0 B14R1.19 CCCCSC(C)c1ccc(cc1)Br 62a_100000210211_100000755118 [0,0,0,0,0,0|2,1,1]=4 1 B14R1.19 CCCCSC(C)c1ccc(cc1)Br 62a_100000755118_100000210210 [0,0,0,0,0,0|2,1,1]=4 2 B15R1.3309 O=C(NNCCO)c1ccc(cc1O)O 22a_100000210001_100000212172 [0,1,0,0,0,0|3,0,0]=4 3 B14R1.14 CCCCCC=Cc1ccc(cc1)Br 271570a_100000062253_100000752885 [1,1,0,0,0,0|2,0,0]=4 4 B14R1.33 CCCCC(=Cc1ccc(cc1)Br)Br 271570a_206741709834_100000752885 [1,1,0,0,0,0|2,0,0]=4 5 B14R1.33 CCCCC(=Cc1ccc(cc1)Cl)Br 271570a_206741709834_100000755918 [1,1,0,0,0,0|2,0,0]=4 6 B14R1.232 CCCCC=Cc1ccc(c(c1)Br)Br 271570a_100016275911_100012356285 [1,1,0,0,0,0|2,0,0]=4 7 B14R1.232 CCCCC=Cc1ccc(c(c1)Br)Cl 271570a_100016275911_100012353702 [1,1,0,0,0,0|2,0,0]=4 8 B14R1.232 CCCCC=Cc1ccc(c(c1)Cl)Br 271570a_100016275911_100012047281 [1,1,0,0,0,0|2,0,0]=4 9 B14R1.232 CCCCC=Cc1ccc(c(c1)Cl)Cl 271570a_100016275911_100011214914 [1,1,0,0,0,0|2,0,0]=4 10 B14R1.774 CCCCC=Cc1ccc(cc1Br)Br 271570a_100016275911_100011484698 [1,1,0,0,0,0|2,0,0]=4 11 B14R1.774 CCCCC=Cc1ccc(cc1Br)Cl 271570a_100016275911_100011219703 [1,1,0,0,0,0|2,0,0]=4 12 B14R1.774 CCCCC=Cc1ccc(cc1Cl)Br 271570a_100016275911_100011216062 [1,1,0,0,0,0|2,0,0]=4 13 B14R1.774 CCCCC=Cc1ccc(cc1Cl)Cl 271570a_100016275911_100000699841 [1,1,0,0,0,0|2,0,0]=4 14 B16R1.1147 O=C(NC[C@H](O)CO)Nc1ccc(cc1)O 2430a_100000185829_100020644852 [0,1,0,0,0,1|2,0,0]=4 15 B16R1.7393 O=C(NCCCO)Nc1ccc(c(c1)O)O 2430a_100102946323_100000182051 [0,1,0,0,0,1|2,0,0]=4 16 B16R1.22955 O=C(NCCCO)Nc1ccc(cc1O)O 2430a_100000106777_100000182051 [0,1,0,0,0,1|2,0,0]=4 17 B16R1.4231 CCCC(C)CC(=O)c1ccc(c(c1)Br)Br 1458a_100012339404_100011216630 [0,2,0,0,0,0|2,0,0]=4 18 B16R1.4231 CCCC(C)CC(=O)c1ccc(c(c1)Br)Cl 1458a_100000691181_100011216630 [0,2,0,0,0,0|2,0,0]=4 19 B16R1.4231 CCCC(C)CC(=O)c1ccc(c(c1)Br)I 1458a_100000739115_100011216630 [0,2,0,0,0,0|2,0,0]=4 20 B16R1.4231 CCCC(C)CC(=O)c1ccc(c(c1)Cl)Br 1458a_100000687082_100011216630 [0,2,0,0,0,0|2,0,0]=4 21 B16R1.4231 CCCC(C)CC(=O)c1ccc(c(c1)Cl)Cl 1458a_100000210401_100011216630 [0,2,0,0,0,0|2,0,0]=4 22 B16R1.4231 CCCC(C)CC(=O)c1ccc(c(c1)I)Br 1458a_100012343876_100011216630 [0,2,0,0,0,0|2,0,0]=4 23 B16R1.24755 CCCC(C)CC(=O)c1ccc(cc1Br)Br 1458a_100000762965_100011216630 [0,2,0,0,0,0|2,0,0]=4 24 B16R1.24755 CCCC(C)CC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_100011216630 [0,2,0,0,0,0|2,0,0]=4 25 B16R1.24755 CCCC(C)CC(=O)c1ccc(cc1Br)I 1458a_100012360512_100011216630 [0,2,0,0,0,0|2,0,0]=4 26 B16R1.24755 CCCC(C)CC(=O)c1ccc(cc1Cl)Br 1458a_100000741628_100011216630 [0,2,0,0,0,0|2,0,0]=4 27 B16R1.24755 CCCC(C)CC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_100011216630 [0,2,0,0,0,0|2,0,0]=4 28 B16R1.24755 CCCC(C)CC(=O)c1ccc(cc1I)Br 1458a_100000751167_100011216630 [0,2,0,0,0,0|2,0,0]=4 29 B16R1.4616 CCCCCCC(=O)c1ccc(c(c1)Br)Br 1458a_100012339404_100000210757 [0,2,0,0,0,0|2,0,0]=4 30 B16R1.4616 CCCCCCC(=O)c1ccc(c(c1)Br)Cl 1458a_100000691181_100000210757 [0,2,0,0,0,0|2,0,0]=4 31 B16R1.4616 CCCCCCC(=O)c1ccc(c(c1)Br)I 1458a_100000739115_100000210757 [0,2,0,0,0,0|2,0,0]=4 32 B16R1.4616 CCCCCCC(=O)c1ccc(c(c1)Cl)Br 1458a_100000687082_100000210757 [0,2,0,0,0,0|2,0,0]=4 33 B16R1.4616 CCCCCCC(=O)c1ccc(c(c1)Cl)Cl 1458a_100000210401_100000210757 [0,2,0,0,0,0|2,0,0]=4 34 B16R1.4616 CCCCCCC(=O)c1ccc(c(c1)Cl)I 1458a_100000684831_100000210757 [0,2,0,0,0,0|2,0,0]=4 35 B16R1.4616 CCCCCCC(=O)c1ccc(c(c1)I)Br 1458a_100012343876_100000210757 [0,2,0,0,0,0|2,0,0]=4 36 B16R1.4616 CCCCCCC(=O)c1ccc(c(c1)I)Cl 1458a_100000739381_100000210757 [0,2,0,0,0,0|2,0,0]=4 37 B16R1.4616 CCCCCCC(=O)c1ccc(c(c1)I)I 1458a_100000725830_100000210757 [0,2,0,0,0,0|2,0,0]=4 38 B16R1.26593 CCCCCCC(=O)c1ccc(cc1Br)Br 1458a_100000762965_100000210757 [0,2,0,0,0,0|2,0,0]=4 39 B16R1.26593 CCCCCCC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_100000210757 [0,2,0,0,0,0|2,0,0]=4 40 B16R1.26593 CCCCCCC(=O)c1ccc(cc1Br)I 1458a_100012360512_100000210757 [0,2,0,0,0,0|2,0,0]=4 41 B16R1.26593 CCCCCCC(=O)c1ccc(cc1Cl)Br 1458a_100000741628_100000210757 [0,2,0,0,0,0|2,0,0]=4 42 B16R1.26593 CCCCCCC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_100000210757 [0,2,0,0,0,0|2,0,0]=4 43 B16R1.26593 CCCCCCC(=O)c1ccc(cc1Cl)I 1458a_100000751301_100000210757 [0,2,0,0,0,0|2,0,0]=4 44 B16R1.26593 CCCCCCC(=O)c1ccc(cc1I)Br 1458a_100000751167_100000210757 [0,2,0,0,0,0|2,0,0]=4 45 B16R1.26593 CCCCCCC(=O)c1ccc(cc1I)Cl 1458a_100000739380_100000210757 [0,2,0,0,0,0|2,0,0]=4 46 B16R1.7518 CCCCC(C)C(=O)c1ccc(c(c1)Br)Br 1458a_100012339404_200011215066 [0,2,0,0,0,0|2,0,0]=4 47 B16R1.7518 CCCCC(C)C(=O)c1ccc(c(c1)Br)Cl 1458a_100000691181_200011215066 [0,2,0,0,0,0|2,0,0]=4 48 B16R1.7518 CCCCC(C)C(=O)c1ccc(c(c1)Br)I 1458a_100000739115_200011215066 [0,2,0,0,0,0|2,0,0]=4 49 B16R1.7518 CCCCC(C)C(=O)c1ccc(c(c1)Cl)Br 1458a_100000687082_200011215066 [0,2,0,0,0,0|2,0,0]=4 50 B16R1.7518 CCCCC(C)C(=O)c1ccc(c(c1)Cl)Cl 1458a_100000210401_200011215066 [0,2,0,0,0,0|2,0,0]=4 51 B16R1.7518 CCCCC(C)C(=O)c1ccc(c(c1)I)Br 1458a_100012343876_200011215066 [0,2,0,0,0,0|2,0,0]=4 52 B16R1.40312 CCCCC(C)C(=O)c1ccc(cc1Br)Br 1458a_100000762965_200011215066 [0,2,0,0,0,0|2,0,0]=4 53 B16R1.40312 CCCCC(C)C(=O)c1ccc(cc1Br)Cl 1458a_100000766353_200011215066 [0,2,0,0,0,0|2,0,0]=4 54 B16R1.40312 CCCCC(C)C(=O)c1ccc(cc1Br)I 1458a_100012360512_200011215066 [0,2,0,0,0,0|2,0,0]=4 55 B16R1.40312 CCCCC(C)C(=O)c1ccc(cc1Cl)Br 1458a_100000741628_200011215066 [0,2,0,0,0,0|2,0,0]=4 56 B16R1.40312 CCCCC(C)C(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_200011215066 [0,2,0,0,0,0|2,0,0]=4 57 B16R1.40312 CCCCC(C)C(=O)c1ccc(cc1I)Br 1458a_100000751167_200011215066 [0,2,0,0,0,0|2,0,0]=4 58 B16R1.1091 CC(C)CCCC(=O)c1ccc(c(c1)Br)Br 1458a_100012339404_100011214892 [0,2,0,0,0,0|2,0,0]=4 59 B16R1.1091 CC(C)CCCC(=O)c1ccc(c(c1)Br)Cl 1458a_100000691181_100011214892 [0,2,0,0,0,0|2,0,0]=4 60 B16R1.1091 CC(C)CCCC(=O)c1ccc(c(c1)Br)I 1458a_100000739115_100011214892 [0,2,0,0,0,0|2,0,0]=4 61 B16R1.1091 CC(C)CCCC(=O)c1ccc(c(c1)Cl)Br 1458a_100000687082_100011214892 [0,2,0,0,0,0|2,0,0]=4 62 B16R1.1091 CC(C)CCCC(=O)c1ccc(c(c1)Cl)Cl 1458a_100000210401_100011214892 [0,2,0,0,0,0|2,0,0]=4 63 B16R1.1091 CC(C)CCCC(=O)c1ccc(c(c1)I)Br 1458a_100012343876_100011214892 [0,2,0,0,0,0|2,0,0]=4 64 B16R1.11442 CC(C)CCCC(=O)c1ccc(cc1Br)Br 1458a_100000762965_100011214892 [0,2,0,0,0,0|2,0,0]=4 65 B16R1.11442 CC(C)CCCC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_100011214892 [0,2,0,0,0,0|2,0,0]=4 66 B16R1.11442 CC(C)CCCC(=O)c1ccc(cc1Br)I 1458a_100012360512_100011214892 [0,2,0,0,0,0|2,0,0]=4 67 B16R1.11442 CC(C)CCCC(=O)c1ccc(cc1Cl)Br 1458a_100000741628_100011214892 [0,2,0,0,0,0|2,0,0]=4 68 B16R1.11442 CC(C)CCCC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_100011214892 [0,2,0,0,0,0|2,0,0]=4 69 B16R1.11442 CC(C)CCCC(=O)c1ccc(cc1I)Br 1458a_100000751167_100011214892 [0,2,0,0,0,0|2,0,0]=4 70 B16R1.11442 CC(O)CNNC(=O)c1ccc(cc1O)O 22a_200000730056_100000212172 [0,2,0,0,0,0|2,0,0]=4 71 B16R1.3548 CCCCCC(=O)c1cc(c(c(c1)Br)C)Br 1458a_100000187602_100000210326 [0,2,0,0,0,0|2,0,0]=4 72 B16R1.3548 CCCCCC(=O)c1cc(c(c(c1)Br)Cl)Cl 1458a_200012920480_100000210326 [0,2,0,0,0,0|2,0,0]=4 73 B16R1.3548 CCCCCC(=O)c1cc(c(c(c1)Br)Cl)F 1458a_100010291025_100000210326 [0,2,0,0,0,0|2,0,0]=4 74 B16R1.3548 CCCCCC(=O)c1cc(c(c(c1)Cl)Br)Cl 1458a_100012354307_100000210326 [0,2,0,0,0,0|2,0,0]=4 75 B16R1.3548 CCCCCC(=O)c1cc(c(c(c1)Cl)C)Cl 1458a_100012356007_100000210326 [0,2,0,0,0,0|2,0,0]=4 76 B16R1.3548 CCCCCC(=O)c1cc(c(c(c1)Cl)Cl)Cl 1458a_100012339221_100000210326 [0,2,0,0,0,0|2,0,0]=4 77 B16R1.3548 CCCCCC(=O)c1cc(c(c(c1)I)I)I 1458a_100000033816_100000210326 [0,2,0,0,0,0|2,0,0]=4 78 B16R1.3548 CCCCNC(=O)c1cc(c(c(c1)I)I)I 11a_100000102301_100000033816 [0,2,0,0,0,0|2,0,0]=4 79 B16R1.3548 CCCCNC(=O)c1cc(c(c(c1)I)I)I 1626a_100000102301_100000033816 [0,2,0,0,0,0|2,0,0]=4 80 B16R1.3548 CCCCNC(=O)c1cc(c(c(c1)I)I)I 527a_100000102301_100000033816 [0,2,0,0,0,0|2,0,0]=4 81 B16R1.3548 CCCNNC(=O)c1cc(c(c(c1)O)O)O 22a_100000740057_100000212154 [0,2,0,0,0,0|2,0,0]=4 82 B16R1.3573 CCCCCC(=O)c1cc(c(cc1Br)F)Cl 1458a_100012921620_100000210326 [0,2,0,0,0,0|2,0,0]=4 83 B16R1.3573 CCCCCC(=O)c1cc(c(cc1C)Cl)Cl 1458a_100010439669_100000210326 [0,2,0,0,0,0|2,0,0]=4 84 B16R1.3573 CCCCCC(=O)c1cc(c(cc1Cl)Br)Cl 1458a_100000246132_100000210326 [0,2,0,0,0,0|2,0,0]=4 85 B16R1.3573 CCCCCC(=O)c1cc(c(cc1Cl)Br)F 1458a_100000724438_100000210326 [0,2,0,0,0,0|2,0,0]=4 86 B16R1.3573 CCCCCC(=O)c1cc(c(cc1Cl)C)Cl 1458a_100013033594_100000210326 [0,2,0,0,0,0|2,0,0]=4 87 B16R1.3573 CCCCCC(=O)c1cc(c(cc1Cl)Cl)Cl 1458a_100011934218_100000210326 [0,2,0,0,0,0|2,0,0]=4 88 B16R1.3573 CCCCCC(=O)c1cc(c(cc1F)Br)Br 1458a_200011217225_100000210326 [0,2,0,0,0,0|2,0,0]=4 89 B16R1.3573 CCCCCC(=O)c1cc(c(cc1F)Br)Cl 1458a_100012347732_100000210326 [0,2,0,0,0,0|2,0,0]=4 90 B16R1.3573 CCCCCC(=O)c1cc(c(cc1F)Cl)Br 1458a_100011217226_100000210326 [0,2,0,0,0,0|2,0,0]=4 91 B16R1.3574 CCCCCC(=O)c1ccc(c(c1Cl)Br)Cl 1458a_100010208263_100000210326 [0,2,0,0,0,0|2,0,0]=4 92 B16R1.3574 CCCCCC(=O)c1ccc(c(c1Cl)C)Cl 1458a_100010074829_100000210326 [0,2,0,0,0,0|2,0,0]=4 93 B16R1.3574 CCCCCC(=O)c1ccc(c(c1Cl)Cl)Br 1458a_200012347731_100000210326 [0,2,0,0,0,0|2,0,0]=4 94 B16R1.3574 CCCCCC(=O)c1ccc(c(c1F)Br)Br 1458a_200016032200_100000210326 [0,2,0,0,0,0|2,0,0]=4 95 B16R1.3574 CCCCCC(=O)c1ccc(c(c1F)Cl)Br 1458a_100000719840_100000210326 [0,2,0,0,0,0|2,0,0]=4 96 B16R1.21625 CCCCCC(=O)c1c(cc(cc1Br)Br)Br 1458a_100011217931_100000210326 [0,2,0,0,0,0|2,0,0]=4 97 B16R1.21625 CCCCCC(=O)c1c(cc(cc1Br)Br)F 1458a_100009813784_100000210326 [0,2,0,0,0,0|2,0,0]=4 98 B16R1.21625 CCCCCC(=O)c1c(cc(cc1Br)Cl)F 1458a_100010244364_100000210326 [0,2,0,0,0,0|2,0,0]=4 99 B16R1.21625 CCCCCC(=O)c1c(cc(cc1Br)F)Br 1458a_200015320377_100000210326 [0,2,0,0,0,0|2,0,0]=4 100 B16R1.21625 CCCCCC(=O)c1c(cc(cc1Cl)Br)C 1458a_100000698028_100000210326 [0,2,0,0,0,0|2,0,0]=4 101 B16R1.21625 CCCCCC(=O)c1c(cc(cc1Cl)Br)Cl 1458a_100012360385_100000210326 [0,2,0,0,0,0|2,0,0]=4 102 B16R1.21625 CCCCCC(=O)c1c(cc(cc1Cl)Br)F 1458a_100010078411_100000210326 [0,2,0,0,0,0|2,0,0]=4 103 B16R1.21625 CCCCCC(=O)c1c(cc(cc1Cl)C)Cl 1458a_100009989429_100000210326 [0,2,0,0,0,0|2,0,0]=4 104 B16R1.21625 CCCCCC(=O)c1c(cc(cc1Cl)Cl)Cl 1458a_100011215713_100000210326 [0,2,0,0,0,0|2,0,0]=4 105 B16R1.21625 CCCCCC(=O)c1c(cc(cc1Cl)I)Cl 1458a_100010740244_100000210326 [0,2,0,0,0,0|2,0,0]=4 106 B16R1.21625 O=C(NCCCO)c1c(cc(cc1O)O)O 527a_100000182051_100000040092 [0,2,0,0,0,0|2,0,0]=4