R2.179959 COc1cc(c2ncccc2c1)SCCSC 62a_100000212216_200010235761 [2,0,0,0,0,0|2,0,0]=4 266 B18R2.744 C#CC(C)Nc1cc(cc2c1nccc2)OC 34a_100000014381_200000035995 [2,0,0,0,0,0|0,0,2]=4 267 B18R2.744 CCC(=O)Nc1cc(cc2c1nccc2)OC 11a_100000014381_100000210414 [2,0,0,0,0,0|1,0,1]=4 268 B18R2.744 CCC(=O)Nc1cc(cc2c1nccc2)OC 1626a_100000014381_100000210414 [2,0,0,0,0,0|1,0,1]=4 269 B18R2.744 CCC(=O)Nc1cc(cc2c1nccc2)OC 22a_100000014381_100000210414 [2,0,0,0,0,0|1,0,1]=4 270 B18R2.744 CCC(=O)Nc1cc(cc2c1nccc2)OC 527a_100000014381_100000210414 [2,0,0,0,0,0|1,0,1]=4 271 B18R2.744 CCC(C)Nc1cc(cc2c1nccc2)OC 34a_100000014381_100011215416 [2,0,0,0,0,0|0,0,0]=2 272 B18R2.744 CCC(C)Oc1cc(cc2c1cccc2)OC 34a_200000076035_100011215416 [2,0,0,0,0,0|2,0,0]=4 273 B18R2.744 CCC(C)Oc1cc(cc2c1cccc2)OC 7a_200000076035_100000758301 [2,0,0,0,0,0|2,0,0]=4 274 B18R2.744 CCC(C)Sc1cc(cc2c1cccc2)OC 62a_100000758301_100010152498 [2,0,0,0,0,0|2,0,0]=4 275 B18R2.744 CCC(C)Sc1cc(cc2c1nccc2)OC 62a_100000758301_200010235761 [2,0,0,0,0,0|1,0,0]=3 276 B18R2.744 COc1cc(c2ncccc2c1)NC(C)CO 34a_100000014381_100012180447 [2,0,0,0,0,0|1,0,0]=3 277 B18R2.744 COc1cc(c2ncccc2c1)SC(C)CO 62a_100012180447_200010235761 [2,0,0,0,0,0|2,0,0]=4 278 B18R2.744 COc1cc(c2ncccc2c1)SC(C)OC 62a_100009879195_200010235761 [2,0,0,0,0,0|2,0,0]=4 279 B18R2.744 COc1cc(c2ncccc2c1)S[C@H](C)CO 62a_100016084084_200010235761 [2,0,0,0,0,0|2,0,0]=4 280 B20R2.8544 CC(C)CCC(C)Nc1cc(cc2c1nccc2)F 27a_100138410893_100010214460 [1,1,0,0,0,0|2,0,0]=4 281 B20R2.8544 CC(C)CCC(C)Nc1cc(cc2c1nccc2)F 34a_100000088212_100011261404 [1,1,0,0,0,0|2,0,0]=4 282 B20R2.8544 CC(C)CCC(C)Nc1cc(cc2c1nccc2)O 34a_100000083691_100011261404 [1,1,0,0,0,0|1,0,0]=3 283 B20R2.8544 Cc1cc(c2ncccc2c1)OC(C)CCC(C)C 34a_100009888445_100011261404 [1,1,0,0,0,0|2,0,0]=4 284 B20R2.828869 CCCCC(CC)Nc1cc(cc2c1nccc2)F 34a_100000088212_200011216223 [1,1,0,0,0,0|2,0,0]=4 285 B20R2.828869 CCCCC(CC)Nc1cc(cc2c1nccc2)O 34a_100000083691_200011216223 [1,1,0,0,0,0|1,0,0]=3 286 B20R2.828869 CCCCC(CC)Oc1cc(cc2c1nccc2)C 34a_100009888445_200011216223 [1,1,0,0,0,0|2,0,0]=4 287 B20R2.828869 CCCCC(CC)Oc1cc(cc2c1nccc2)C 7a_100009888445_200011216223 [1,1,0,0,0,0|2,0,0]=4 288 B20R2.828869 CCCC[C@@H](CO)Nc1cc(cc2c1nccc2)Br 27a_100011934283_100010090713 [1,1,0,0,0,0|2,0,0]=4 289 B20R2.828869 CCCC[C@@H](CO)Nc1cc(cc2c1nccc2)F 27a_100011934283_100010214460 [1,1,0,0,0,0|2,0,0]=4 290 B20R2.1364642 CCC(C)CC(C)Nc1cc(cc2c1nccc2)F 27a_100000763565_100010214460 [1,1,0,0,0,0|2,0,0]=4 291 B20R2.2719388 CCCCCC(C)Nc1cc(cc2c1nccc2)F 27a_100000211957_100010214460 [1,1,0,0,0,0|2,0,0]=4 292 B20R2.2719388 CCCCCC(C)Nc1cc(cc2c1nccc2)F 34a_100000088212_200011218191 [1,1,0,0,0,0|2,0,0]=4 293 B20R2.2719388 CCCCCC(C)Nc1cc(cc2c1nccc2)O 34a_100000083691_200011218191 [1,1,0,0,0,0|1,0,0]=3 294 B20R2.2719388 CCCCCC(C)Oc1cc(cc2c1nccc2)C 34a_100009888445_200011218191 [1,1,0,0,0,0|2,0,0]=4 295 B20R2.2719388 CCCCCC(C)Oc1cc(cc2c1nccc2)C 7a_100009888445_200011218191 [1,1,0,0,0,0|2,0,0]=4 296 B20R2.18597 COc1cc(c2ncccc2c1)NCCCC(=O)C 34a_100000014381_100000685027 [1,1,0,0,0,0|1,0,1]=4 297 B20R2.18597 COc1cc(c2ncccc2c1)NCCCC(=O)N 34a_100000014381_100102525003 [1,1,0,0,0,0|0,0,1]=3 298 B20R2.18597 COc1cc(c2ncccc2c1)NCCCC(C)C 34a_100000014381_100011214892 [1,1,0,0,0,0|1,0,0]=3 299 B20R2.18597 COc1cc(c2ncccc2c1)NCCCC(C)O 34a_100000014381_200000718107 [1,1,0,0,0,0|1,0,0]=3 300 B20R2.18597 COc1cc(c2ncccc2c1)NCCOC(=O)N 34a_100000014381_200011214921 [1,1,0,0,0,0|1,0,1]=4 301 B20R2.18597 COc1cc(c2ncccc2c1)NCCOC(C)C 34a_100000014381_100000211751 [1,1,0,0,0,0|2,0,0]=4 302 B20R2.18597 COc1cc(c2ncccc2c1)NCCSC(C)C 34a_100000014381_100000730970 [1,1,0,0,0,0|2,0,0]=4 303 B20R2.18597 COc1cc(c2ncccc2c1)SCCCC(=O)N 62a_100102525003_200010235761 [1,1,0,0,0,0|1,0,1]=4 304 B20R2.18597 COc1cc(c2ncccc2c1)SCCCC(C)C 62a_100011214892_200010235761 [1,1,0,0,0,0|2,0,0]=4 305 B20R2.18597 COc1cc(c2ncccc2c1)SCCCC(C)O 62a_200000718107_200010235761 [1,1,0,0,0,0|2,0,0]=4 306 B20R2.845842 C#CCCCNc1cc(c(c2c1nccc2)F)OC 27a_100000718082_100010742067 [1,1,0,0,0,0|1,0,1]=4 307 B20R2.845842 C=CCCCNc1cc(c(c2c1nccc2)F)OC 27a_100000700776_100010742067 [1,1,0,0,0,0|1,0,1]=4 308 B20R2.845842 CCCCCNc1cc(c(c2c1nccc2)F)OC 27a_100000209983_100010742067 [1,1,0,0,0,0|1,0,0]=3 309 B20R2.845842 CCCCCSc1cc(c(c2c1nccc2)F)OC 62a_100000210326_100010742067 [1,1,0,0,0,0|2,0,0]=4 310 B20R2.845842 CCCCCSc1cc(c(c2c1nccc2)F)OC 62a_100010742067_100000210326 [1,1,0,0,0,0|2,0,0]=4 311 B20R2.845842 CCOCCNc1cc(c(c2c1nccc2)F)OC 27a_100011200944_100010742067 [1,1,0,0,0,0|2,0,0]=4 312 B20R2.845842 CCSCCNc1cc(c(c2c1nccc2)F)OC 27a_100000106463_100010742067 [1,1,0,0,0,0|2,0,0]=4 313 B20R2.845842 COCCCNc1cc(c(c2c1nccc2)F)OC 27a_100150723488_100010742067 [1,1,0,0,0,0|2,0,0]=4 314 B20R2.845842 COc1cc(c2ncccc2c1F)NCCCCO 27a_100000750430_100010742067 [1,1,0,0,0,0|1,0,0]=3 315 B20R2.845842 COc1cc(c2ncccc2c1F)NCCCSC 27a_100000749238_100010742067 [1,1,0,0,0,0|2,0,0]=4 316 B20R2.845842 COc1cc(c2ncccc2c1F)SCCCCF 62a_100000729493_100010742067 [1,1,0,0,0,0|2,0,0]=4 317 B20R2.845842 COc1cc(c2ncccc2c1F)SCCCCF 62a_100010742067_100000729493 [1,1,0,0,0,0|2,0,0]=4 318 B20R2.845842 COc1cc(c2ncccc2c1F)SCCCCO 62a_100000210776_100010742067 [1,1,0,0,0,0|2,0,0]=4 319 B20R2.845842 COc1cc(c2ncccc2c1F)SCCCCO 62a_100010742067_100000210776 [1,1,0,0,0,0|2,0,0]=4 320 B20R2.1018945 CCCC(C)CNc1cc(cc2c1nccc2)OC 34a_100000014381_100011216630 [1,1,0,0,0,0|1,0,0]=3 321 B20R2.1018945 CCCC(C)CSc1cc(cc2c1nccc2)OC 62a_100011216630_200010235761 [1,1,0,0,0,0|2,0,0]=4 322 B20R2.1018945 COCC(O)CNc1cc(cc2c1nccc2)OC 34a_100000014381_100011215053 [1,1,0,0,0,0|2,0,0]=4 323 B20R2.1439521 C#CCCCCNc1cc(cc2c1nccc2)OC 34a_100000014381_100010269958 [1,1,0,0,0,0|1,0,0]=3 324 B20R2.1439521 C#CCCCCSc1cc(cc2c1nccc2)OC 62a_100010269958_200010235761 [1,1,0,0,0,0|2,0,0]=4 325 B20R2.1439521 C#CCOCCNc1cc(cc2c1nccc2)OC 34a_100000014381_100010402529 [1,1,0,0,0,0|1,0,1]=4 326 B20R2.1439521 C=CCCCCNc1cc(cc2c1nccc2)OC 34a_100000014381_100011215482 [1,1,0,0,0,0|1,0,0]=3 327 B20R2.1439521 C=CCCCCSc1cc(cc2c1nccc2)OC 62a_100011215482_200010235761 [1,1,0,0,0,0|2,0,0]=4 328 B20R2.1439521 CC/C=C\CCNc1cc(cc2c1nccc2)OC 34a_100000014381_100015370543 [1,1,0,0,0,0|1,0,1]=4 329 B20R2.1439521 CCCCCC=Cc1cc(cc2c1nccc2)OC 271570a_100000062253_200010235761 [1,1,0,0,0,0|2,0,0]=4 330 B20R2.1439521 CCCCCCNc1cc(cc2c1nccc2)OC 34a_100000014381_100000210314 [1,1,0,0,0,0|1,0,0]=3 331 B20R2.1439521 CCCCCCSc1cc(cc2c1nccc2)OC 62a_100000210314_200010235761 [1,1,0,0,0,0|2,0,0]=4 332 B20R2.1439521 CCCCOCNc1cc(cc2c1nccc2)OC 34a_100000014381_100011995733 [1,1,0,0,0,0|1,0,0]=3 333 B20R2.1439521 CCCCOCSc1cc(cc2c1nccc2)OC 62a_100011995733_200010235761 [1,1,0,0,0,0|2,0,0]=4 334 B20R2.1439521 CCCOCCNc1cc(cc2c1nccc2)OC 34a_100000014381_100011215938 [1,1,0,0,0,0|1,0,0]=3 335 B20R2.1439521 CCCOCCSc1cc(cc2c1nccc2)OC 62a_100011215938_200010235761 [1,1,0,0,0,0|2,0,0]=4 336 B20R2.1439521 CCOCCCNc1cc(cc2c1nccc2)OC 34a_100000014381_100012232248 [1,1,0,0,0,0|1,0,0]=3 337 B20R2.1439521 CCOCCCSc1cc(cc2c1nccc2)OC 62a_100012232248_200010235761 [1,1,0,0,0,0|2,0,0]=4 338 B20R2.1439521 COCCCCNc1cc(cc2c1nccc2)OC 34a_100000014381_100000755781 [1,1,0,0,0,0|1,0,0]=3 339 B20R2.1439521 COCCCCSc1cc(cc2c1nccc2)OC 62a_100000730899_200010235761 [1,1,0,0,0,0|2,0,0]=4 340 B20R2.1439521 COc1cc(c2ncccc2c1)NCCCCCF 34a_100000014381_100000729378 [1,1,0,0,0,0|1,0,0]=3 341 B20R2.1439521 COc1cc(c2ncccc2c1)NCCCCCO 34a_100000014381_100000746330 [1,1,0,0,0,0|1,0,0]=3 342 B20R2.1439521 COc1cc(c2ncccc2c1)NCCOCCO 34a_100000014381_100000692535 [1,1,0,0,0,0|1,0,0]=3 343 B20R2.1439521 COc1cc(c2ncccc2c1)SCCCCC#N 62a_100011219923_200010235761 [1,1,0,0,0,0|1,0,1]=4 344 B20R2.1439521 COc1cc(c2ncccc2c1)SCCCCC=O 62a_100000139335_200010235761 [1,1,0,0,0,0|2,0,0]=4 345 B20R2.1439521 COc1cc(c2ncccc2c1)SCCCCCF 62a_100000729378_200010235761 [1,1,0,0,0,0|2,0,0]=4 346 B20R2.1439521 COc1cc(c2ncccc2c1)SCCCCCO 62a_100000746330_200010235761 [1,1,0,0,0,0|2,0,0]=4 347 B20R2.1439521 COc1cc(c2ncccc2c1)SCCOCCO 62a_100011215305_200010235761 [1,1,0,0,0,0|2,0,0]=4 348 B20R2.18596 CCC(=O)C(C)Sc1cc(cc2c1nccc2)OC 62a_100000742827_200010235761 [1,1,0,0,0,0|1,0,1]=4 349 B20R2.18596 CCC(C)C(=O)Nc1cc(cc2c1nccc2)OC 11a_100000014381_100011192722 [1,1,0,0,0,0|1,0,1]=4 350 B20R2.18596 CCC(C)C(=O)Nc1cc(cc2c1nccc2)OC 1626a_100000014381_100011192722 [1,1,0,0,0,0|1,0,1]=4 351 B20R2.18596 CCC(C)C(=O)Nc1cc(cc2c1nccc2)OC 22a_100000014381_100011192722 [1,1,0,0,0,0|1,0,1]=4 352 B20R2.18596 CCC(C)C(=O)Nc1cc(cc2c1nccc2)OC 527a_100000014381_100011192722 [1,1,0,0,0,0|1,0,1]=4 353 B20R2.18596 CCC(O)C(=O)Nc1cc(cc2c1nccc2)OC 22a_100000014381_100011196387 [1,1,0,0,0,0|1,0,1]=4 354 B20R2.18596 CNC(=O)C(C)Nc1cc(cc2c1nccc2)OC 34a_100000014381_100000731044 [1,1,0,0,0,0|1,0,1]=4 355 B20R2.18596 COC(=O)C(C)Nc1cc(cc2c1nccc2)OC 34a_100000014381_100000211248 [1,1,0,0,0,0|1,0,1]=4 356 B20R2.278533 COc1cc(c2ccccc2c1)OC(C)CC(C)C 34a_200000076035_100000731052 [1,1,0,0,0,0|2,0,0]=4 357 B20R2.278533 COc1cc(c2ccccc2c1)OC(C)CC(C)C 7a_200000076035_100000731052 [1,1,0,0,0,0|2,0,0]=4 358 B20R2.278533 COc1cc(c2cccnc2c1)NC(C)CC(C)C 27a_100000692259_100010248855 [1,1,0,0,0,0|2,0,0]=4 359 B20R2.278533 COc1cc(c2ncccc2c1)NC(=O)CC(C)C 11a_100000014381_100000210554 [1,1,0,0,0,0|1,0,1]=4 360 B20R2.278533 COc1cc(c2ncccc2c1)NC(=O)CC(C)C 1626a_100000014381_100000210554 [1,1,0,0,0,0|1,0,1]=4 361 B20R2.278533 COc1cc(c2ncccc2c1)NC(=O)CC(C)C 22a_100000014381_100000210554 [1,1,0,0,0,0|1,0,1]=4 362 B20R2.278533 COc1cc(c2ncccc2c1)NC(=O)CC(C)C 527a_100000014381_100000210554 [1,1,0,0,0,0|1,0,1]=4 363 B20R2.278533 COc1cc(c2ncccc2c1)NC(=O)C[C@@H](C)O 22a_100000014381_100011933948 [1,1,0,0,0,0|1,0,1]=4 364 B20R2.278533 COc1cc(c2ncccc2c1)NC(C)CC(C)C 34a_100000014381_100000731052 [1,1,0,0,0,0|0,0,0]=2 365 B20R2.278533 COc1cc(c2ncccc2c1)SC(C)CC(C)C 62a_100000731052_200010235761 [1,1,0,0,0,0|1,0,0]=3 366 B20R2.278533 COc1cc(c2ncccc2c1)SC(C)CN(C)C 62a_100020606517_200010235761 [1,1,0,0,0,0|2,0,0]=4 367 B20R2.2064823 CCCC(C)Nc1cc(c(c2c1nccc2)F)OC 27a_100000741246_100010742067 [1,1,0,0,0,0|0,0,0]=2 368 B20R2.2064823 CCCC(C)Sc1cc(c(c2c1nccc2)F)OC 62a_100000766640_100010742067 [1,1,0,0,0,0|1,0,0]=3 369 B20R2.2064823 CCCC(C)Sc1cc(c(c2c1nccc2)F)OC 62a_100010742067_100000766640 [1,1,0,0,0,0|1,0,0]=3 370 B20R2.2064823 COCC(C)Sc1cc(c(c2c1nccc2)F)OC 62a_100000765312_100010742067 [1,1,0,0,0,0|2,0,0]=4 371 B20R2.2064823 COCC(C)Sc1cc(c(c2c1nccc2)F)OC 62a_100010742067_100000765312 [1,1,0,0,0,0|2,0,0]=4 372 B20R2.2064823 COC[C@@H](C)Nc1cc(c(c2c1nccc2)F)OC 27a_100000764878_100010742067 [1,1,0,0,0,0|1,0,0]=3 373 B20R2.2064823 COc1cc(c2ncccc2c1F)N[C@@H](C)CC#N 27a_100016994482_100010742067 [1,1,0,0,0,0|0,0,2]=4 374 B20R2.2064823 COc1cc(c2ncccc2c1F)N[C@H](C)CCO 27a_100000706166_100010742067 [1,1,0,0,0,0|1,0,0]=3 375 B20R2.2064823 COc1cc(c2ncccc2c1F)SC(C)CCO 62a_100009893172_100010742067 [1,1,0,0,0,0|2,0,0]=4 376 B20R2.2064823 COc1cc(c2ncccc2c1F)SC(C)CCO 62a_100010742067_100009893172 [1,1,0,0,0,0|2,0,0]=4 377 B20R2.4008055 CCCC(CC)Nc1cc(cc2c1cccn2)OC 27a_100000747048_100010248855 [1,1,0,0,0,0|2,0,0]=4 378 B20R2.4008055 CCCC(CC)Oc1cc(cc2c1cccc2)OC 7a_200000076035_100011219200 [1,1,0,0,0,0|2,0,0]=4 379 B20R2.4008055 CCCC(CC)Sc1cc(cc2c1nccc2)OC 62a_100011219200_200010235761 [1,1,0,0,0,0|1,0,0]=3 380 B20R2.4008055 CCC[C@@H](CO)Nc1cc(cc2c1cccn2)OC 27a_100000732646_100010248855 [1,1,0,0,0,0|2,0,0]=4 381 B20R2.5216529 CCCC(C)C(=O)c1cc(cc2c1cccc2)OC 1458a_100010090016_100000766640 [1,1,0,0,0,0|2,0,0]=4 382 B20R2.30227524 CCCS(=O)(=O)Nc1cc(cc2c1nccc2)OC 232682a_100000014381_100000211391 [1,1,0,0,0,0|2,0,0]=4 383 B20R2.30227524 CCCS(=O)(=O)Nc1cc(cc2c1nccc2)OC 40a_100000014381_100000054278 [1,1,0,0,0,0|2,0,0]=4 384 B20R2.2028322 CCCCN(C)c1cc(c(c2c1nccc2)F)OC 27a_100000207549_100010742067 [0,1,0,0,1,0|2,0,0]=4 385 B20R2.2028322 COc1cc(c2ncccc2c1F)N(C)CCCO 27a_100000213112_100010742067 [0,1,0,0,1,0|2,0,0]=4 386 B20R2.316436 CCCCC(C)Sc1cc(c2ncccc2c1)OC 62a_200011215066_100010248852 [0,0,1,1,0,0|2,0,0]=4 387 B20R3.413 Brc1cc(c2ncccc2c1)NC3CCCCC3 27a_100000182618_100010090713 [1,0,0,1,0,0|2,0,0]=4 388 B20R3.413 Brc1cc(c2ncccc2c1)NC3CCCCC3 34a_100009814519_100000210327 [1,0,0,1,0,0|2,0,0]=4 389 B20R3.413 Brc1cc(c2ncccc2c1)NC3CCCOC3 27a_100000719290_100010090713 [1,0,0,1,0,0|2,0,0]=4 390 B20R3.413 Brc1cc(c2ncccc2c1)NC3CCCOC3 34a_100009814519_100000693364 [1,0,0,1,0,0|2,0,0]=4 391 B20R3.413 Cc1cc(c2ncccc2c1)OC3CCCCC3 34a_100009888445_100000210327 [1,0,0,1,0,0|2,0,0]=4 392 B20R3.413 Cc1cc(c2ncccc2c1)OC3CCCCC3 7a_100009888445_100000210327 [1,0,0,1,0,0|2,0,0]=4 393 B20R3.413 Cc1cc(c2ncccc2c1)OC3CCCOC3 34a_100009888445_100000693364 [1,0,0,1,0,0|2,0,0]=4 394 B20R3.413 Cc1cc(c2ncccc2c1)OC3CCCOC3 7a_100009888445_100000693364 [1,0,0,1,0,0|2,0,0]=4 395 B20R3.413 Cc1cc(c2ncccc2c1)SC3CCCCC3 62a_100000210327_100010113427 [1,0,0,1,0,0|2,0,0]=4 396 B20R3.413 Clc1cc(c2ncccc2c1)NC3CCCCC3 34a_100000026717_100000210327 [1,0,0,1,0,0|2,0,0]=4 397 B20R3.413 Clc1cc(c2ncccc2c1)NC3CCCOC3 34a_100000026717_100000693364 [1,0,0,1,0,0|2,0,0]=4 398 B20R3.413 Fc1cc(c2ncccc2c1)NC3CCCCC3 27a_100000182618_100010214460 [1,0,0,1,0,0|2,0,0]=4 399 B20R3.413 Fc1cc(c2ncccc2c1)NC3CCCCC3 34a_100000088212_100000210327 [1,0,0,1,0,0|2,0,0]=4 400 B20R3.413 Fc1cc(c2ncccc2c1)NC3CCCOC3 27a_100000719290_100010214460 [1,0,0,1,0,0|2,0,0]=4 401 B20R3.413 Fc1cc(c2ncccc2c1)NC3CCCOC3 34a_100000088212_100000693364 [1,0,0,1,0,0|2,0,0]=4 402 B20R3.413 Oc1cc(c2ncccc2c1)NC3CCCCC3 34a_100000083691_100000210327 [1,0,0,1,0,0|1,0,0]=3 403 B20R3.413 Oc1cc(c2ncccc2c1)NC3CCCOC3 34a_100000083691_100000693364 [1,0,0,1,0,0|1,0,0]=3 404 B20R3.413 Oc1cc(c2ncccc2c1)NC3CCSCC3 34a_100000083691_100000069128 [1,0,0,1,0,0|2,0,0]=4 405 B20R3.86379 O[C@@H]1CC[C@@H](C1)Nc2cc(cc3c2nccc3)Br 27a_100015195300_100010090713 [1,0,0,1,0,0|2,0,0]=4 406 B20R3.86379 O[C@@H]1CC[C@@H](C1)Nc2cc(cc3c2nccc3)F 27a_100015195300_100010214460 [1,0,0,1,0,0|2,0,0]=4 407 B20R3.97153 CC1CCCCN1c2cc(cc3c2nccc3)Br 27a_100000211376_100010090713 [1,0,0,1,0,0|2,0,0]=4 408 B20R3.97153 CC1CCCCN1c2cc(cc3c2nccc3)F 27a_100000211376_100010214460 [1,0,0,1,0,0|2,0,0]=4 409 B20R3.260821 CC(Nc1cc(cc2c1nccc2)Br)C3CCC3 27a_100016994624_100010090713 [1,0,0,1,0,0|2,0,0]=4 410 B20R3.260821 CC(Nc1cc(cc2c1nccc2)F)C3CCC3 27a_100016994624_100010214460 [1,0,0,1,0,0|2,0,0]=4 411 B20R3.507222 Cc1cc(c2ncccc2c1)SC3CC(C3)CO 62a_100009874164_100010113427 [1,0,0,1,0,0|2,0,0]=4 412 B20R3.507222 OCC1CC(C1)Nc2cc(cc3c2nccc3)Br 27a_100000095622_100010090713 [1,0,0,1,0,0|2,0,0]=4 413 B20R3.507222 OCC1CC(C1)Nc2cc(cc3c2nccc3)F 27a_100000095622_100010214460 [1,0,0,1,0,0|2,0,0]=4 414 B20R3.1958178 CC1CCC(N1c2cc(cc3c2nccc3)Br)C 27a_100000687148_100010090713 [1,0,0,1,0,0|2,0,0]=4 415 B20R3.1958178 CC1CCC(N1c2cc(cc3c2nccc3)F)C 27a_100000687148_100010214460 [1,0,0,1,0,0|2,0,0]=4 416 B20R3.756 COc1cc(c2ncccc2c1)C3=CCCCC3 271570a_100000062251_200010235761 [1,0,0,1,0,0|2,0,0]=4 417 B20R3.23064 COc1cc(c2ncccc2c1)NC3CCCC3 34a_100000014381_100000179811 [1,0,0,1,0,0|1,0,0]=3 418 B20R3.23064 COc1cc(c2ncccc2c1)NC3CCOC3 34a_100000014381_100000690089 [1,0,0,1,0,0|2,0,0]=4 419 B20R3.23064 COc1cc(c2ncccc2c1)SC3CCCC3 62a_100011217020_200010235761 [1,0,0,1,0,0|2,0,0]=4 420 B20R3.463676 COc1cc(c2ncccc2c1)NC3CCC3=O 34a_100000014381_100009892977 [1,0,0,1,0,0|1,0,1]=4 421 B20R3.463680 COc1cc(c2ncccc2c1)NCCC3CC3 34a_100000014381_100000694398 [1,0,0,1,0,0|1,0,0]=3 422 B20R3.463680 COc1cc(c2ncccc2c1)NCCC3CO3 34a_100000014381_100000732470 [1,0,0,1,0,0|1,0,0]=3 423 B20R3.463680 COc1cc(c2ncccc2c1)SCCC3CC3 62a_100000764125_200010235761 [1,0,0,1,0,0|2,0,0]=4 424 B20R3.463680 COc1cc(c2ncccc2c1)SCCC3CO3 62a_100000732470_200010235761 [1,0,0,1,0,0|2,0,0]=4 425 B20R3.463685 COc1cc(c2ncccc2c1)NCC3CCC3 34a_100000014381_100000763275 [1,0,0,1,0,0|1,0,0]=3 426 B20R3.463685 COc1cc(c2ncccc2c1)NCC3CCO3 34a_100000014381_100000103362 [1,0,0,1,0,0|1,0,0]=3 427 B20R3.463685 COc1cc(c2ncccc2c1)NCC3COC3 34a_100000014381_100010264016 [1,0,0,1,0,0|2,0,0]=4 428 B20R3.463685 COc1cc(c2ncccc2c1)SCC3CCC3 62a_100000763275_200010235761 [1,0,0,1,0,0|2,0,0]=4 429 B20R3.463685 COc1cc(c2ncccc2c1)SCC3CCO3 62a_100000103362_200010235761 [1,0,0,1,0,0|2,0,0]=4 430 B20R3.463684 COc1cc(c2cccnc2c1)NC(C)C3CC3 27a_100000700016_100010248855 [1,0,0,1,0,0|2,0,0]=4 431 B20R3.463684 COc1cc(c2ncccc2c1)NC(=O)C3CC3 11a_100000014381_100000210395 [1,0,0,1,0,0|1,0,1]=4 432 B20R3.463684 COc1cc(c2ncccc2c1)NC(=O)C3CC3 1626a_100000014381_100000210395 [1,0,0,1,0,0|1,0,1]=4 433 B20R3.463684 COc1cc(c2ncccc2c1)NC(=O)C3CC3 22a_100000014381_100000210395 [1,0,0,1,0,0|1,0,1]=4 434 B20R3.463684 COc1cc(c2ncccc2c1)NC(=O)C3CC3 527a_100000014381_100000210395 [1,0,0,1,0,0|1,0,1]=4 435 B20R3.463698 COc1cc(c2cccnc2c1)NC3(CCC3)C 27a_100000692455_100010248855 [1,0,0,1,0,0|2,0,0]=4 436 B18R2.895583 CCCC(C)Sc1cc(cc2c1cc[nH]2)OC 62a_100000766640_100010006585 [1,0,0,0,1,0|2,0,0]=4 437 B18R2.895583 CCCC(C)Sc1cc(cc2c1nc[nH]2)OC 62a_100000766640_100102526192 [1,0,0,0,1,0|2,0,0]=4 438 B20R2.316852 C[C@H](CCCO)CNc1cc(cc2c1nccc2)Br 27a_100160569302_100010090713 [1,0,0,0,0,1|2,0,0]=4 439 B20R2.316852 C[C@H](CCCO)CNc1cc(cc2c1nccc2)F 27a_100160569302_100010214460 [1,0,0,0,0,1|2,0,0]=4 440 B20R2.651 CCCCC(C)Sc1cc2ncccc2cc1OC 62a_100011093944_200011215066 [0,0,0,0,1,1|2,0,0]=4 441 B20R2.651 CCCCC(C)Sc1cc2ncccc2cc1OC 62a_200011215066_100011093944 [0,0,0,0,1,1|2,0,0]=4 442 B20R2.3759652 CCCCC(C)Nc1c(ccc2c1cccc2)OC 34a_100009884440_200011215066 [0,0,0,0,1,1|2,0,0]=4 443 B20R2.3759652 CCCCC(C)Sc1c(ccc2c1nccc2)OC 62a_200011215066_100010071576 [0,0,0,0,1,1|2,0,0]=4 444 B20R2.3768505 CCCCC(C)Nc1ccc(c2c1cccc2)OC 34a_100020629631_200011215066 [0,0,0,0,1,1|2,0,0]=4 445 B20R2.3768505 CCCCC(C)Nc1ccc(c2c1nccc2)OC 34a_100000703970_200011215066 [0,0,0,0,1,1|1,0,0]=3 446 B20R2.3768505 CCCCC(C)Oc1ccc(c2c1nccc2)OC 34a_100009853971_200011215066 [0,0,0,0,1,1|2,0,0]=4