0 B11R1.4 CCCCNCc1ccco1 CSC000200681 [0,0,0,1,0,0|1,0,2]=4 1 B11R1.4 CCCCNCc1cccs1 CSC000200673 [0,0,0,1,0,0|1,1,1]=4 2 B11R1.17 CCCCn1cnccc1=O CSC012650617 [0,0,0,1,0,0|2,0,0]=3 3 B11R1.17 CCCOc1ccccc1Br CSC000174042 [0,0,0,1,0,0|2,0,1]=4 4 B11R1.17 CCCOc1ccccc1C CSC000169983 [0,0,0,1,0,0|2,0,1]=4 5 B11R1.17 CCCOc1ccccc1F CSC000173322 [0,0,0,1,0,0|2,0,1]=4 6 B11R1.17 CCCSc1ccccc1Br CSC000230854 [0,0,0,1,0,0|2,0,1]=4 7 B11R1.17 CCCSc1ccccc1Cl CSC000006739 [0,0,0,1,0,0|2,0,1]=4 8 B11R1.17 CCNCc1ccccc1F CSC000201217 [0,0,0,1,0,0|2,0,1]=4 9 B11R1.17 CCSCc1ccccc1Cl CSC000044547 [0,0,0,1,0,0|2,0,1]=4 10 B11R1.28 CCCCNc1ccccc1 CSC000211623 [0,0,0,1,0,0|2,0,0]=3 11 B11R1.28 CCCCNc1ccccn1 CSC000156416 [0,0,0,1,0,0|2,0,0]=3 12 B11R1.28 CCCCOc1ccccc1 CSC011212283 [0,0,0,1,0,0|2,0,0]=3 13 B11R1.28 CCCCSc1ncccn1 CSC000002571 [0,0,0,1,0,0|3,0,0]=4 14 B11R1.28 CCCNCc1ccccn1 CSC000201641 [0,0,0,1,0,0|2,0,0]=3 15 B11R1.28 CCCNCc1cccnc1 CSC000180834 [0,0,0,1,0,0|3,0,0]=4 16 B11R1.28 CCCNCc1ccncc1 CSC000180873 [0,0,0,1,0,0|3,0,0]=4 17 B11R1.28 CCCSCc1ccccc1 CSC000006446 [0,0,0,1,0,0|2,0,0]=3 18 B11R1.28 COCCOc1ccccc1 CSC000757042 [0,0,0,1,0,0|3,0,0]=4 19 B11R1.28 COCCSc1ccccc1 CSC025761232 [0,0,0,1,0,0|3,0,0]=4 20 B11R1.28 COCCSc1ccccn1 CSC000024487 [0,0,0,1,0,0|3,0,0]=4 21 B11R1.28 CSCCCc1ccccc1 CSC000051364 [0,0,0,1,0,0|2,0,0]=3 22 B11R1.28 CSCCOc1ccccc1 CSC000148400 [0,0,0,1,0,0|3,0,0]=4 23 B11R1.28 OCCCOc1ccccc1 CSC011215863 [0,0,0,1,0,0|3,0,0]=4 24 B11R1.28 OCCNCc1ccccc1 CSC000180844 [0,0,0,1,0,0|3,0,0]=4 25 B11R1.28 OCCNCc1ccccn1 CSC000200435 [0,0,0,1,0,0|3,0,0]=4 26 B11R1.28 OCCSCc1ccccc1 CSC011205989 [0,0,0,1,0,0|3,0,0]=4 27 B11R1.180 CCCNCc1cccn1C CSC000215833 [0,0,0,1,0,0|3,0,0]=4 28 B11R1.180 CCCNCc1sccc1C CSC000189075 [0,0,0,1,0,0|3,0,0]=4 29 B10R0.91 CCCCCC(=O)OCC=C CSC000006420 [1,1,0,0,0,0|1,0,1]=4 30 B10R1.17 CCCSc1ccccc1 CSC000005822 [1,0,0,1,0,0|1,0,1]=4 31 B10R1.17 CCCSc1ccccn1 CSC000006455 [1,0,0,1,0,0|2,0,0]=4 32 B10R1.17 CCSCc1ccccc1 CSC000006444 [1,0,0,1,0,0|1,0,1]=4 33 B10R1.21 CCCNCc1cccs1 CSC000186944 [1,0,0,1,0,0|1,1,0]=4 34 B10R1.21 CCCNCc1ccsc1 CSC000201670 [1,0,0,1,0,0|2,0,0]=4 35 B12R1.8 CCCCCNc1ccccc1 CSC000219563 [0,1,0,1,0,0|1,0,0]=3 36 B12R1.8 CCCCCSc1ccccc1 CSC000048317 [0,1,0,1,0,0|1,0,0]=3 37 B12R1.8 CCCCNCc1ccccc1 CSC000196024 [0,1,0,1,0,0|1,0,0]=3 38 B12R1.8 CCCCNCc1ccccn1 CSC000200672 [0,1,0,1,0,0|1,0,0]=3 39 B12R1.8 CCCCNCc1cccnc1 CSC000200674 [0,1,0,1,0,0|2,0,0]=4 40 B12R1.8 CCCCNCc1ccncc1 CSC000200698 [0,1,0,1,0,0|2,0,0]=4 41 B12R1.8 CCOCCSc1ccccn1 CSC000006452 [0,1,0,1,0,0|2,0,0]=4 42 B12R1.8 CCSCCCc1ccccc1 CSC000053059 [0,1,0,1,0,0|1,0,0]=3 43 B12R1.8 OCCCNCc1ccccn1 CSC000200612 [0,1,0,1,0,0|2,0,0]=4 44 B12R1.37 CCCCCNCc1ccco1 CSC000199926 [0,1,0,1,0,0|0,0,2]=4 45 B12R1.37 CCCCCNCc1cccs1 CSC000186957 [0,1,0,1,0,0|0,1,1]=4 46 B12R1.267 CCCCOc1ccccc1C CSC011212280 [0,1,0,1,0,0|1,0,1]=4 47 B12R1.267 CCCNCc1ccccc1C CSC000196471 [0,1,0,1,0,0|1,0,1]=4 48 B12R1.267 CCCNCc1ccccc1Cl CSC000196458 [0,1,0,1,0,0|1,0,1]=4 49 B12R1.372 CCCCNCc1cccn1C CSC000215829 [0,1,0,1,0,0|2,0,0]=4 50 B12R1.372 CCCCNCc1sccc1Br CSC011541509 [0,1,0,1,0,0|2,0,0]=4 51 B12R1.372 CCCCNCc1sccc1C CSC000200699 [0,1,0,1,0,0|2,0,0]=4 52 B12R1.28 CCCCNc1cccc(c1)C CSC000219676 [0,1,0,1,0,0|2,0,0]=4 53 B12R1.28 CCCCOc1cccc(c1)Br CSC011212284 [0,1,0,1,0,0|2,0,0]=4 54 B12R1.28 CCCNCc1cccc(c1)Br CSC000187640 [0,1,0,1,0,0|2,0,0]=4 55 B12R1.28 CCCNCc1cccc(c1)C CSC000196480 [0,1,0,1,0,0|2,0,0]=4 56 B12R1.28 CCCNCc1cccc(c1)Cl CSC000196467 [0,1,0,1,0,0|2,0,0]=4 57 B12R1.28 CCCNCc1cccc(c1)F CSC000196477 [0,1,0,1,0,0|2,0,0]=4 58 B12R1.1 CCCCOc1ccc(cc1)Br CSC011212269 [0,1,0,1,0,0|2,0,0]=4 59 B12R1.1 CCCCOc1ccc(cc1)C CSC011212278 [0,1,0,1,0,0|2,0,0]=4 60 B12R1.1 CCCCOc1ccc(cc1)Cl CSC000237964 [0,1,0,1,0,0|2,0,0]=4 61 B12R1.1 CCCCOc1ccc(cc1)I CSC000230682 [0,1,0,1,0,0|2,0,0]=4 62 B12R1.1 CCCCSc1ccc(cc1)C CSC000015701 [0,1,0,1,0,0|2,0,0]=4 63 B12R1.1 CCCNCc1ccc(cc1)Br CSC000186942 [0,1,0,1,0,0|2,0,0]=4 64 B12R1.1 CCCNCc1ccc(cc1)C CSC000186941 [0,1,0,1,0,0|2,0,0]=4 65 B12R1.1 CCCNCc1ccc(cc1)Cl CSC000180872 [0,1,0,1,0,0|2,0,0]=4 66 B12R1.25 COCCn1cccc(c1=O)Br CSC013733236 [0,1,0,1,0,0|2,0,0]=4 67 B12R1.27 CCC(C)NCc1ccccn1 CSC000199859 [0,1,0,1,0,0|2,0,0]=4 68 B12R1.27 CCC(C)SCc1ccccc1 CSC000000404 [0,1,0,1,0,0|2,0,0]=4 69 B12R1.27 CCC(N)CNc1ccccn1 CSC011915201 [0,1,0,1,0,0|2,0,0]=4 70 B12R1.30 CCCNC(C)c1ccccc1 CSC000187307 [0,1,0,1,0,0|2,0,0]=4 71 B12R1.374 COCCn1cc(ccc1=O)Br CSC000234157 [0,1,0,1,0,0|2,0,0]=4 72 B12R1.35 CCCCNC(=O)c1ccco1 CSC000159049 [0,1,0,1,0,0|1,0,1]=4 73 B12R1.35 CCCCNC(=O)c1cccs1 CSC000159062 [0,1,0,1,0,0|1,1,0]=4 74 B12R1.252 CC(C)CCNc1ccccc1 CSC000219564 [0,1,0,1,0,0|2,0,0]=4 75 B12R1.252 CC(C)CNCc1ccccn1 CSC000200742 [0,1,0,1,0,0|2,0,0]=4 76 B12R1.252 CC(C)NCCc1ccccc1 CSC000200190 [0,1,0,1,0,0|2,0,0]=4 77 B12R2.2057 C(NC1CC1)c2ccccc2 CSC000196367 [0,0,0,2,0,0|2,0,0]=4 78 B12R2.2057 C(Nc1ccccc1)C2CC2 CSC011316272 [0,0,0,2,0,0|2,0,0]=4 79 B12R2.2058 C1CC(C1)Sc2ccccc2 CSC000092208 [0,0,0,2,0,0|2,0,0]=4