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(=Cc1cc(cc2c1nccc2)OC)Br 271570a_206741709834_200010235761 [0,0,0,0,0,0|3,0,1]=4 9 B20R2.7554664 CCCCC(=O)Nc1cc(cc2c1nccc2)OC 11a_100000014381_100000210183 [0,0,0,0,0,0|2,0,1]=3 10 B20R2.7554664 CCCCC(=O)Nc1cc(cc2c1nccc2)OC 1626a_100000014381_100000210183 [0,0,0,0,0,0|2,0,1]=3 11 B20R2.7554664 CCCCC(=O)Nc1cc(cc2c1nccc2)OC 22a_100000014381_100000210183 [0,0,0,0,0,0|2,0,1]=3 12 B20R2.7554664 CCCCC(=O)Nc1cc(cc2c1nccc2)OC 527a_100000014381_100000210183 [0,0,0,0,0,0|2,0,1]=3 13 B20R2.7554664 CCCCC(C)Nc1cc(cc2c1cccn2)OC 27a_100000126638_100010248855 [0,0,0,0,0,0|3,0,0]=3 14 B20R2.7554664 CCCCC(C)Nc1cc(cc2c1nccc2)OC 34a_100000014381_200011215066 [0,0,0,0,0,0|1,0,0]=1 15 B20R2.7554664 CCCCC(C)Oc1cc(cc2c1cccc2)OC 34a_200000076035_200011215066 [0,0,0,0,0,0|3,0,0]=3 16 B20R2.7554664 CCCCC(C)Oc1cc(cc2c1cccc2)OC 7a_200000076035_200011215066 [0,0,0,0,0,0|3,0,0]=3 17 B20R2.7554664 CCCCC(C)Sc1cc(cc2c1cccc2)OC 62a_200011215066_100010152498 [0,0,0,0,0,0|3,0,0]=3 18 B20R2.7554664 CCCCC(C)Sc1cc(cc2c1cccn2)OC 62a_100010248855_200011215066 [0,0,0,0,0,0|4,0,0]=4 19 B20R2.7554664 CCCCC(C)Sc1cc(cc2c1cccn2)OC 62a_200011215066_100010248855 [0,0,0,0,0,0|4,0,0]=4 20 B20R2.7554664 CCCCC(C)Sc1cc(cc2c1nccc2)OC 62a_200011215066_200010235761 [0,0,0,0,0,0|2,0,0]=2 21 B20R2.7554664 CCCNC(=O)Nc1cc(cc2c1nccc2)OC 2430a_100000014381_100020643023 [0,0,0,0,0,0|3,0,1]=4 22 B20R2.7554664 CCCNC(=O)Nc1cc(cc2c1nccc2)OC 512a_100000014381_100020643023 [0,0,0,0,0,0|3,0,1]=4 23 B20R2.7554664 CCOCC(=O)Nc1cc(cc2c1nccc2)OC 11a_100000014381_100000211967 [0,0,0,0,0,0|3,0,1]=4 24 B20R2.7554664 CCOCC(=O)Nc1cc(cc2c1nccc2)OC 1626a_100000014381_100000211967 [0,0,0,0,0,0|3,0,1]=4 25 B20R2.7554664 CCOCC(=O)Nc1cc(cc2c1nccc2)OC 22a_100000014381_100000211967 [0,0,0,0,0,0|3,0,1]=4 26 B20R2.7554664 CCOCC(=O)Nc1cc(cc2c1nccc2)OC 527a_100000014381_100000211967 [0,0,0,0,0,0|3,0,1]=4 27 B20R2.7554664 CCSCC(=O)Nc1cc(cc2c1nccc2)OC 11a_100000014381_100000230394 [0,0,0,0,0,0|3,0,1]=4 28 B20R2.7554664 CCSCC(=O)Nc1cc(cc2c1nccc2)OC 1626a_100000014381_100000230394 [0,0,0,0,0,0|3,0,1]=4 29 B20R2.7554664 CCSCC(=O)Nc1cc(cc2c1nccc2)OC 22a_100000014381_100000230394 [0,0,0,0,0,0|3,0,1]=4 30 B20R2.7554664 CCSCC(=O)Nc1cc(cc2c1nccc2)OC 527a_100000014381_100000230394 [0,0,0,0,0,0|3,0,1]=4 31 B20R2.7554664 COCCC(=O)Nc1cc(cc2c1nccc2)OC 11a_100000014381_100000749529 [0,0,0,0,0,0|3,0,1]=4 32 B20R2.7554664 COCCC(=O)Nc1cc(cc2c1nccc2)OC 1626a_100000014381_100000749529 [0,0,0,0,0,0|3,0,1]=4 33 B20R2.7554664 COCCC(=O)Nc1cc(cc2c1nccc2)OC 22a_100000014381_100000749529 [0,0,0,0,0,0|3,0,1]=4 34 B20R2.7554664 COCCC(=O)Nc1cc(cc2c1nccc2)OC 527a_100000014381_100000749529 [0,0,0,0,0,0|3,0,1]=4 35 B20R2.7554664 COc1cc(c2ncccc2c1)NC(=O)CCC#N 11a_100000014381_100011934036 [0,0,0,0,0,0|1,0,3]=4 36 B20R2.7554664 COc1cc(c2ncccc2c1)NC(=O)CCC#N 1626a_100000014381_100011934036 [0,0,0,0,0,0|1,0,3]=4 37 B20R2.7554664 COc1cc(c2ncccc2c1)NC(=O)CCC#N 22a_100000014381_100011934036 [0,0,0,0,0,0|1,0,3]=4 38 B20R2.7554664 COc1cc(c2ncccc2c1)NC(=O)CCC#N 527a_100000014381_100011934036 [0,0,0,0,0,0|1,0,3]=4 39 B20R2.7554664 COc1cc(c2ncccc2c1)NC(=O)CCSC 11a_100000014381_100000174002 [0,0,0,0,0,0|3,0,1]=4 40 B20R2.7554664 COc1cc(c2ncccc2c1)NC(=O)CCSC 1626a_100000014381_100000174002 [0,0,0,0,0,0|3,0,1]=4 41 B20R2.7554664 COc1cc(c2ncccc2c1)NC(=O)CCSC 22a_100000014381_100000174002 [0,0,0,0,0,0|3,0,1]=4 42 B20R2.7554664 COc1cc(c2ncccc2c1)NC(=O)CCSC 527a_100000014381_100000174002 [0,0,0,0,0,0|3,0,1]=4 43 B20R2.7554664 COc1cc(c2ncccc2c1)NC(=O)NCCF 2430a_100000014381_100000724931 [0,0,0,0,0,0|3,0,1]=4 44 B20R2.7554664 COc1cc(c2ncccc2c1)NC(=O)NCCF 512a_100000014381_100000724931 [0,0,0,0,0,0|3,0,1]=4 45 B20R2.7554664 COc1cc(c2ncccc2c1)NC(=O)NCCO 2430a_100000014381_100000210304 [0,0,0,0,0,0|3,0,1]=4 46 B20R2.7554664 COc1cc(c2ncccc2c1)NC(=O)NCCO 512a_100000014381_100000210304 [0,0,0,0,0,0|3,0,1]=4 47 B19R2.514244 CCCCC(=O)Nc1cc(cc2c1nccc2)O 527a_100000083691_100000210183 [1,0,0,0,0,0|2,0,1]=4 48 B19R2.514244 CCCCC(C)Nc1cc(cc2c1cccc2)Br 34a_100010171453_200011215066 [1,0,0,0,0,0|3,0,0]=4 49 B19R2.514244 CCCCC(C)Nc1cc(cc2c1nccc2)Br 27a_100000126638_100010090713 [1,0,0,0,0,0|2,0,0]=3 50 B19R2.514244 CCCCC(C)Nc1cc(cc2c1nccc2)Br 34a_100009814519_200011215066 [1,0,0,0,0,0|2,0,0]=3 51 B19R2.514244 CCCCC(C)Nc1cc(cc2c1nccc2)Cl 34a_100000026717_200011215066 [1,0,0,0,0,0|2,0,0]=3 52 B19R2.514244 CCCCC(C)Nc1cc(cc2c1nccc2)F 27a_100000126638_100010214460 [1,0,0,0,0,0|2,0,0]=3 53 B19R2.514244 CCCCC(C)Nc1cc(cc2c1nccc2)F 34a_100000088212_200011215066 [1,0,0,0,0,0|2,0,0]=3 54 B19R2.514244 CCCCC(C)Nc1cc(cc2c1nccc2)O 34a_100000083691_200011215066 [1,0,0,0,0,0|1,0,0]=2 55 B19R2.514244 CCCCC(C)Nc1cc(cc2c1nccn2)F 27a_100000126638_100011083936 [1,0,0,0,0,0|3,0,0]=4 56 B19R2.514244 CCCCC(C)Nc1cc(nc2c1cccc2)C 27a_100000126638_100000735862 [1,0,0,0,0,0|3,0,0]=4 57 B19R2.514244 CCCCC(C)Nc1nc(cc2c1cccc2)C 27a_100000126638_100000698243 [1,0,0,0,0,0|3,0,0]=4 58 B19R2.514244 CCCCC(C)Nc1nc(cc2c1nccc2)N 27a_100000126638_100010205410 [1,0,0,0,0,0|3,0,0]=4 59 B19R2.514244 CCCCC(C)Oc1cc(cc2c1nccc2)Br 34a_100010248853_200011215066 [1,0,0,0,0,0|3,0,0]=4 60 B19R2.514244 CCCCC(C)Oc1cc(cc2c1nccc2)Br 7a_100010248853_200011215066 [1,0,0,0,0,0|3,0,0]=4 61 B19R2.514244 CCCCC(C)Oc1cc(cc2c1nccc2)C 34a_100009888445_200011215066 [1,0,0,0,0,0|2,0,0]=3 62 B19R2.514244 CCCCC(C)Oc1cc(cc2c1nccc2)C 7a_100009888445_200011215066 [1,0,0,0,0,0|2,0,0]=3 63 B19R2.514244 CCCCC(C)Oc1cc(cc2c1nccc2)Cl 34a_200000089624_200011215066 [1,0,0,0,0,0|3,0,0]=4 64 B19R2.514244 CCCCC(C)Oc1cc(cc2c1nccc2)Cl 7a_200000089624_200011215066 [1,0,0,0,0,0|3,0,0]=4 65 B19R2.514244 CCCCC(C)Sc1cc(cc2c1cccc2)O 62a_200011215066_100010001680 [1,0,0,0,0,0|3,0,0]=4 66 B19R2.514244 CCCCC(C)Sc1cc(cc2c1nccc2)Br 62a_100010090713_200011215066 [1,0,0,0,0,0|3,0,0]=4 67 B19R2.514244 CCCCC(C)Sc1cc(cc2c1nccc2)Br 62a_200011215066_100010090713 [1,0,0,0,0,0|3,0,0]=4 68 B19R2.514244 CCCCC(C)Sc1cc(cc2c1nccc2)C 62a_200011215066_100010113427 [1,0,0,0,0,0|2,0,0]=3 69 B19R2.514244 CCCCC(C)Sc1cc(cc2c1nccc2)F 62a_100010214460_200011215066 [1,0,0,0,0,0|3,0,0]=4 70 B19R2.514244 CCCCC(C)Sc1cc(cc2c1nccc2)F 62a_200011215066_100010214460 [1,0,0,0,0,0|3,0,0]=4 71 B19R2.1069697 C#CCCCNc1cc(cc2c1nccc2)OC 34a_100000014381_100000695029 [1,0,0,0,0,0|1,0,1]=3 72 B19R2.1069697 C#CCCCSc1cc(cc2c1nccc2)OC 62a_100011215417_200010235761 [1,0,0,0,0,0|2,0,1]=4 73 B19R2.1069697 C=CCCCNc1cc(cc2c1nccc2)OC 34a_100000014381_100000757094 [1,0,0,0,0,0|1,0,1]=3 74 B19R2.1069697 C=CCCCSc1cc(cc2c1nccc2)OC 62a_100011713584_200010235761 [1,0,0,0,0,0|2,0,1]=4 75 B19R2.1069697 C=COCCNc1cc(cc2c1nccc2)OC 34a_100000014381_100000039644 [1,0,0,0,0,0|2,0,1]=4 76 B19R2.1069697 CC/C=C\CNc1cc(cc2c1nccc2)OC 34a_100000014381_100103147603 [1,0,0,0,0,0|1,0,2]=4 77 B19R2.1069697 CCC#CCNc1cc(cc2c1nccc2)OC 34a_100000014381_100009813939 [1,0,0,0,0,0|1,0,2]=4 78 B19R2.1069697 CCCCC=Cc1cc(cc2c1nccc2)OC 271570a_100016275911_200010235761 [1,0,0,0,0,0|2,0,1]=4 79 B19R2.1069697 CCCCCNc1cc(cc2c1cccn2)OC 27a_100000209983_100010248855 [1,0,0,0,0,0|3,0,0]=4 80 B19R2.1069697 CCCCCNc1cc(cc2c1nccc2)OC 34a_100000014381_100000718602 [1,0,0,0,0,0|1,0,0]=2 81 B19R2.1069697 CCCCCOc1cc(cc2c1cccc2)OC 34a_200000076035_100000718602 [1,0,0,0,0,0|3,0,0]=4 82 B19R2.1069697 CCCCCOc1cc(cc2c1cccc2)OC 7a_200000076035_100000210326 [1,0,0,0,0,0|3,0,0]=4 83 B19R2.1069697 CCCCCSc1cc(cc2c1cccc2)OC 62a_100000210326_100010152498 [1,0,0,0,0,0|3,0,0]=4 84 B19R2.1069697 CCCCCSc1cc(cc2c1nccc2)OC 62a_100000210326_200010235761 [1,0,0,0,0,0|2,0,0]=3 85 B19R2.1069697 CCOCCNc1cc(cc2c1nccc2)OC 34a_100000014381_100000210147 [1,0,0,0,0,0|2,0,0]=3 86 B19R2.1069697 CCOCCSc1cc(cc2c1nccc2)OC 62a_100000210147_200010235761 [1,0,0,0,0,0|3,0,0]=4 87 B19R2.1069697 CCSCCNc1cc(cc2c1nccc2)OC 34a_100000014381_100000757381 [1,0,0,0,0,0|2,0,0]=3 88 B19R2.1069697 CCSCCSc1cc(cc2c1nccc2)OC 62a_100000757381_200010235761 [1,0,0,0,0,0|3,0,0]=4 89 B19R2.1069697 COCCCNc1cc(cc2c1nccc2)OC 34a_100000014381_100000740836 [1,0,0,0,0,0|2,0,0]=3 90 B19R2.1069697 COCCCSc1cc(cc2c1nccc2)OC 62a_100000709357_200010235761 [1,0,0,0,0,0|3,0,0]=4 91 B19R2.1069697 COc1cc(c2ccccc2c1)OCCCCF 34a_200000076035_100000729493 [1,0,0,0,0,0|3,0,0]=4 92 B19R2.1069697 COc1cc(c2ccccc2c1)OCCCCF 7a_200000076035_100000729493 [1,0,0,0,0,0|3,0,0]=4 93 B19R2.1069697 COc1cc(c2ccccc2c1)OCCCCO 34a_200000076035_100011216708 [1,0,0,0,0,0|3,0,0]=4 94 B19R2.1069697 COc1cc(c2ccccc2c1)OCCCCO 7a_200000076035_100000210776 [1,0,0,0,0,0|3,0,0]=4 95 B19R2.1069697 COc1cc(c2ccccc2c1)SCCCCF 62a_100000729493_100010152498 [1,0,0,0,0,0|3,0,0]=4 96 B19R2.1069697 COc1cc(c2ccccc2c1)SCCCCO 62a_100000210776_100010152498 [1,0,0,0,0,0|3,0,0]=4 97 B19R2.1069697 COc1cc(c2cccnc2c1)NCCCCO 27a_100000750430_100010248855 [1,0,0,0,0,0|3,0,0]=4 98 B19R2.1069697 COc1cc(c2ncccc2c1)NCC#CCO 34a_100000014381_200000047223 [1,0,0,0,0,0|1,0,2]=4 99 B19R2.1069697 COc1cc(c2ncccc2c1)NCCCCF 34a_100000014381_100000729493 [1,0,0,0,0,0|1,0,0]=2 100 B19R2.1069697 COc1cc(c2ncccc2c1)NCCCCO 34a_100000014381_100011216708 [1,0,0,0,0,0|1,0,0]=2 101 B19R2.1069697 COc1cc(c2ncccc2c1)SCCCC#N 62a_100000687738_200010235761 [1,0,0,0,0,0|1,0,2]=4 102 B19R2.1069697 COc1cc(c2ncccc2c1)SCCCC=O 62a_200011292268_200010235761 [1,0,0,0,0,0|2,0,1]=4 103 B19R2.1069697 COc1cc(c2ncccc2c1)SCCCCF 62a_100000729493_200010235761 [1,0,0,0,0,0|2,0,0]=3 104 B19R2.1069697 COc1cc(c2ncccc2c1)SCCCCO 62a_100000210776_200010235761 [1,0,0,0,0,0|2,0,0]=3 105 B19R2.1707326 CCCC(=O)Nc1cc(cc2c1nccc2)OC 11a_100000014381_100000211992 [1,0,0,0,0,0|1,0,1]=3 106 B19R2.1707326 CCCC(=O)Nc1cc(cc2c1nccc2)OC 1626a_100000014381_100000211992 [1,0,0,0,0,0|1,0,1]=3 107 B19R2.1707326 CCCC(=O)Nc1cc(cc2c1nccc2)OC 22a_100000014381_100000211992 [1,0,0,0,0,0|1,0,1]=3 108 B19R2.1707326 CCCC(=O)Nc1cc(cc2c1nccc2)OC 527a_100000014381_100000211992 [1,0,0,0,0,0|1,0,1]=3 109 B19R2.1707326 CCCC(C)Nc1cc(cc2c1cccn2)OC 27a_100000741246_100010248855 [1,0,0,0,0,0|2,0,0]=3 110 B19R2.1707326 CCCC(C)Nc1cc(cc2c1nccc2)OC 34a_100000014381_100000766640 [1,0,0,0,0,0|0,0,0]=1 111 B19R2.1707326 CCCC(C)Oc1cc(cc2c1cccc2)OC 34a_200000076035_100000766640 [1,0,0,0,0,0|2,0,0]=3 112 B19R2.1707326 CCCC(C)Oc1cc(cc2c1cccc2)OC 7a_200000076035_100000766640 [1,0,0,0,0,0|2,0,0]=3 113 B19R2.1707326 CCCC(C)Sc1cc(cc2c1cccc2)OC 62a_100000766640_100010152498 [1,0,0,0,0,0|2,0,0]=3 114 B19R2.1707326 CCCC(C)Sc1cc(cc2c1cccn2)OC 62a_100000766640_100010248855 [1,0,0,0,0,0|3,0,0]=4 115 B19R2.1707326 CCCC(C)Sc1cc(cc2c1cccn2)OC 62a_100010248855_100000766640 [1,0,0,0,0,0|3,0,0]=4 116 B19R2.1707326 CCCC(C)Sc1cc(cc2c1nccc2)OC 62a_100000766640_200010235761 [1,0,0,0,0,0|1,0,0]=2 117 B19R2.1707326 CCNC(=O)Nc1cc(cc2c1nccc2)OC 2430a_100000014381_100015525214 [1,0,0,0,0,0|2,0,1]=4 118 B19R2.1707326 CCNC(=O)Nc1cc(cc2c1nccc2)OC 512a_100000014381_100015525214 [1,0,0,0,0,0|2,0,1]=4 119 B19R2.1707326 COCC(=O)Nc1cc(cc2c1nccc2)OC 11a_100000014381_100000210968 [1,0,0,0,0,0|2,0,1]=4 120 B19R2.1707326 COCC(=O)Nc1cc(cc2c1nccc2)OC 1626a_100000014381_100000210968 [1,0,0,0,0,0|2,0,1]=4 121 B19R2.1707326 COCC(=O)Nc1cc(cc2c1nccc2)OC 22a_100000014381_100000210968 [1,0,0,0,0,0|2,0,1]=4 122 B19R2.1707326 COCC(=O)Nc1cc(cc2c1nccc2)OC 527a_100000014381_100000210968 [1,0,0,0,0,0|2,0,1]=4 123 B19R2.1707326 COCC(C)Nc1cc(cc2c1nccc2)OC 34a_100000014381_100000765312 [1,0,0,0,0,0|1,0,0]=2 124 B19R2.1707326 COCC(C)Oc1cc(cc2c1cccc2)OC 34a_200000076035_100000765312 [1,0,0,0,0,0|3,0,0]=4 125 B19R2.1707326 COCC(C)Oc1cc(cc2c1cccc2)OC 7a_200000076035_100000765312 [1,0,0,0,0,0|3,0,0]=4 126 B19R2.1707326 COCC(C)Sc1cc(cc2c1cccc2)OC 62a_100000765312_100010152498 [1,0,0,0,0,0|3,0,0]=4 127 B19R2.1707326 COCC(C)Sc1cc(cc2c1nccc2)OC 62a_100000765312_200010235761 [1,0,0,0,0,0|2,0,0]=3 128 B19R2.1707326 COC[C@@H](C)Nc1cc(cc2c1cccn2)OC 27a_100000764878_100010248855 [1,0,0,0,0,0|3,0,0]=4 129 B19R2.1707326 COc1cc(c2ccccc2c1)OC(C)CCO 34a_200000076035_100009893172 [1,0,0,0,0,0|3,0,0]=4 130 B19R2.1707326 COc1cc(c2ccccc2c1)OC(C)CCO 7a_200000076035_100009893172 [1,0,0,0,0,0|3,0,0]=4 131 B19R2.1707326 COc1cc(c2ccccc2c1)SC(C)CCO 62a_100009893172_100010152498 [1,0,0,0,0,0|3,0,0]=4 132 B19R2.1707326 COc1cc(c2cccnc2c1)N[C@H](C)CCO 27a_100000706166_100010248855 [1,0,0,0,0,0|3,0,0]=4 133 B19R2.1707326 COc1cc(c2ncccc2c1)NC(=O)CCO 22a_100000014381_100011216618 [1,0,0,0,0,0|2,0,1]=4 134 B19R2.1707326 COc1cc(c2ncccc2c1)NC(=O)CSC 11a_100000014381_100000184570 [1,0,0,0,0,0|2,0,1]=4 135 B19R2.1707326 COc1cc(c2ncccc2c1)NC(=O)CSC 1626a_100000014381_100000184570 [1,0,0,0,0,0|2,0,1]=4 136 B19R2.1707326 COc1cc(c2ncccc2c1)NC(=O)CSC 22a_100000014381_100000184570 [1,0,0,0,0,0|2,0,1]=4 137 B19R2.1707326 COc1cc(c2ncccc2c1)NC(=O)CSC 527a_100000014381_100000184570 [1,0,0,0,0,0|2,0,1]=4 138 B19R2.1707326 COc1cc(c2ncccc2c1)NC(C)CCO 34a_100000014381_100009893172 [1,0,0,0,0,0|1,0,0]=2 139 B19R2.1707326 COc1cc(c2ncccc2c1)SC(C)CC#N 62a_100009813641_200010235761 [1,0,0,0,0,0|1,0,2]=4 140 B19R2.1707326 COc1cc(c2ncccc2c1)SC(C)CCO 62a_100009893172_200010235761 [1,0,0,0,0,0|2,0,0]=3 141 B21R2.23485 COc1cc(c2ccccc2c1)OC(C)CCC(C)C 34a_200000076035_100011261404 [0,1,0,0,0,0|3,0,0]=4 142 B21R2.23485 COc1cc(c2ccccc2c1)SC(C)CCC(C)C 62a_100011261404_100010152498 [0,1,0,0,0,0|3,0,0]=4 143 B21R2.23485 COc1cc(c2cccnc2c1)NC(C)CCC(C)C 27a_100138410893_100010248855 [0,1,0,0,0,0|3,0,0]=4 144 B21R2.23485 COc1cc(c2ncccc2c1)NC(=O)CCC(=O)N 22a_100000014381_100011215257 [0,1,0,0,0,0|1,0,2]=4 145 B21R2.23485 COc1cc(c2ncccc2c1)NC(=O)CCC(=O)N 527a_100000014381_100011215257 [0,1,0,0,0,0|1,0,2]=4 146 B21R2.23485 COc1cc(c2ncccc2c1)NC(=O)CCC(C)C 11a_100000014381_100000181311 [0,1,0,0,0,0|2,0,1]=4 147 B21R2.23485 COc1cc(c2ncccc2c1)NC(=O)CCC(C)C 1626a_100000014381_100000181311 [0,1,0,0,0,0|2,0,1]=4 148 B21R2.23485 COc1cc(c2ncccc2c1)NC(=O)CCC(C)C 22a_100000014381_100000181311 [0,1,0,0,0,0|2,0,1]=4 149 B21R2.23485 COc1cc(c2ncccc2c1)NC(=O)CCC(C)C 527a_100000014381_100000181311 [0,1,0,0,0,0|2,0,1]=4 150 B21R2.23485 COc1cc(c2ncccc2c1)NC(=O)CCC(C)O 1626a_100000014381_100000718519 [0,1,0,0,0,0|2,0,1]=4 151 B21R2.23485 COc1cc(c2ncccc2c1)NC(C)CCC(C)C 34a_100000014381_100011261404 [0,1,0,0,0,0|1,0,0]=2 152 B21R2.23485 COc1cc(c2ncccc2c1)SC(C)CCC(C)C 62a_100011261404_200010235761 [0,1,0,0,0,0|2,0,0]=3 153 B21R2.425248 CCC(C)CC(=O)Nc1cc(cc2c1nccc2)OC 11a_100000014381_100000708755 [0,1,0,0,0,0|2,0,1]=4 154 B21R2.425248 CCC(C)CC(=O)Nc1cc(cc2c1nccc2)OC 1626a_100000014381_100000708755 [0,1,0,0,0,0|2,0,1]=4 155 B21R2.425248 CCC(C)CC(=O)Nc1cc(cc2c1nccc2)OC 22a_100000014381_100000708755 [0,1,0,0,0,0|2,0,1]=4 156 B21R2.425248 CCC(C)CC(=O)Nc1cc(cc2c1nccc2)OC 527a_100000014381_100000708755 [0,1,0,0,0,0|2,0,1]=4 157 B21R2.425248 CCC(C)CC(C)Nc1cc(cc2c1cccn2)OC 27a_100000763565_100010248855 [0,1,0,0,0,0|3,0,0]=4 158 B21R2.425248 CCC(O)CC(=O)Nc1cc(cc2c1nccc2)OC 1626a_100000014381_100011667805 [0,1,0,0,0,0|2,0,1]=4 159 B21R2.425248 CCC(O)CC(=O)Nc1cc(cc2c1nccc2)OC 22a_100000014381_100011667805 [0,1,0,0,0,0|2,0,1]=4 160 B21R2.425248 COC(=O)CC(C)Nc1cc(cc2c1nccc2)OC 34a_100000014381_100009817358 [0,1,0,0,0,0|2,0,1]=4 161 B21R2.8531299 CCCC(C)C(=O)Nc1cc(cc2c1nccc2)OC 11a_100000014381_100000210906 [0,1,0,0,0,0|2,0,1]=4 162 B21R2.8531299 CCCC(C)C(=O)Nc1cc(cc2c1nccc2)OC 1626a_100000014381_100000210906 [0,1,0,0,0,0|2,0,1]=4 163 B21R2.8531299 CCCC(C)C(=O)Nc1cc(cc2c1nccc2)OC 22a_100000014381_100000210906 [0,1,0,0,0,0|2,0,1]=4 164 B21R2.8531299 CCCC(C)C(=O)Nc1cc(cc2c1nccc2)OC 527a_100000014381_100000210906 [0,1,0,0,0,0|2,0,1]=4 165 B21R2.8531299 CCC[C@H](O)C(=O)Nc1cc(cc2c1nccc2)OC 22a_100000014381_100009822183 [0,1,0,0,0,0|2,0,1]=4 166 B21R2.8531299 CCNC(=O)C(C)Nc1cc(cc2c1nccc2)OC 34a_100000014381_100000230173 [0,1,0,0,0,0|2,0,1]=4 167 B21R2.8531299 CCOC(=O)C(C)Nc1cc(cc2c1nccc2)OC 34a_100000014381_100011216346 [0,1,0,0,0,0|2,0,1]=4 168 B21R2.12403933 C#CCCCC(=O)Nc1cc(cc2c1nccc2)OC 11a_100000014381_100000690238 [0,1,0,0,0,0|2,0,1]=4 169 B21R2.12403933 C#CCCCC(=O)Nc1cc(cc2c1nccc2)OC 1626a_100000014381_100000690238 [0,1,0,0,0,0|2,0,1]=4 170 B21R2.12403933 C#CCCCC(=O)Nc1cc(cc2c1nccc2)OC 22a_100000014381_100000690238 [0,1,0,0,0,0|2,0,1]=4 171 B21R2.12403933 C#CCCCC(=O)Nc1cc(cc2c1nccc2)OC 527a_100000014381_100000690238 [0,1,0,0,0,0|2,0,1]=4 172 B21R2.12403933 C=CCCCC(=O)Nc1cc(cc2c1nccc2)OC 11a_100000014381_100000766728 [0,1,0,0,0,0|2,0,1]=4 173 B21R2.12403933 C=CCCCC(=O)Nc1cc(cc2c1nccc2)OC 1626a_100000014381_100000766728 [0,1,0,0,0,0|2,0,1]=4 174 B21R2.12403933 C=CCCCC(=O)Nc1cc(cc2c1nccc2)OC 22a_100000014381_100000766728 [0,1,0,0,0,0|2,0,1]=4 175 B21R2.12403933 C=CCCCC(=O)Nc1cc(cc2c1nccc2)OC 527a_100000014381_100000766728 [0,1,0,0,0,0|2,0,1]=4 176 B21R2.12403933 CCCCCC(=O)Nc1cc(cc2c1nccc2)OC 11a_100000014381_100000212188 [0,1,0,0,0,0|2,0,1]=4 177 B21R2.12403933 CCCCCC(=O)Nc1cc(cc2c1nccc2)OC 1626a_100000014381_100000212188 [0,1,0,0,0,0|2,0,1]=4 178 B21R2.12403933 CCCCCC(=O)Nc1cc(cc2c1nccc2)OC 22a_100000014381_100000212188 [0,1,0,0,0,0|2,0,1]=4 179 B21R2.12403933 CCCCCC(=O)Nc1cc(cc2c1nccc2)OC 527a_100000014381_100000212188 [0,1,0,0,0,0|2,0,1]=4 180 B21R2.12403933 CCCCCC(C)Nc1cc(cc2c1cccn2)OC 27a_100000211957_100010248855 [0,1,0,0,0,0|3,0,0]=4 181 B21R2.12403933 CCCCCC(C)Nc1cc(cc2c1nccc2)OC 34a_100000014381_200011218191 [0,1,0,0,0,0|1,0,0]=2 182 B21R2.12403933 CCCCCC(C)Oc1cc(cc2c1cccc2)OC 34a_200000076035_200011218191 [0,1,0,0,0,0|3,0,0]=4 183 B21R2.12403933 CCCCCC(C)Oc1cc(cc2c1cccc2)OC 7a_200000076035_200011218191 [0,1,0,0,0,0|3,0,0]=4 184 B21R2.12403933 CCCCCC(C)Sc1cc(cc2c1cccc2)OC 62a_200011218191_100010152498 [0,1,0,0,0,0|3,0,0]=4 185 B21R2.12403933 CCCCCC(C)Sc1cc(cc2c1nccc2)OC 62a_200011218191_200010235761 [0,1,0,0,0,0|2,0,0]=3 186 B21R2.12403933 CCCCNC(=O)Nc1cc(cc2c1nccc2)OC 2430a_100000014381_100000102301 [0,1,0,0,0,0|2,0,1]=4 187 B21R2.12403933 CCCCNC(=O)Nc1cc(cc2c1nccc2)OC 512a_100000014381_100000102301 [0,1,0,0,0,0|2,0,1]=4 188 B21R2.12403933 CCCOCC(=O)Nc1cc(cc2c1nccc2)OC 11a_100000014381_100000745993 [0,1,0,0,0,0|2,0,1]=4 189 B21R2.12403933 CCCOCC(=O)Nc1cc(cc2c1nccc2)OC 1626a_100000014381_100000745993 [0,1,0,0,0,0|2,0,1]=4 190 B21R2.12403933 CCCOCC(=O)Nc1cc(cc2c1nccc2)OC 22a_100000014381_100000745993 [0,1,0,0,0,0|2,0,1]=4 191 B21R2.12403933 CCCOCC(=O)Nc1cc(cc2c1nccc2)OC 527a_100000014381_100000745993 [0,1,0,0,0,0|2,0,1]=4 192 B21R2.12403933 CCCSCC(=O)Nc1cc(cc2c1nccc2)OC 11a_100000014381_100000217233 [0,1,0,0,0,0|2,0,1]=4 193 B21R2.12403933 CCCSCC(=O)Nc1cc(cc2c1nccc2)OC 1626a_100000014381_100000217233 [0,1,0,0,0,0|2,0,1]=4 194 B21R2.12403933 CCCSCC(=O)Nc1cc(cc2c1nccc2)OC 22a_100000014381_100000217233 [0,1,0,0,0,0|2,0,1]=4 195 B21R2.12403933 CCCSCC(=O)Nc1cc(cc2c1nccc2)OC 527a_100000014381_100000217233 [0,1,0,0,0,0|2,0,1]=4 196 B21R2.12403933 CCOCCC(=O)Nc1cc(cc2c1nccc2)OC 11a_100000014381_100000749530 [0,1,0,0,0,0|2,0,1]=4 197 B21R2.12403933 CCOCCC(=O)Nc1cc(cc2c1nccc2)OC 1626a_100000014381_100000749530 [0,1,0,0,0,0|2,0,1]=4 198 B21R2.12403933 CCOCCC(=O)Nc1cc(cc2c1nccc2)OC 22a_100000014381_100000749530 [0,1,0,0,0,0|2,0,1]=4 199 B21R2.12403933 CCOCCC(=O)Nc1cc(cc2c1nccc2)OC 527a_100000014381_100000749530 [0,1,0,0,0,0|2,0,1]=4 200 B21R2.12403933 CCSCCC(=O)Nc1cc(cc2c1nccc2)OC 11a_100000014381_100000230768 [0,1,0,0,0,0|2,0,1]=4 201 B21R2.12403933 CCSCCC(=O)Nc1cc(cc2c1nccc2)OC 1626a_100000014381_100000230768 [0,1,0,0,0,0|2,0,1]=4 202 B21R2.12403933 CCSCCC(=O)Nc1cc(cc2c1nccc2)OC 22a_100000014381_100000230768 [0,1,0,0,0,0|2,0,1]=4 203 B21R2.12403933 CCSCCC(=O)Nc1cc(cc2c1nccc2)OC 527a_100000014381_100000230768 [0,1,0,0,0,0|2,0,1]=4 204 B21R2.12403933 COCCCC(=O)Nc1cc(cc2c1nccc2)OC 11a_100000014381_100000741012 [0,1,0,0,0,0|2,0,1]=4 205 B21R2.12403933 COCCCC(=O)Nc1cc(cc2c1nccc2)OC 1626a_100000014381_100000741012 [0,1,0,0,0,0|2,0,1]=4 206 B21R2.12403933 COCCCC(=O)Nc1cc(cc2c1nccc2)OC 22a_100000014381_100000741012 [0,1,0,0,0,0|2,0,1]=4 207 B21R2.12403933 COCCCC(=O)Nc1cc(cc2c1nccc2)OC 527a_100000014381_100000741012 [0,1,0,0,0,0|2,0,1]=4 208 B21R2.12403933 COc1cc(c2ncccc2c1)NC(=O)CCCC#N 11a_100000014381_100000075515 [0,1,0,0,0,0|1,0,2]=4 209 B21R2.12403933 COc1cc(c2ncccc2c1)NC(=O)CCCC#N 1626a_100000014381_100000075515 [0,1,0,0,0,0|1,0,2]=4 210 B21R2.12403933 COc1cc(c2ncccc2c1)NC(=O)CCCC#N 22a_100000014381_100000075515 [0,1,0,0,0,0|1,0,2]=4 211 B21R2.12403933 COc1cc(c2ncccc2c1)NC(=O)CCCC#N 527a_100000014381_100000075515 [0,1,0,0,0,0|1,0,2]=4 212 B21R2.12403933 COc1cc(c2ncccc2c1)NC(=O)CCCCO 1626a_100000014381_100000695505 [0,1,0,0,0,0|2,0,1]=4 213 B21R2.12403933 COc1cc(c2ncccc2c1)NC(=O)CCCSC 11a_100000014381_100000173376 [0,1,0,0,0,0|2,0,1]=4 214 B21R2.12403933 COc1cc(c2ncccc2c1)NC(=O)CCCSC 1626a_100000014381_100000173376 [0,1,0,0,0,0|2,0,1]=4 215 B21R2.12403933 COc1cc(c2ncccc2c1)NC(=O)CCCSC 22a_100000014381_100000173376 [0,1,0,0,0,0|2,0,1]=4 216 B21R2.12403933 COc1cc(c2ncccc2c1)NC(=O)CCCSC 527a_100000014381_100000173376 [0,1,0,0,0,0|2,0,1]=4 217 B21R2.12403933 COc1cc(c2ncccc2c1)NC(=O)COCCO 1626a_100000014381_100000708028 [0,1,0,0,0,0|2,0,1]=4 218 B21R2.12403933 COc1cc(c2ncccc2c1)NC(=O)NCCCF 2430a_100000014381_100015189416 [0,1,0,0,0,0|2,0,1]=4 219 B21R2.12403933 COc1cc(c2ncccc2c1)NC(=O)NCCCF 512a_100000014381_100015189416 [0,1,0,0,0,0|2,0,1]=4 220 B21R2.12403933 COc1cc(c2ncccc2c1)NC(=O)NCCCO 2430a_100000014381_100000182051 [0,1,0,0,0,0|2,0,1]=4 221 B21R2.12403933 COc1cc(c2ncccc2c1)NC(=O)NCCCO 512a_100000014381_100000182051 [0,1,0,0,0,0|2,0,1]=4 222 B21R2.12523787 CCCCC(C)C(=O)c1cc(cc2c1cccc2)OC 1458a_100010090016_200011215066 [0,1,0,0,0,0|3,0,0]=4 223 B21R2.12633461 CCCCC(C)Nc1cc(c(c2c1nccc2)F)OC 27a_100000126638_100010742067 [0,1,0,0,0,0|1,0,0]=2 224 B21R2.12633461 CCCCC(C)Sc1cc(c(c2c1nccc2)F)OC 62a_100010742067_200011215066 [0,1,0,0,0,0|2,0,0]=3 225 B21R2.12633461 CCCCC(C)Sc1cc(c(c2c1nccc2)F)OC 62a_200011215066_100010742067 [0,1,0,0,0,0|2,0,0]=3 226 B21R2.20519206 CCCCC(CC)Nc1cc(cc2c1nccc2)OC 34a_100000014381_200011216223 [0,1,0,0,0,0|1,0,0]=2 227 B21R2.20519206 CCCCC(CC)Oc1cc(cc2c1cccc2)OC 34a_200000076035_200011216223 [0,1,0,0,0,0|3,0,0]=4 228 B21R2.20519206 CCCCC(CC)Oc1cc(cc2c1cccc2)OC 7a_200000076035_200011216223 [0,1,0,0,0,0|3,0,0]=4 229 B21R2.20519206 CCCCC(CC)Sc1cc(cc2c1cccc2)OC 62a_200011216223_100010152498 [0,1,0,0,0,0|3,0,0]=4 230 B21R2.20519206 CCCCC(CC)Sc1cc(cc2c1nccc2)OC 62a_200011216223_200010235761 [0,1,0,0,0,0|2,0,0]=3 231 B21R2.20519206 CCCC[C@@H](CO)Nc1cc(cc2c1cccn2)OC 27a_100011934283_100010248855 [0,1,0,0,0,0|3,0,0]=4 232 B21R2.77017623 CCCCS(=O)(=O)Nc1cc(cc2c1nccc2)OC 232682a_100000014381_100000212082 [0,1,0,0,0,0|3,0,0]=4 233 B21R2.77017623 CCCCS(=O)(=O)Nc1cc(cc2c1nccc2)OC 40a_100000014381_100000054263 [0,1,0,0,0,0|3,0,0]=4 234 B21R2.77017623 COc1cc(c2ncccc2c1)NS(=O)(=O)CCCCl 232682a_100000014381_100000211827 [0,1,0,0,0,0|3,0,0]=4 235 B21R2.77017623 COc1cc(c2ncccc2c1)NS(=O)(=O)CCCF 232682a_100000014381_200000759752 [0,1,0,0,0,0|3,0,0]=4 236 B21R3.1031 COc1cc(c2ccccc2c1)OC3CCCCC3 34a_200000076035_100000210327 [0,0,0,1,0,0|3,0,0]=4 237 B21R3.1031 COc1cc(c2ccccc2c1)OC3CCCCC3 7a_200000076035_100000210327 [0,0,0,1,0,0|3,0,0]=4 238 B21R3.1031 COc1cc(c2ccccc2c1)OC3CCCOC3 34a_200000076035_100000693364 [0,0,0,1,0,0|3,0,0]=4 239 B21R3.1031 COc1cc(c2ccccc2c1)OC3CCCOC3 7a_200000076035_100000693364 [0,0,0,1,0,0|3,0,0]=4 240 B21R3.1031 COc1cc(c2ccccc2c1)SC3CCCCC3 62a_100000210327_100010152498 [0,0,0,1,0,0|3,0,0]=4 241 B21R3.1031 COc1cc(c2cccnc2c1)NC3CCCCC3 27a_100000182618_100010248855 [0,0,0,1,0,0|3,0,0]=4 242 B21R3.1031 COc1cc(c2cccnc2c1)NC3CCCOC3 27a_100000719290_100010248855 [0,0,0,1,0,0|3,0,0]=4 243 B21R3.1031 COc1cc(c2ncccc2c1)NC3CCCCC3 34a_100000014381_100000210327 [0,0,0,1,0,0|1,0,0]=2 244 B21R3.1031 COc1cc(c2ncccc2c1)NC3CCCOC3 34a_100000014381_100000693364 [0,0,0,1,0,0|1,0,0]=2 245 B21R3.1031 COc1cc(c2ncccc2c1)NC3CCSCC3 34a_100000014381_100000069128 [0,0,0,1,0,0|2,0,0]=3 246 B21R3.1031 COc1cc(c2ncccc2c1)SC3C=CCCC3 62a_100000751183_200010235761 [0,0,0,1,0,0|2,0,1]=4 247 B21R3.1031 COc1cc(c2ncccc2c1)SC3CCCCC3 62a_100000210327_200010235761 [0,0,0,1,0,0|2,0,0]=3 248 B21R3.35834 COc1cc(c2cccnc2c1)N3CCCCC3C 27a_100000211376_100010248855 [0,0,0,1,0,0|3,0,0]=4 249 B21R3.752183 COc1cc(c2cccnc2c1)NC(C)C3CCC3 27a_100016994624_100010248855 [0,0,0,1,0,0|3,0,0]=4 250 B21R3.752183 COc1cc(c2ncccc2c1)NC(=O)C3CCC3 11a_100000014381_100000209988 [0,0,0,1,0,0|2,0,1]=4 251 B21R3.752183 COc1cc(c2ncccc2c1)NC(=O)C3CCC3 1626a_100000014381_100000209988 [0,0,0,1,0,0|2,0,1]=4 252 B21R3.752183 COc1cc(c2ncccc2c1)NC(=O)C3CCC3 22a_100000014381_100000209988 [0,0,0,1,0,0|2,0,1]=4 253 B21R3.752183 COc1cc(c2ncccc2c1)NC(=O)C3CCC3 527a_100000014381_100000209988 [0,0,0,1,0,0|2,0,1]=4 254 B21R3.752183 COc1cc(c2ncccc2c1)NC(=O)C3CCO3 11a_100000014381_100000089072 [0,0,0,1,0,0|2,0,1]=4 255 B21R3.752183 COc1cc(c2ncccc2c1)NC(=O)C3CCO3 1626a_100000014381_100000089072 [0,0,0,1,0,0|2,0,1]=4 256 B21R3.752183 COc1cc(c2ncccc2c1)NC(=O)C3CCO3 22a_100000014381_100000089072 [0,0,0,1,0,0|2,0,1]=4 257 B21R3.752183 COc1cc(c2ncccc2c1)NC(=O)C3CCO3 527a_100000014381_100000089072 [0,0,0,1,0,0|2,0,1]=4 258 B21R3.752184 COc1cc(c2ncccc2c1)NC(=O)CC3CC3 11a_100000014381_100000738066 [0,0,0,1,0,0|2,0,1]=4 259 B21R3.752184 COc1cc(c2ncccc2c1)NC(=O)CC3CC3 1626a_100000014381_100000738066 [0,0,0,1,0,0|2,0,1]=4 260 B21R3.752184 COc1cc(c2ncccc2c1)NC(=O)CC3CC3 22a_100000014381_100000738066 [0,0,0,1,0,0|2,0,1]=4 261 B21R3.752184 COc1cc(c2ncccc2c1)NC(=O)CC3CC3 527a_100000014381_100000738066 [0,0,0,1,0,0|2,0,1]=4 262 B21R3.752197 COc1cc(c2ccccc2c1)SC3CC(C3)CO 62a_100009874164_100010152498 [0,0,0,1,0,0|3,0,0]=4 263 B21R3.752197 COc1cc(c2cccnc2c1)NC3CC(C3)CO 27a_100000095622_100010248855 [0,0,0,1,0,0|3,0,0]=4 264 B21R3.752197 COc1cc(c2ncccc2c1)SC3CC(C3)CO 62a_100009874164_200010235761 [0,0,0,1,0,0|2,0,0]=3 265 B21R3.752225 COc1cc(c2cccnc2c1)N[C@H]3CC[C@H](C3)O 27a_100015195300_100010248855 [0,0,0,1,0,0|3,0,0]=4 266 B21R3.10578484 COc1cc(c2cccnc2c1)N3C(CCC3C)C 27a_100000687148_100010248855 [0,0,0,1,0,0|3,0,0]=4 267 B21R3.10578521 COc1cc(c2ncccc2c1)NC(=O)C3CC3C 11a_100000014381_100000211227 [0,0,0,1,0,0|2,0,1]=4 268 B21R3.10578521 COc1cc(c2ncccc2c1)NC(=O)C3CC3C 1626a_100000014381_100000211227 [0,0,0,1,0,0|2,0,1]=4 269 B21R3.10578521 COc1cc(c2ncccc2c1)NC(=O)C3CC3C 22a_100000014381_100000211227 [0,0,0,1,0,0|2,0,1]=4 270 B21R3.10578521 COc1cc(c2ncccc2c1)NC(=O)C3CC3C 527a_100000014381_100000211227 [0,0,0,1,0,0|2,0,1]=4 271 B21R3.10578521 COc1cc(c2ncccc2c1)NC(=O)[C@@H]3C[C@@H]3F 11a_100000014381_100015396687 [0,0,0,1,0,0|2,0,1]=4 272 B21R3.10578521 COc1cc(c2ncccc2c1)NC(=O)[C@@H]3C[C@@H]3F 22a_100000014381_100015396687 [0,0,0,1,0,0|2,0,1]=4 273 B21R3.10578521 COc1cc(c2ncccc2c1)NC(=O)[C@@H]3C[C@@H]3F 527a_100000014381_100015396687 [0,0,0,1,0,0|2,0,1]=4 274 B19R2.4580418 CCCCC(C)Sc1cc(cc2c1cc[nH]2)OC 62a_200011215066_100010006585 [0,0,0,0,1,0|3,0,0]=4 275 B19R2.4580418 CCCCC(C)Sc1cc(cc2c1nc[nH]2)OC 62a_200011215066_100102526192 [0,0,0,0,1,0|3,0,0]=4 276 B21R2.2026771 COc1cc(c2cccnc2c1)NC[C@H](C)CCCO 27a_100160569302_100010248855 [0,0,0,0,0,1|3,0,0]=4 277 B18R2.75342 C#CCCCNc1cc(cc2c1nccc2)O 34a_100000083691_100000695029 [2,0,0,0,0,0|1,0,1]=4 278 B18R2.75342 C=CCCCNc1cc(cc2c1nccc2)O 34a_100000083691_100000757094 [2,0,0,0,0,0|1,0,1]=4 279 B18R2.75342 CCCCCNc1cc(cc2c1nccc2)Br 27a_100000209983_100010090713 [2,0,0,0,0,0|2,0,0]=4 280 B18R2.75342 CCCCCNc1cc(cc2c1nccc2)Br 34a_100009814519_100000718602 [2,0,0,0,0,0|2,0,0]=4 281 B18R2.75342 CCCCCNc1cc(cc2c1nccc2)Cl 34a_100000026717_100000718602 [2,0,0,0,0,0|2,0,0]=4 282 B18R2.75342 CCCCCNc1cc(cc2c1nccc2)F 27a_100000209983_100010214460 [2,0,0,0,0,0|2,0,0]=4 283 B18R2.75342 CCCCCNc1cc(cc2c1nccc2)F 34a_100000088212_100000718602 [2,0,0,0,0,0|2,0,0]=4 284 B18R2.75342 CCCCCNc1cc(cc2c1nccc2)O 34a_100000083691_100000718602 [2,0,0,0,0,0|1,0,0]=3 285 B18R2.75342 CCCCCOc1cc(cc2c1nccc2)C 34a_100009888445_100000718602 [2,0,0,0,0,0|2,0,0]=4 286 B18R2.75342 CCCCCOc1cc(cc2c1nccc2)C 7a_100009888445_100000210326 [2,0,0,0,0,0|2,0,0]=4 287 B18R2.75342 CCCCCSc1cc(cc2c1nccc2)C 62a_100000210326_100010113427 [2,0,0,0,0,0|2,0,0]=4 288 B18R2.75342 CCOCCNc1cc(cc2c1nccc2)O 34a_100000083691_100000210147 [2,0,0,0,0,0|2,0,0]=4 289 B18R2.75342 CCSCCNc1cc(cc2c1nccc2)O 34a_100000083691_100000757381 [2,0,0,0,0,0|2,0,0]=4 290 B18R2.75342 COCCCNc1cc(cc2c1nccc2)O 34a_100000083691_100000740836 [2,0,0,0,0,0|2,0,0]=4 291 B18R2.75342 Cc1cc(c2ncccc2c1)OCCCCF 34a_100009888445_100000729493 [2,0,0,0,0,0|2,0,0]=4 292 B18R2.75342 Cc1cc(c2ncccc2c1)OCCCCF 7a_100009888445_100000729493 [2,0,0,0,0,0|2,0,0]=4 293 B18R2.75342 Cc1cc(c2ncccc2c1)OCCCCO 34a_100009888445_100011216708 [2,0,0,0,0,0|2,0,0]=4 294 B18R2.75342 Cc1cc(c2ncccc2c1)OCCCCO 7a_100009888445_100000210776 [2,0,0,0,0,0|2,0,0]=4 295 B18R2.75342 Cc1cc(c2ncccc2c1)SCCCCF 62a_100000729493_100010113427 [2,0,0,0,0,0|2,0,0]=4 296 B18R2.75342 Cc1cc(c2ncccc2c1)SCCCCO 62a_100000210776_100010113427 [2,0,0,0,0,0|2,0,0]=4 297 B18R2.75342 FCCCCNc1cc(cc2c1nccc2)Br 34a_100009814519_100000729493 [2,0,0,0,0,0|2,0,0]=4 298 B18R2.75342 FCCCCNc1cc(cc2c1nccc2)Cl 34a_100000026717_100000729493 [2,0,0,0,0,0|2,0,0]=4 299 B18R2.75342 FCCCCNc1cc(cc2c1nccc2)F 34a_100000088212_100000729493 [2,0,0,0,0,0|2,0,0]=4 300 B18R2.75342 OCCCCNc1cc(cc2c1nccc2)Br 27a_100000750430_100010090713 [2,0,0,0,0,0|2,0,0]=4 301 B18R2.75342 OCCCCNc1cc(cc2c1nccc2)Br 34a_100009814519_100011216708 [2,0,0,0,0,0|2,0,0]=4 302 B18R2.75342 OCCCCNc1cc(cc2c1nccc2)Cl 34a_100000026717_100011216708 [2,0,0,0,0,0|2,0,0]=4 303 B18R2.75342 OCCCCNc1cc(cc2c1nccc2)F 27a_100000750430_100010214460 [2,0,0,0,0,0|2,0,0]=4 304 B18R2.75342 OCCCCNc1cc(cc2c1nccc2)F 34a_100000088212_100011216708 [2,0,0,0,0,0|2,0,0]=4 305 B18R2.75342 OCCCCNc1cc(cc2c1nccc2)O 34a_100000083691_100011216708 [2,0,0,0,0,0|1,0,0]=3 306 B18R2.75342 Oc1cc(c2ncccc2c1)NCCCCF 34a_100000083691_100000729493 [2,0,0,0,0,0|1,0,0]=3 307 B18R2.124786 CC(CCO)Nc1cc(cc2c1nccc2)Br 34a_100009814519_100009893172 [2,0,0,0,0,0|2,0,0]=4 308 B18R2.124786 CC(CCO)Nc1cc(cc2c1nccc2)Cl 34a_100000026717_100009893172 [2,0,0,0,0,0|2,0,0]=4 309 B18R2.124786 CC(CCO)Nc1cc(cc2c1nccc2)F 34a_100000088212_100009893172 [2,0,0,0,0,0|2,0,0]=4 310 B18R2.124786 CC(CCO)Nc1cc(cc2c1nccc2)O 34a_100000083691_100009893172 [2,0,0,0,0,0|1,0,0]=3 311 B18R2.124786 CCCC(=O)Nc1cc(cc2c1nccc2)O 527a_100000083691_100000211992 [2,0,0,0,0,0|1,0,1]=4 312 B18R2.124786 CCCC(C)Nc1cc(cc2c1cccc2)Br 34a_100010171453_100000766640 [2,0,0,0,0,0|2,0,0]=4 313 B18R2.124786 CCCC(C)Nc1cc(cc2c1nccc2)Br 27a_100000741246_100010090713 [2,0,0,0,0,0|1,0,0]=3 314 B18R2.124786 CCCC(C)Nc1cc(cc2c1nccc2)Br 34a_100009814519_100000766640 [2,0,0,0,0,0|1,0,0]=3 315 B18R2.124786 CCCC(C)Nc1cc(cc2c1nccc2)Cl 34a_100000026717_100000766640 [2,0,0,0,0,0|1,0,0]=3 316 B18R2.124786 CCCC(C)Nc1cc(cc2c1nccc2)F 27a_100000741246_100010214460 [2,0,0,0,0,0|1,0,0]=3 317 B18R2.124786 CCCC(C)Nc1cc(cc2c1nccc2)F 34a_100000088212_100000766640 [2,0,0,0,0,0|1,0,0]=3 318 B18R2.124786 CCCC(C)Nc1cc(cc2c1nccc2)O 34a_100000083691_100000766640 [2,0,0,0,0,0|0,0,0]=2 319 B18R2.124786 CCCC(C)Nc1cc(cc2c1nccn2)F 27a_100000741246_100011083936 [2,0,0,0,0,0|2,0,0]=4 320 B18R2.124786 CCCC(C)Nc1cc(nc2c1cccc2)C 27a_100000741246_100000735862 [2,0,0,0,0,0|2,0,0]=4 321 B18R2.124786 CCCC(C)Nc1nc(cc2c1cccc2)C 27a_100000741246_100000698243 [2,0,0,0,0,0|2,0,0]=4 322 B18R2.124786 CCCC(C)Nc1nc(cc2c1nccc2)N 27a_100000741246_100010205410 [2,0,0,0,0,0|2,0,0]=4 323 B18R2.124786 CCCC(C)Oc1cc(cc2c1nccc2)Br 34a_100010248853_100000766640 [2,0,0,0,0,0|2,0,0]=4 324 B18R2.124786 CCCC(C)Oc1cc(cc2c1nccc2)Br 7a_100010248853_100000766640 [2,0,0,0,0,0|2,0,0]=4 325 B18R2.124786 CCCC(C)Oc1cc(cc2c1nccc2)C 34a_100009888445_100000766640 [2,0,0,0,0,0|1,0,0]=3 326 B18R2.124786 CCCC(C)Oc1cc(cc2c1nccc2)C 7a_100009888445_100000766640 [2,0,0,0,0,0|1,0,0]=3 327 B18R2.124786 CCCC(C)Oc1cc(cc2c1nccc2)Cl 34a_200000089624_100000766640 [2,0,0,0,0,0|2,0,0]=4 328 B18R2.124786 CCCC(C)Oc1cc(cc2c1nccc2)Cl 7a_200000089624_100000766640 [2,0,0,0,0,0|2,0,0]=4 329 B18R2.124786 CCCC(C)Sc1cc(cc2c1cccc2)O 62a_100000766640_100010001680 [2,0,0,0,0,0|2,0,0]=4 330 B18R2.124786 CCCC(C)Sc1cc(cc2c1nccc2)Br 62a_100000766640_100010090713 [2,0,0,0,0,0|2,0,0]=4 331 B18R2.124786 CCCC(C)Sc1cc(cc2c1nccc2)Br 62a_100010090713_100000766640 [2,0,0,0,0,0|2,0,0]=4 332 B18R2.124786 CCCC(C)Sc1cc(cc2c1nccc2)C 62a_100000766640_100010113427 [2,0,0,0,0,0|1,0,0]=3 333 B18R2.124786 CCCC(C)Sc1cc(cc2c1nccc2)F 62a_100000766640_100010214460 [2,0,0,0,0,0|2,0,0]=4 334 B18R2.124786 CCCC(C)Sc1cc(cc2c1nccc2)F 62a_100010214460_100000766640 [2,0,0,0,0,0|2,0,0]=4 335 B18R2.124786 COCC(C)Nc1cc(cc2c1nccc2)Br 34a_100009814519_100000765312 [2,0,0,0,0,0|2,0,0]=4 336 B18R2.124786 COCC(C)Nc1cc(cc2c1nccc2)Cl 34a_100000026717_100000765312 [2,0,0,0,0,0|2,0,0]=4 337 B18R2.124786 COCC(C)Nc1cc(cc2c1nccc2)F 34a_100000088212_100000765312 [2,0,0,0,0,0|2,0,0]=4 338 B18R2.124786 COCC(C)Nc1cc(cc2c1nccc2)O 34a_100000083691_100000765312 [2,0,0,0,0,0|1,0,0]=3 339 B18R2.124786 COCC(C)Oc1cc(cc2c1nccc2)C 34a_100009888445_100000765312 [2,0,0,0,0,0|2,0,0]=4 340 B18R2.124786 COCC(C)Oc1cc(cc2c1nccc2)C 7a_100009888445_100000765312 [2,0,0,0,0,0|2,0,0]=4 341 B18R2.124786 COCC(C)Sc1cc(cc2c1nccc2)C 62a_100000765312_100010113427 [2,0,0,0,0,0|2,0,0]=4 342 B18R2.124786 COC[C@@H](C)Nc1cc(cc2c1nccc2)Br 27a_100000764878_100010090713 [2,0,0,0,0,0|2,0,0]=4 343 B18R2.124786 COC[C@@H](C)Nc1cc(cc2c1nccc2)F 27a_100000764878_100010214460 [2,0,0,0,0,0|2,0,0]=4 344 B18R2.124786 C[C@H](CCO)Nc1cc(cc2c1nccc2)Br 27a_100000706166_100010090713 [2,0,0,0,0,0|2,0,0]=4 345 B18R2.124786 C[C@H](CCO)Nc1cc(cc2c1nccc2)F 27a_100000706166_100010214460 [2,0,0,0,0,0|2,0,0]=4 346 B18R2.124786 Cc1cc(c2ncccc2c1)OC(C)CCO 34a_100009888445_100009893172 [2,0,0,0,0,0|2,0,0]=4 347 B18R2.124786 Cc1cc(c2ncccc2c1)OC(C)CCO 7a_100009888445_100009893172 [2,0,0,0,0,0|2,0,0]=4 348 B18R2.124786 Cc1cc(c2ncccc2c1)SC(C)CCO 62a_100009893172_100010113427 [2,0,0,0,0,0|2,0,0]=4 349 B18R2.883208 CCCCC(C)Nc1cccc2c1cccc2 34a_100000185869_200011215066 [2,0,0,0,0,0|2,0,0]=4 350 B18R2.883208 CCCCC(C)Nc1cccc2c1nccc2 34a_100000181377_200011215066 [2,0,0,0,0,0|1,0,0]=3 351 B18R2.883208 CCCCC(C)Nc1cccc2c1nccn2 27a_100000126638_100010003881 [2,0,0,0,0,0|2,0,0]=4 352 B18R2.883208 CCCCC(C)Nc1cccc2c1ncnc2 27a_100000126638_100010246313 [2,0,0,0,0,0|2,0,0]=4 353 B18R2.883208 CCCCC(C)Nc1nccc2c1nccc2 27a_100000126638_100010063729 [2,0,0,0,0,0|2,0,0]=4 354 B18R2.883208 CCCCC(C)Oc1cccc2c1nccc2 34a_100000056035_200011215066 [2,0,0,0,0,0|2,0,0]=4 355 B18R2.883208 CCCCC(C)Sc1cccc2c1nccc2 62a_200011215066_100011215545 [2,0,0,0,0,0|2,0,0]=4 356 B18R2.179959 C#CCCNc1cc(cc2c1nccc2)OC 34a_100000014381_100000688953 [2,0,0,0,0,0|0,0,2]=4 357 B18R2.179959 C/C=C/CNc1cc(cc2c1nccc2)OC 34a_100000014381_100102629194 [2,0,0,0,0,0|0,0,2]=4 358 B18R2.179959 C=CCCNc1cc(cc2c1nccc2)OC 34a_100000014381_100000754431 [2,0,0,0,0,0|0,0,2]=4 359 B18R2.179959 CC#CCNc1cc(cc2c1nccc2)OC 34a_100000014381_100000748600 [2,0,0,0,0,0|0,0,2]=4 360 B18R2.179959 CC=CCNc1cc(cc2c1nccc2)OC 34a_100000014381_100000070051 [2,0,0,0,0,0|0,0,2]=4 361 B18R2.179959 CCCC=Cc1cc(cc2c1nccc2)OC 271570a_100016258520_200010235761 [2,0,0,0,0,0|1,0,1]=4 362 B18R2.179959 CCCCNc1cc(cc2c1cccn2)OC 27a_100000102301_100010248855 [2,0,0,0,0,0|2,0,0]=4 363 B18R2.179959 CCCCNc1cc(cc2c1nccc2)OC 34a_100000014381_100000210210 [2,0,0,0,0,0|0,0,0]=2 364 B18R2.179959 CCCCOc1cc(cc2c1cccc2)OC 34a_200000076035_100000210210 [2,0,0,0,0,0|2,0,0]=4 365 B18R2.179959 CCCCOc1cc(cc2c1cccc2)OC 7a_200000076035_100000210211 [2,0,0,0,0,0|2,0,0]=4 366 B18R2.179959 CCCCSc1cc(cc2c1cccc2)OC 62a_100000210211_100010152498 [2,0,0,0,0,0|2,0,0]=4 367 B18R2.179959 CCCCSc1cc(cc2c1nccc2)OC 62a_100000210211_200010235761 [2,0,0,0,0,0|1,0,0]=3 368 B18R2.179959 CCOCSc1cc(cc2c1nccc2)OC 62a_100000739092_200010235761 [2,0,0,0,0,0|2,0,0]=4 369 B18R2.179959 COCCNc1cc(cc2c1nccc2)OC 34a_100000014381_100011201679 [2,0,0,0,0,0|1,0,0]=3 370 B18R2.179959 COCCSc1cc(cc2c1nccc2)OC 62a_100000233755_200010235761 [2,0,0,0,0,0|2,0,0]=4 371 B18R2.179959 COc1cc(c2ncccc2c1)NCCCF 34a_100000014381_100011934791 [2,0,0,0,0,0|1,0,0]=3 372 B18R2.179959 COc1cc(c2ncccc2c1)NCCCO 34a_100000014381_100000230001 [2,0,0,0,0,0|1,0,0]=3 373 B18R2.179959 COc1cc(c2ncccc2c1)NCCSC 34a_100000014381_100000212216 [2,0,0,0,0,0|1,0,0]=3 374 B18R2.179959 COc1cc(c2ncccc2c1)SCCCF 62a_100011934791_200010235761 [2,0,0,0,0,0|2,0,0]=4 375 B18R2.179959 COc1cc(c2ncccc2c1)SCCCO 62a_100011215043_200010235761 [2,0,0,0,0,0|2,0,0]=4 376 B18R2.179959 COc1cc(c2ncccc2c1)SCCSC 62a_100000212216_200010235761 [2,0,0,0,0,0|2,0,0]=4 377 B18R2.744 C#CC(C)Nc1cc(cc2c1nccc2)OC 34a_100000014381_200000035995 [2,0,0,0,0,0|0,0,2]=4 378 B18R2.744 CCC(=O)Nc1cc(cc2c1nccc2)OC 11a_100000014381_100000210414 [2,0,0,0,0,0|1,0,1]=4 379 B18R2.744 CCC(=O)Nc1cc(cc2c1nccc2)OC 1626a_100000014381_100000210414 [2,0,0,0,0,0|1,0,1]=4 380 B18R2.744 CCC(=O)Nc1cc(cc2c1nccc2)OC 22a_100000014381_100000210414 [2,0,0,0,0,0|1,0,1]=4 381 B18R2.744 CCC(=O)Nc1cc(cc2c1nccc2)OC 527a_100000014381_100000210414 [2,0,0,0,0,0|1,0,1]=4 382 B18R2.744 CCC(C)Nc1cc(cc2c1nccc2)OC 34a_100000014381_100011215416 [2,0,0,0,0,0|0,0,0]=2 383 B18R2.744 CCC(C)Oc1cc(cc2c1cccc2)OC 34a_200000076035_100011215416 [2,0,0,0,0,0|2,0,0]=4 384 B18R2.744 CCC(C)Oc1cc(cc2c1cccc2)OC 7a_200000076035_100000758301 [2,0,0,0,0,0|2,0,0]=4 385 B18R2.744 CCC(C)Sc1cc(cc2c1cccc2)OC 62a_100000758301_100010152498 [2,0,0,0,0,0|2,0,0]=4 386 B18R2.744 CCC(C)Sc1cc(cc2c1nccc2)OC 62a_100000758301_200010235761 [2,0,0,0,0,0|1,0,0]=3 387 B18R2.744 COc1cc(c2ncccc2c1)NC(C)CO 34a_100000014381_100012180447 [2,0,0,0,0,0|1,0,0]=3 388 B18R2.744 COc1cc(c2ncccc2c1)SC(C)CO 62a_100012180447_200010235761 [2,0,0,0,0,0|2,0,0]=4 389 B18R2.744 COc1cc(c2ncccc2c1)SC(C)OC 62a_100009879195_200010235761 [2,0,0,0,0,0|2,0,0]=4 390 B18R2.744 COc1cc(c2ncccc2c1)S[C@H](C)CO 62a_100016084084_200010235761 [2,0,0,0,0,0|2,0,0]=4 391 B20R2.8544 CC(C)CCC(C)Nc1cc(cc2c1nccc2)Br 27a_100138410893_100010090713 [1,1,0,0,0,0|2,0,0]=4 392 B20R2.8544 CC(C)CCC(C)Nc1cc(cc2c1nccc2)Br 34a_100009814519_100011261404 [1,1,0,0,0,0|2,0,0]=4 393 B20R2.8544 CC(C)CCC(C)Nc1cc(cc2c1nccc2)Cl 34a_100000026717_100011261404 [1,1,0,0,0,0|2,0,0]=4 394 B20R2.8544 CC(C)CCC(C)Nc1cc(cc2c1nccc2)F 27a_100138410893_100010214460 [1,1,0,0,0,0|2,0,0]=4 395 B20R2.8544 CC(C)CCC(C)Nc1cc(cc2c1nccc2)F 34a_100000088212_100011261404 [1,1,0,0,0,0|2,0,0]=4 396 B20R2.8544 CC(C)CCC(C)Nc1cc(cc2c1nccc2)O 34a_100000083691_100011261404 [1,1,0,0,0,0|1,0,0]=3 397 B20R2.8544 Cc1cc(c2ncccc2c1)OC(C)CCC(C)C 34a_100009888445_100011261404 [1,1,0,0,0,0|2,0,0]=4 398 B20R2.8544 Cc1cc(c2ncccc2c1)SC(C)CCC(C)C 62a_100011261404_100010113427 [1,1,0,0,0,0|2,0,0]=4 399 B20R2.828869 CCCCC(CC)Nc1cc(cc2c1nccc2)Br 34a_100009814519_200011216223 [1,1,0,0,0,0|2,0,0]=4 400 B20R2.828869 CCCCC(CC)Nc1cc(cc2c1nccc2)Cl 34a_100000026717_200011216223 [1,1,0,0,0,0|2,0,0]=4 401 B20R2.828869 CCCCC(CC)Nc1cc(cc2c1nccc2)F 34a_100000088212_200011216223 [1,1,0,0,0,0|2,0,0]=4 402 B20R2.828869 CCCCC(CC)Nc1cc(cc2c1nccc2)O 34a_100000083691_200011216223 [1,1,0,0,0,0|1,0,0]=3 403 B20R2.828869 CCCCC(CC)Oc1cc(cc2c1nccc2)C 34a_100009888445_200011216223 [1,1,0,0,0,0|2,0,0]=4 404 B20R2.828869 CCCCC(CC)Oc1cc(cc2c1nccc2)C 7a_100009888445_200011216223 [1,1,0,0,0,0|2,0,0]=4 405 B20R2.828869 CCCCC(CC)Sc1cc(cc2c1nccc2)C 62a_200011216223_100010113427 [1,1,0,0,0,0|2,0,0]=4 406 B20R2.828869 CCCC[C@@H](CO)Nc1cc(cc2c1nccc2)Br 27a_100011934283_100010090713 [1,1,0,0,0,0|2,0,0]=4 407 B20R2.828869 CCCC[C@@H](CO)Nc1cc(cc2c1nccc2)F 27a_100011934283_100010214460 [1,1,0,0,0,0|2,0,0]=4 408 B20R2.1364642 CCC(C)CC(C)Nc1cc(cc2c1nccc2)Br 27a_100000763565_100010090713 [1,1,0,0,0,0|2,0,0]=4 409 B20R2.1364642 CCC(C)CC(C)Nc1cc(cc2c1nccc2)F 27a_100000763565_100010214460 [1,1,0,0,0,0|2,0,0]=4 410 B20R2.2719388 CCCCCC(C)Nc1cc(cc2c1nccc2)Br 27a_100000211957_100010090713 [1,1,0,0,0,0|2,0,0]=4 411 B20R2.2719388 CCCCCC(C)Nc1cc(cc2c1nccc2)Br 34a_100009814519_200011218191 [1,1,0,0,0,0|2,0,0]=4 412 B20R2.2719388 CCCCCC(C)Nc1cc(cc2c1nccc2)Cl 34a_100000026717_200011218191 [1,1,0,0,0,0|2,0,0]=4 413 B20R2.2719388 CCCCCC(C)Nc1cc(cc2c1nccc2)F 27a_100000211957_100010214460 [1,1,0,0,0,0|2,0,0]=4 414 B20R2.2719388 CCCCCC(C)Nc1cc(cc2c1nccc2)F 34a_100000088212_200011218191 [1,1,0,0,0,0|2,0,0]=4 415 B20R2.2719388 CCCCCC(C)Nc1cc(cc2c1nccc2)O 34a_100000083691_200011218191 [1,1,0,0,0,0|1,0,0]=3 416 B20R2.2719388 CCCCCC(C)Oc1cc(cc2c1nccc2)C 34a_100009888445_200011218191 [1,1,0,0,0,0|2,0,0]=4 417 B20R2.2719388 CCCCCC(C)Oc1cc(cc2c1nccc2)C 7a_100009888445_200011218191 [1,1,0,0,0,0|2,0,0]=4 418 B20R2.2719388 CCCCCC(C)Sc1cc(cc2c1nccc2)C 62a_200011218191_100010113427 [1,1,0,0,0,0|2,0,0]=4 419 B20R2.18597 COc1cc(c2ncccc2c1)NCCCC(=O)C 34a_100000014381_100000685027 [1,1,0,0,0,0|1,0,1]=4 420 B20R2.18597 COc1cc(c2ncccc2c1)NCCCC(=O)N 34a_100000014381_100102525003 [1,1,0,0,0,0|0,0,1]=3 421 B20R2.18597 COc1cc(c2ncccc2c1)NCCCC(C)C 34a_100000014381_100011214892 [1,1,0,0,0,0|1,0,0]=3 422 B20R2.18597 COc1cc(c2ncccc2c1)NCCCC(C)O 34a_100000014381_200000718107 [1,1,0,0,0,0|1,0,0]=3 423 B20R2.18597 COc1cc(c2ncccc2c1)NCCOC(=O)N 34a_100000014381_200011214921 [1,1,0,0,0,0|1,0,1]=4 424 B20R2.18597 COc1cc(c2ncccc2c1)NCCOC(C)C 34a_100000014381_100000211751 [1,1,0,0,0,0|2,0,0]=4 425 B20R2.18597 COc1cc(c2ncccc2c1)NCCSC(C)C 34a_100000014381_100000730970 [1,1,0,0,0,0|2,0,0]=4 426 B20R2.18597 COc1cc(c2ncccc2c1)SCCCC(=O)N 62a_100102525003_200010235761 [1,1,0,0,0,0|1,0,1]=4 427 B20R2.18597 COc1cc(c2ncccc2c1)SCCCC(C)C 62a_100011214892_200010235761 [1,1,0,0,0,0|2,0,0]=4 428 B20R2.18597 COc1cc(c2ncccc2c1)SCCCC(C)O 62a_200000718107_200010235761 [1,1,0,0,0,0|2,0,0]=4 429 B20R2.845842 C#CCCCNc1cc(c(c2c1nccc2)F)OC 27a_100000718082_100010742067 [1,1,0,0,0,0|1,0,1]=4 430 B20R2.845842 C=CCCCNc1cc(c(c2c1nccc2)F)OC 27a_100000700776_100010742067 [1,1,0,0,0,0|1,0,1]=4 431 B20R2.845842 CCCCCNc1cc(c(c2c1nccc2)F)OC 27a_100000209983_100010742067 [1,1,0,0,0,0|1,0,0]=3 432 B20R2.845842 CCCCCSc1cc(c(c2c1nccc2)F)OC 62a_100000210326_100010742067 [1,1,0,0,0,0|2,0,0]=4 433 B20R2.845842 CCCCCSc1cc(c(c2c1nccc2)F)OC 62a_100010742067_100000210326 [1,1,0,0,0,0|2,0,0]=4 434 B20R2.845842 CCOCCNc1cc(c(c2c1nccc2)F)OC 27a_100011200944_100010742067 [1,1,0,0,0,0|2,0,0]=4 435 B20R2.845842 CCSCCNc1cc(c(c2c1nccc2)F)OC 27a_100000106463_100010742067 [1,1,0,0,0,0|2,0,0]=4 436 B20R2.845842 COCCCNc1cc(c(c2c1nccc2)F)OC 27a_100150723488_100010742067 [1,1,0,0,0,0|2,0,0]=4 437 B20R2.845842 COc1cc(c2ncccc2c1F)NCCCCO 27a_100000750430_100010742067 [1,1,0,0,0,0|1,0,0]=3 438 B20R2.845842 COc1cc(c2ncccc2c1F)NCCCSC 27a_100000749238_100010742067 [1,1,0,0,0,0|2,0,0]=4 439 B20R2.845842 COc1cc(c2ncccc2c1F)SCCCCF 62a_100000729493_100010742067 [1,1,0,0,0,0|2,0,0]=4 440 B20R2.845842 COc1cc(c2ncccc2c1F)SCCCCF 62a_100010742067_100000729493 [1,1,0,0,0,0|2,0,0]=4 441 B20R2.845842 COc1cc(c2ncccc2c1F)SCCCCO 62a_100000210776_100010742067 [1,1,0,0,0,0|2,0,0]=4 442 B20R2.845842 COc1cc(c2ncccc2c1F)SCCCCO 62a_100010742067_100000210776 [1,1,0,0,0,0|2,0,0]=4 443 B20R2.1018945 CCCC(C)CNc1cc(cc2c1nccc2)OC 34a_100000014381_100011216630 [1,1,0,0,0,0|1,0,0]=3 444 B20R2.1018945 CCCC(C)CSc1cc(cc2c1nccc2)OC 62a_100011216630_200010235761 [1,1,0,0,0,0|2,0,0]=4 445 B20R2.1018945 COCC(O)CNc1cc(cc2c1nccc2)OC 34a_100000014381_100011215053 [1,1,0,0,0,0|2,0,0]=4 446 B20R2.1439521 C#CCCCCNc1cc(cc2c1nccc2)OC 34a_100000014381_100010269958 [1,1,0,0,0,0|1,0,0]=3 447 B20R2.1439521 C#CCCCCSc1cc(cc2c1nccc2)OC 62a_100010269958_200010235761 [1,1,0,0,0,0|2,0,0]=4 448 B20R2.1439521 C#CCOCCNc1cc(cc2c1nccc2)OC 34a_100000014381_100010402529 [1,1,0,0,0,0|1,0,1]=4 449 B20R2.1439521 C=CCCCCNc1cc(cc2c1nccc2)OC 34a_100000014381_100011215482 [1,1,0,0,0,0|1,0,0]=3 450 B20R2.1439521 C=CCCCCSc1cc(cc2c1nccc2)OC 62a_100011215482_200010235761 [1,1,0,0,0,0|2,0,0]=4 451 B20R2.1439521 CC/C=C\CCNc1cc(cc2c1nccc2)OC 34a_100000014381_100015370543 [1,1,0,0,0,0|1,0,1]=4 452 B20R2.1439521 CCCCCC=Cc1cc(cc2c1nccc2)OC 271570a_100000062253_200010235761 [1,1,0,0,0,0|2,0,0]=4 453 B20R2.1439521 CCCCCCNc1cc(cc2c1nccc2)OC 34a_100000014381_100000210314 [1,1,0,0,0,0|1,0,0]=3 454 B20R2.1439521 CCCCCCSc1cc(cc2c1nccc2)OC 62a_100000210314_200010235761 [1,1,0,0,0,0|2,0,0]=4 455 B20R2.1439521 CCCCOCNc1cc(cc2c1nccc2)OC 34a_100000014381_100011995733 [1,1,0,0,0,0|1,0,0]=3 456 B20R2.1439521 CCCCOCSc1cc(cc2c1nccc2)OC 62a_100011995733_200010235761 [1,1,0,0,0,0|2,0,0]=4 457 B20R2.1439521 CCCOCCNc1cc(cc2c1nccc2)OC 34a_100000014381_100011215938 [1,1,0,0,0,0|1,0,0]=3 458 B20R2.1439521 CCCOCCSc1cc(cc2c1nccc2)OC 62a_100011215938_200010235761 [1,1,0,0,0,0|2,0,0]=4 459 B20R2.1439521 CCOCCCNc1cc(cc2c1nccc2)OC 34a_100000014381_100012232248 [1,1,0,0,0,0|1,0,0]=3 460 B20R2.1439521 CCOCCCSc1cc(cc2c1nccc2)OC 62a_100012232248_200010235761 [1,1,0,0,0,0|2,0,0]=4 461 B20R2.1439521 COCCCCNc1cc(cc2c1nccc2)OC 34a_100000014381_100000755781 [1,1,0,0,0,0|1,0,0]=3 462 B20R2.1439521 COCCCCSc1cc(cc2c1nccc2)OC 62a_100000730899_200010235761 [1,1,0,0,0,0|2,0,0]=4 463 B20R2.1439521 COc1cc(c2ncccc2c1)NCCCCCF 34a_100000014381_100000729378 [1,1,0,0,0,0|1,0,0]=3 464 B20R2.1439521 COc1cc(c2ncccc2c1)NCCCCCO 34a_100000014381_100000746330 [1,1,0,0,0,0|1,0,0]=3 465 B20R2.1439521 COc1cc(c2ncccc2c1)NCCOCCO 34a_100000014381_100000692535 [1,1,0,0,0,0|1,0,0]=3 466 B20R2.1439521 COc1cc(c2ncccc2c1)SCCCCC#N 62a_100011219923_200010235761 [1,1,0,0,0,0|1,0,1]=4 467 B20R2.1439521 COc1cc(c2ncccc2c1)SCCCCC=O 62a_100000139335_200010235761 [1,1,0,0,0,0|2,0,0]=4 468 B20R2.1439521 COc1cc(c2ncccc2c1)SCCCCCF 62a_100000729378_200010235761 [1,1,0,0,0,0|2,0,0]=4 469 B20R2.1439521 COc1cc(c2ncccc2c1)SCCCCCO 62a_100000746330_200010235761 [1,1,0,0,0,0|2,0,0]=4 470 B20R2.1439521 COc1cc(c2ncccc2c1)SCCOCCO 62a_100011215305_200010235761 [1,1,0,0,0,0|2,0,0]=4 471 B20R2.18596 CCC(=O)C(C)Sc1cc(cc2c1nccc2)OC 62a_100000742827_200010235761 [1,1,0,0,0,0|1,0,1]=4 472 B20R2.18596 CCC(C)C(=O)Nc1cc(cc2c1nccc2)OC 11a_100000014381_100011192722 [1,1,0,0,0,0|1,0,1]=4 473 B20R2.18596 CCC(C)C(=O)Nc1cc(cc2c1nccc2)OC 1626a_100000014381_100011192722 [1,1,0,0,0,0|1,0,1]=4 474 B20R2.18596 CCC(C)C(=O)Nc1cc(cc2c1nccc2)OC 22a_100000014381_100011192722 [1,1,0,0,0,0|1,0,1]=4 475 B20R2.18596 CCC(C)C(=O)Nc1cc(cc2c1nccc2)OC 527a_100000014381_100011192722 [1,1,0,0,0,0|1,0,1]=4 476 B20R2.18596 CCC(O)C(=O)Nc1cc(cc2c1nccc2)OC 22a_100000014381_100011196387 [1,1,0,0,0,0|1,0,1]=4 477 B20R2.18596 CNC(=O)C(C)Nc1cc(cc2c1nccc2)OC 34a_100000014381_100000731044 [1,1,0,0,0,0|1,0,1]=4 478 B20R2.18596 COC(=O)C(C)Nc1cc(cc2c1nccc2)OC 34a_100000014381_100000211248 [1,1,0,0,0,0|1,0,1]=4 479 B20R2.278533 COc1cc(c2ccccc2c1)OC(C)CC(C)C 34a_200000076035_100000731052 [1,1,0,0,0,0|2,0,0]=4 480 B20R2.278533 COc1cc(c2ccccc2c1)OC(C)CC(C)C 7a_200000076035_100000731052 [1,1,0,0,0,0|2,0,0]=4 481 B20R2.278533 COc1cc(c2ccccc2c1)SC(C)CC(C)C 62a_100000731052_100010152498 [1,1,0,0,0,0|2,0,0]=4 482 B20R2.278533 COc1cc(c2cccnc2c1)NC(C)CC(C)C 27a_100000692259_100010248855 [1,1,0,0,0,0|2,0,0]=4 483 B20R2.278533 COc1cc(c2ncccc2c1)NC(=O)CC(C)C 11a_100000014381_100000210554 [1,1,0,0,0,0|1,0,1]=4 484 B20R2.278533 COc1cc(c2ncccc2c1)NC(=O)CC(C)C 1626a_100000014381_100000210554 [1,1,0,0,0,0|1,0,1]=4 485 B20R2.278533 COc1cc(c2ncccc2c1)NC(=O)CC(C)C 22a_100000014381_100000210554 [1,1,0,0,0,0|1,0,1]=4 486 B20R2.278533 COc1cc(c2ncccc2c1)NC(=O)CC(C)C 527a_100000014381_100000210554 [1,1,0,0,0,0|1,0,1]=4 487 B20R2.278533 COc1cc(c2ncccc2c1)NC(=O)C[C@@H](C)O 22a_100000014381_100011933948 [1,1,0,0,0,0|1,0,1]=4 488 B20R2.278533 COc1cc(c2ncccc2c1)NC(C)CC(C)C 34a_100000014381_100000731052 [1,1,0,0,0,0|0,0,0]=2 489 B20R2.278533 COc1cc(c2ncccc2c1)SC(C)CC(C)C 62a_100000731052_200010235761 [1,1,0,0,0,0|1,0,0]=3 490 B20R2.278533 COc1cc(c2ncccc2c1)SC(C)CN(C)C 62a_100020606517_200010235761 [1,1,0,0,0,0|2,0,0]=4 491 B20R2.2064823 CCCC(C)Nc1cc(c(c2c1nccc2)F)OC 27a_100000741246_100010742067 [1,1,0,0,0,0|0,0,0]=2 492 B20R2.2064823 CCCC(C)Sc1cc(c(c2c1nccc2)F)OC 62a_100000766640_100010742067 [1,1,0,0,0,0|1,0,0]=3 493 B20R2.2064823 CCCC(C)Sc1cc(c(c2c1nccc2)F)OC 62a_100010742067_100000766640 [1,1,0,0,0,0|1,0,0]=3 494 B20R2.2064823 COCC(C)Sc1cc(c(c2c1nccc2)F)OC 62a_100000765312_100010742067 [1,1,0,0,0,0|2,0,0]=4 495 B20R2.2064823 COCC(C)Sc1cc(c(c2c1nccc2)F)OC 62a_100010742067_100000765312 [1,1,0,0,0,0|2,0,0]=4 496 B20R2.2064823 COC[C@@H](C)Nc1cc(c(c2c1nccc2)F)OC 27a_100000764878_100010742067 [1,1,0,0,0,0|1,0,0]=3 497 B20R2.2064823 COc1cc(c2ncccc2c1F)N[C@@H](C)CC#N 27a_100016994482_100010742067 [1,1,0,0,0,0|0,0,2]=4 498 B20R2.2064823 COc1cc(c2ncccc2c1F)N[C@H](C)CCO 27a_100000706166_100010742067 [1,1,0,0,0,0|1,0,0]=3 499 B20R2.2064823 COc1cc(c2ncccc2c1F)SC(C)CCO 62a_100009893172_100010742067 [1,1,0,0,0,0|2,0,0]=4 500 B20R2.2064823 COc1cc(c2ncccc2c1F)SC(C)CCO 62a_100010742067_100009893172 [1,1,0,0,0,0|2,0,0]=4 501 B20R2.4008055 CCCC(CC)Nc1cc(cc2c1cccn2)OC 27a_100000747048_100010248855 [1,1,0,0,0,0|2,0,0]=4 502 B20R2.4008055 CCCC(CC)Oc1cc(cc2c1cccc2)OC 7a_200000076035_100011219200 [1,1,0,0,0,0|2,0,0]=4 503 B20R2.4008055 CCCC(CC)Sc1cc(cc2c1cccc2)OC 62a_100011219200_100010152498 [1,1,0,0,0,0|2,0,0]=4 504 B20R2.4008055 CCCC(CC)Sc1cc(cc2c1nccc2)OC 62a_100011219200_200010235761 [1,1,0,0,0,0|1,0,0]=3 505 B20R2.4008055 CCC[C@@H](CO)Nc1cc(cc2c1cccn2)OC 27a_100000732646_100010248855 [1,1,0,0,0,0|2,0,0]=4 506 B20R2.5216529 CCCC(C)C(=O)c1cc(cc2c1cccc2)OC 1458a_100010090016_100000766640 [1,1,0,0,0,0|2,0,0]=4 507 B20R2.30227524 CCCS(=O)(=O)Nc1cc(cc2c1nccc2)OC 232682a_100000014381_100000211391 [1,1,0,0,0,0|2,0,0]=4 508 B20R2.30227524 CCCS(=O)(=O)Nc1cc(cc2c1nccc2)OC 40a_100000014381_100000054278 [1,1,0,0,0,0|2,0,0]=4 509 B20R2.2028322 CCCCN(C)c1cc(c(c2c1nccc2)F)OC 27a_100000207549_100010742067 [0,1,0,0,1,0|2,0,0]=4 510 B20R2.2028322 COc1cc(c2ncccc2c1F)N(C)CCCO 27a_100000213112_100010742067 [0,1,0,0,1,0|2,0,0]=4 511 B22R2.1962482 CCCOC(C)CNc1cc(c(c2c1nccc2)F)OC 27a_100015185124_100010742067 [0,1,0,0,0,1|2,0,0]=4 512 B22R2.1962482 COc1cc(c2ncccc2c1F)NC[C@H](C)CCCO 27a_100160569302_100010742067 [0,1,0,0,0,1|1,0,0]=3 513 B22R2.10779090 CCCCC(CC)CNc1cc(cc2c1nccc2)OC 34a_100000014381_100000211942 [0,1,0,0,0,1|1,0,0]=3 514 B22R2.10779090 CCCCC(CC)CSc1cc(cc2c1nccc2)OC 62a_100000211942_200010235761 [0,1,0,0,0,1|2,0,0]=4 515 B22R2.19606291 CCCCC(C)NC(=O)c1cc(cc2c1cccc2)OC 11a_100000126638_100010090016 [0,1,0,0,0,1|2,0,0]=4 516 B22R2.19606291 CCCCC(C)NC(=O)c1cc(cc2c1cccc2)OC 1626a_100000126638_100010090016 [0,1,0,0,0,1|2,0,0]=4 517 B22R2.19606291 CCCCC(C)NC(=O)c1cc(cc2c1cccc2)OC 240690a_100000126638_100010090016 [0,1,0,0,0,1|2,0,0]=4 518 B22R2.19606291 CCCCC(C)NC(=O)c1cc(cc2c1cccc2)OC 527a_100000126638_100010090016 [0,1,0,0,0,1|2,0,0]=4 519 B22R2.35864198 CCCCC(C)C(=O)Nc1cc(cc2c1nccc2)OC 11a_100000014381_100000725509 [0,1,0,0,0,1|1,0,0]=3 520 B22R2.35864198 CCCCC(C)C(=O)Nc1cc(cc2c1nccc2)OC 1626a_100000014381_100000725509 [0,1,0,0,0,1|1,0,0]=3 521 B22R2.35864198 CCCCC(C)C(=O)Nc1cc(cc2c1nccc2)OC 22a_100000014381_100000725509 [0,1,0,0,0,1|1,0,0]=3 522 B22R2.35864198 CCCCC(C)C(=O)Nc1cc(cc2c1nccc2)OC 527a_100000014381_100000725509 [0,1,0,0,0,1|1,0,0]=3 523 B22R2.35864198 CCCCC(O)C(=O)Nc1cc(cc2c1nccc2)OC 22a_100000014381_100000720857 [0,1,0,0,0,1|2,0,0]=4 524 B22R2.35864198 CCCCC(O)C(=O)Nc1cc(cc2c1nccc2)OC 527a_100000014381_100000720857 [0,1,0,0,0,1|2,0,0]=4 525 B22R2.35864198 CCCCN(C)C(=O)Nc1cc(cc2c1nccc2)OC 2430a_100000014381_100000207549 [0,1,0,0,0,1|2,0,0]=4 526 B22R2.35864198 COc1cc(c2ncccc2c1)NC(=O)N(C)CCCO 2430a_100000014381_100000213112 [0,1,0,0,0,1|2,0,0]=4 527 B22R2.617824 COc1cc(c2ncccc2c1)NC(C)(C)CCC(C)C 34a_100000014381_200000037585 [0,2,0,0,0,0|1,0,0]=3 528 B22R2.617824 COc1cc(c2ncccc2c1)SC(C)(C)CCC(C)C 62a_200000037585_200010235761 [0,2,0,0,0,0|2,0,0]=4 529 B22R2.8948761 COc1cc(c2ncccc2c1F)NC(C)CCC(C)C 27a_100138410893_100010742067 [0,2,0,0,0,0|1,0,0]=3 530 B22R2.8948761 COc1cc(c2ncccc2c1F)SC(C)CCC(C)C 62a_100010742067_100011261404 [0,2,0,0,0,0|2,0,0]=4 531 B22R2.8948761 COc1cc(c2ncccc2c1F)SC(C)CCC(C)C 62a_100011261404_100010742067 [0,2,0,0,0,0|2,0,0]=4 532 B22R2.8948759 CCC(C)CC(C)Nc1cc(c(c2c1nccc2)F)OC 27a_100000763565_100010742067 [0,2,0,0,0,0|1,0,0]=3 533 B22R2.617763 COc1cc(c2ncccc2c1)NC(=O)CCCN(C)C 11a_100000014381_100000740757 [0,2,0,0,0,0|1,0,1]=4 534 B22R2.617763 COc1cc(c2ncccc2c1)NC(=O)CCCN(C)C 22a_100000014381_100000740757 [0,2,0,0,0,0|1,0,1]=4 535 B22R2.14688108 CCCCCCC(C)Nc1cc(cc2c1nccc2)OC 34a_100000014381_100011215978 [0,2,0,0,0,0|1,0,0]=3 536 B22R2.14688108 CCCCCCC(C)Sc1cc(cc2c1nccc2)OC 62a_100011215978_200010235761 [0,2,0,0,0,0|2,0,0]=4 537 B22R2.20440506 CCCCCC(C)Nc1cc(c(c2c1nccc2)F)OC 27a_100000211957_100010742067 [0,2,0,0,0,0|1,0,0]=3 538 B22R2.20440506 CCCCCC(C)Sc1cc(c(c2c1nccc2)F)OC 62a_100010742067_200011218191 [0,2,0,0,0,0|2,0,0]=4 539 B22R2.20440506 CCCCCC(C)Sc1cc(c(c2c1nccc2)F)OC 62a_200011218191_100010742067 [0,2,0,0,0,0|2,0,0]=4 540 B22R2.36132540 CCCCC(CC)Sc1cc(c(c2c1nccc2)F)OC 62a_100010742067_200011216223 [0,2,0,0,0,0|2,0,0]=4 541 B22R2.36132540 CCCCC(CC)Sc1cc(c(c2c1nccc2)F)OC 62a_200011216223_100010742067 [0,2,0,0,0,0|2,0,0]=4 542 B22R2.36132540 CCCC[C@@H](CO)Nc1cc(c(c2c1nccc2)F)OC 27a_100011934283_100010742067 [0,2,0,0,0,0|1,0,0]=3 543 B22R2.36132540 COc1cc(c2ncccc2c1F)N[C@H](CO)CCSC 27a_100011827619_100010742067 [0,2,0,0,0,0|2,0,0]=4 544 B22R2.46866965 CCCCC(Nc1cc(cc2c1nccc2)OC)C(=O)N 34a_100000014381_100000748834 [0,2,0,0,0,0|1,0,1]=4 545 B22R2.48233673 CCCCC(CCC)Nc1cc(cc2c1nccc2)OC 34a_100000014381_100000211913 [0,2,0,0,0,0|1,0,0]=3 546 B22R2.48233673 CCCCC(CCC)Sc1cc(cc2c1nccc2)OC 62a_100000211913_200010235761 [0,2,0,0,0,0|2,0,0]=4 547 B20R2.316436 CCCCC(C)Sc1cc(c2ncccc2c1)OC 62a_200011215066_100010248852 [0,0,1,1,0,0|2,0,0]=4 548 B20R3.413 Brc1cc(c2ncccc2c1)NC3CCCCC3 27a_100000182618_100010090713 [1,0,0,1,0,0|2,0,0]=4 549 B20R3.413 Brc1cc(c2ncccc2c1)NC3CCCCC3 34a_100009814519_100000210327 [1,0,0,1,0,0|2,0,0]=4 550 B20R3.413 Brc1cc(c2ncccc2c1)NC3CCCOC3 27a_100000719290_100010090713 [1,0,0,1,0,0|2,0,0]=4 551 B20R3.413 Brc1cc(c2ncccc2c1)NC3CCCOC3 34a_100009814519_100000693364 [1,0,0,1,0,0|2,0,0]=4 552 B20R3.413 Cc1cc(c2ncccc2c1)OC3CCCCC3 34a_100009888445_100000210327 [1,0,0,1,0,0|2,0,0]=4 553 B20R3.413 Cc1cc(c2ncccc2c1)OC3CCCCC3 7a_100009888445_100000210327 [1,0,0,1,0,0|2,0,0]=4 554 B20R3.413 Cc1cc(c2ncccc2c1)OC3CCCOC3 34a_100009888445_100000693364 [1,0,0,1,0,0|2,0,0]=4 555 B20R3.413 Cc1cc(c2ncccc2c1)OC3CCCOC3 7a_100009888445_100000693364 [1,0,0,1,0,0|2,0,0]=4 556 B20R3.413 Cc1cc(c2ncccc2c1)SC3CCCCC3 62a_100000210327_100010113427 [1,0,0,1,0,0|2,0,0]=4 557 B20R3.413 Clc1cc(c2ncccc2c1)NC3CCCCC3 34a_100000026717_100000210327 [1,0,0,1,0,0|2,0,0]=4 558 B20R3.413 Clc1cc(c2ncccc2c1)NC3CCCOC3 34a_100000026717_100000693364 [1,0,0,1,0,0|2,0,0]=4 559 B20R3.413 Fc1cc(c2ncccc2c1)NC3CCCCC3 27a_100000182618_100010214460 [1,0,0,1,0,0|2,0,0]=4 560 B20R3.413 Fc1cc(c2ncccc2c1)NC3CCCCC3 34a_100000088212_100000210327 [1,0,0,1,0,0|2,0,0]=4 561 B20R3.413 Fc1cc(c2ncccc2c1)NC3CCCOC3 27a_100000719290_100010214460 [1,0,0,1,0,0|2,0,0]=4 562 B20R3.413 Fc1cc(c2ncccc2c1)NC3CCCOC3 34a_100000088212_100000693364 [1,0,0,1,0,0|2,0,0]=4 563 B20R3.413 Oc1cc(c2ncccc2c1)NC3CCCCC3 34a_100000083691_100000210327 [1,0,0,1,0,0|1,0,0]=3 564 B20R3.413 Oc1cc(c2ncccc2c1)NC3CCCOC3 34a_100000083691_100000693364 [1,0,0,1,0,0|1,0,0]=3 565 B20R3.413 Oc1cc(c2ncccc2c1)NC3CCSCC3 34a_100000083691_100000069128 [1,0,0,1,0,0|2,0,0]=4 566 B20R3.86379 O[C@@H]1CC[C@@H](C1)Nc2cc(cc3c2nccc3)Br 27a_100015195300_100010090713 [1,0,0,1,0,0|2,0,0]=4 567 B20R3.86379 O[C@@H]1CC[C@@H](C1)Nc2cc(cc3c2nccc3)F 27a_100015195300_100010214460 [1,0,0,1,0,0|2,0,0]=4 568 B20R3.97153 CC1CCCCN1c2cc(cc3c2nccc3)Br 27a_100000211376_100010090713 [1,0,0,1,0,0|2,0,0]=4 569 B20R3.97153 CC1CCCCN1c2cc(cc3c2nccc3)F 27a_100000211376_100010214460 [1,0,0,1,0,0|2,0,0]=4 570 B20R3.260821 CC(Nc1cc(cc2c1nccc2)Br)C3CCC3 27a_100016994624_100010090713 [1,0,0,1,0,0|2,0,0]=4 571 B20R3.260821 CC(Nc1cc(cc2c1nccc2)F)C3CCC3 27a_100016994624_100010214460 [1,0,0,1,0,0|2,0,0]=4 572 B20R3.507222 Cc1cc(c2ncccc2c1)SC3CC(C3)CO 62a_100009874164_100010113427 [1,0,0,1,0,0|2,0,0]=4 573 B20R3.507222 OCC1CC(C1)Nc2cc(cc3c2nccc3)Br 27a_100000095622_100010090713 [1,0,0,1,0,0|2,0,0]=4 574 B20R3.507222 OCC1CC(C1)Nc2cc(cc3c2nccc3)F 27a_100000095622_100010214460 [1,0,0,1,0,0|2,0,0]=4 575 B20R3.1958178 CC1CCC(N1c2cc(cc3c2nccc3)Br)C 27a_100000687148_100010090713 [1,0,0,1,0,0|2,0,0]=4 576 B20R3.1958178 CC1CCC(N1c2cc(cc3c2nccc3)F)C 27a_100000687148_100010214460 [1,0,0,1,0,0|2,0,0]=4 577 B20R3.756 COc1cc(c2ncccc2c1)C3=CCCCC3 271570a_100000062251_200010235761 [1,0,0,1,0,0|2,0,0]=4 578 B20R3.23064 COc1cc(c2ncccc2c1)NC3CCCC3 34a_100000014381_100000179811 [1,0,0,1,0,0|1,0,0]=3 579 B20R3.23064 COc1cc(c2ncccc2c1)NC3CCOC3 34a_100000014381_100000690089 [1,0,0,1,0,0|2,0,0]=4 580 B20R3.23064 COc1cc(c2ncccc2c1)SC3CCCC3 62a_100011217020_200010235761 [1,0,0,1,0,0|2,0,0]=4 581 B20R3.463676 COc1cc(c2ncccc2c1)NC3CCC3=O 34a_100000014381_100009892977 [1,0,0,1,0,0|1,0,1]=4 582 B20R3.463680 COc1cc(c2ncccc2c1)NCCC3CC3 34a_100000014381_100000694398 [1,0,0,1,0,0|1,0,0]=3 583 B20R3.463680 COc1cc(c2ncccc2c1)NCCC3CO3 34a_100000014381_100000732470 [1,0,0,1,0,0|1,0,0]=3 584 B20R3.463680 COc1cc(c2ncccc2c1)SCCC3CC3 62a_100000764125_200010235761 [1,0,0,1,0,0|2,0,0]=4 585 B20R3.463680 COc1cc(c2ncccc2c1)SCCC3CO3 62a_100000732470_200010235761 [1,0,0,1,0,0|2,0,0]=4 586 B20R3.463685 COc1cc(c2ncccc2c1)NCC3CCC3 34a_100000014381_100000763275 [1,0,0,1,0,0|1,0,0]=3 587 B20R3.463685 COc1cc(c2ncccc2c1)NCC3CCO3 34a_100000014381_100000103362 [1,0,0,1,0,0|1,0,0]=3 588 B20R3.463685 COc1cc(c2ncccc2c1)NCC3COC3 34a_100000014381_100010264016 [1,0,0,1,0,0|2,0,0]=4 589 B20R3.463685 COc1cc(c2ncccc2c1)SCC3CCC3 62a_100000763275_200010235761 [1,0,0,1,0,0|2,0,0]=4 590 B20R3.463685 COc1cc(c2ncccc2c1)SCC3CCO3 62a_100000103362_200010235761 [1,0,0,1,0,0|2,0,0]=4 591 B20R3.463684 COc1cc(c2cccnc2c1)NC(C)C3CC3 27a_100000700016_100010248855 [1,0,0,1,0,0|2,0,0]=4 592 B20R3.463684 COc1cc(c2ncccc2c1)NC(=O)C3CC3 11a_100000014381_100000210395 [1,0,0,1,0,0|1,0,1]=4 593 B20R3.463684 COc1cc(c2ncccc2c1)NC(=O)C3CC3 1626a_100000014381_100000210395 [1,0,0,1,0,0|1,0,1]=4 594 B20R3.463684 COc1cc(c2ncccc2c1)NC(=O)C3CC3 22a_100000014381_100000210395 [1,0,0,1,0,0|1,0,1]=4 595 B20R3.463684 COc1cc(c2ncccc2c1)NC(=O)C3CC3 527a_100000014381_100000210395 [1,0,0,1,0,0|1,0,1]=4 596 B20R3.463698 COc1cc(c2cccnc2c1)NC3(CCC3)C 27a_100000692455_100010248855 [1,0,0,1,0,0|2,0,0]=4 597 B22R3.54652 COc1cc(c2ncccc2c1)C=CC3CCCCC3 271570a_100016283615_200010235761 [0,0,0,1,0,1|2,0,0]=4 598 B22R3.54652 COc1cc(c2ncccc2c1)NCC3CCCCC3 34a_100000014381_100000211423 [0,0,0,1,0,1|1,0,0]=3 599 B22R3.54652 COc1cc(c2ncccc2c1)NCC3CCCCO3 34a_100000014381_100000211543 [0,0,0,1,0,1|2,0,0]=4 600 B22R3.54652 COc1cc(c2ncccc2c1)NCC3CCCOC3 34a_100000014381_100000741521 [0,0,0,1,0,1|1,0,0]=3 601 B22R3.54652 COc1cc(c2ncccc2c1)NCC3CCOCC3 34a_100000014381_100000754603 [0,0,0,1,0,1|2,0,0]=4 602 B22R3.54652 COc1cc(c2ncccc2c1)SCC3CCCCC3 62a_100000211423_200010235761 [0,0,0,1,0,1|2,0,0]=4 603 B22R3.54652 COc1cc(c2ncccc2c1)SCC3CCCOC3 62a_100000741521_200010235761 [0,0,0,1,0,1|2,0,0]=4 604 B22R3.54659 COc1cc(c2ncccc2c1)NC3CCCCC3F 34a_100000014381_100015423560 [0,0,0,1,0,1|2,0,0]=4 605 B22R3.54659 COc1cc(c2ncccc2c1)NC3CCCCC3O 34a_100000014381_100000038908 [0,0,0,1,0,1|2,0,0]=4 606 B22R3.1179600 COc1cc(c2ncccc2c1)NCC3CCN(C3)C 34a_100000014381_200000690779 [0,0,0,1,0,1|2,0,0]=4 607 B22R3.54653 COc1cc(c2ncccc2c1)NC3CCC(CC3)C 34a_100000014381_200011216234 [0,1,0,1,0,0|1,0,0]=3 608 B22R3.17322282 COc1cc(c2ncccc2c1)NC3(CCC3(F)F)F 34a_100000014381_200000036048 [0,1,0,1,0,0|2,0,0]=4 609 B22R3.1179610 COc1cc(c2cccnc2c1)N[C@H]3CCCN(C3)C 27a_100016992120_100010248855 [0,1,0,1,0,0|2,0,0]=4 610 B22R3.1179609 COc1cc(c2ncccc2c1)NC3CCCCCC3 34a_100000014381_100011217769 [0,1,0,1,0,0|1,0,0]=3 611 B22R3.1179609 COc1cc(c2ncccc2c1)SC3CCCCCC3 62a_100011217769_200010235761 [0,1,0,1,0,0|2,0,0]=4 612 B22R3.1108043 COc1cc(c2ncccc2c1F)NC3CCCCC3 27a_100000182618_100010742067 [0,1,0,1,0,0|1,0,0]=3 613 B22R3.1108043 COc1cc(c2ncccc2c1F)NC3CCCOC3 27a_100000719290_100010742067 [0,1,0,1,0,0|1,0,0]=3 614 B22R3.1108043 COc1cc(c2ncccc2c1F)NC3CCOCC3 27a_100000741149_100010742067 [0,1,0,1,0,0|2,0,0]=4 615 B22R3.1108043 COc1cc(c2ncccc2c1F)NC3CCSCC3 27a_100000748639_100010742067 [0,1,0,1,0,0|2,0,0]=4 616 B22R3.1108043 COc1cc(c2ncccc2c1F)SC3CCCCC3 62a_100000210327_100010742067 [0,1,0,1,0,0|2,0,0]=4 617 B22R3.1108043 COc1cc(c2ncccc2c1F)SC3CCCCC3 62a_100010742067_100000210327 [0,1,0,1,0,0|2,0,0]=4 618 B22R3.1108043 COc1cc(c2ncccc2c1F)SC3CCCOC3 62a_100010742067_100000693364 [0,1,0,1,0,0|2,0,0]=4 619 B22R3.1293908 CCN1CC(C1)Nc2cc(c(c3c2nccc3)F)OC 27a_200015199589_100010742067 [0,1,0,1,0,0|2,0,0]=4 620 B22R3.1293908 COc1cc(c2ncccc2c1F)NC3CC(C3)CO 27a_100000095622_100010742067 [0,1,0,1,0,0|1,0,0]=3 621 B22R3.1293908 COc1cc(c2ncccc2c1F)N[C@H]3C[C@@H](C3)OC 27a_100121570643_100010742067 [0,1,0,1,0,0|2,0,0]=4 622 B22R3.1293908 COc1cc(c2ncccc2c1F)SC3CC(C3)CO 62a_100009874164_100010742067 [0,1,0,1,0,0|2,0,0]=4 623 B22R3.1293908 COc1cc(c2ncccc2c1F)SC3CC(C3)CO 62a_100010742067_100009874164 [0,1,0,1,0,0|2,0,0]=4 624 B22R3.16391531 COc1cc(c2ncccc2c1F)N3CCCCC3C 27a_100000211376_100010742067 [0,1,0,1,0,0|1,0,0]=3 625 B22R3.16391531 COc1cc(c2ncccc2c1F)N3CCOC[C@@H]3C 27a_100009815349_100010742067 [0,1,0,1,0,0|2,0,0]=4 626 B22R3.16392561 COc1cc(c2ncccc2c1F)NC3CCN(C3)C 27a_100000744687_100010742067 [0,1,0,1,0,0|2,0,0]=4 627 B22R3.16392561 COc1cc(c2ncccc2c1F)N[C@H]3CC[C@H](C3)O 27a_100015195300_100010742067 [0,1,0,1,0,0|1,0,0]=3 628 B22R3.16392562 COc1cc(c2ncccc2c1F)NC(C)C3CCC3 27a_100016994624_100010742067 [0,1,0,1,0,0|1,0,0]=3 629 B22R3.378119244 COc1cc(c2ncccc2c1F)NC3(CCOC3)C 27a_100000693475_100010742067 [0,1,0,1,0,0|2,0,0]=4 630 B22R3.378119286 COc1cc(c2ncccc2c1F)N3C(CCC3C)C 27a_100000687148_100010742067 [0,1,0,1,0,0|1,0,0]=3 631 B18R2.895583 CCCC(C)Sc1cc(cc2c1cc[nH]2)OC 62a_100000766640_100010006585 [1,0,0,0,1,0|2,0,0]=4 632 B18R2.895583 CCCC(C)Sc1cc(cc2c1nc[nH]2)OC 62a_100000766640_100102526192 [1,0,0,0,1,0|2,0,0]=4 633 B20R2.316852 C[C@H](CCCO)CNc1cc(cc2c1nccc2)Br 27a_100160569302_100010090713 [1,0,0,0,0,1|2,0,0]=4 634 B20R2.316852 C[C@H](CCCO)CNc1cc(cc2c1nccc2)F 27a_100160569302_100010214460 [1,0,0,0,0,1|2,0,0]=4 635 B20R2.651 CCCCC(C)Sc1cc2ncccc2cc1OC 62a_100011093944_200011215066 [0,0,0,0,1,1|2,0,0]=4 636 B20R2.651 CCCCC(C)Sc1cc2ncccc2cc1OC 62a_200011215066_100011093944 [0,0,0,0,1,1|2,0,0]=4 637 B20R2.3759652 CCCCC(C)Nc1c(ccc2c1cccc2)OC 34a_100009884440_200011215066 [0,0,0,0,1,1|2,0,0]=4 638 B20R2.3759652 CCCCC(C)Sc1c(ccc2c1nccc2)OC 62a_200011215066_100010071576 [0,0,0,0,1,1|2,0,0]=4 639 B20R2.3768505 CCCCC(C)Nc1ccc(c2c1cccc2)OC 34a_100020629631_200011215066 [0,0,0,0,1,1|2,0,0]=4 640 B20R2.3768505 CCCCC(C)Nc1ccc(c2c1nccc2)OC 34a_100000703970_200011215066 [0,0,0,0,1,1|1,0,0]=3 641 B20R2.3768505 CCCCC(C)Oc1ccc(c2c1nccc2)OC 34a_100009853971_200011215066 [0,0,0,0,1,1|2,0,0]=4