0 B12R1.8 CCCCCNc1ccccc1 CSC000219563 [0,0,0,1,0,0|2,0,0]=3 1 B12R1.8 CCCCCSc1ccccc1 CSC000048317 [0,0,0,1,0,0|2,0,0]=3 2 B12R1.8 CCCCNCc1ccccc1 CSC000196024 [0,0,0,1,0,0|2,0,0]=3 3 B12R1.8 CCCCNCc1ccccn1 CSC000200672 [0,0,0,1,0,0|2,0,0]=3 4 B12R1.8 CCCCNCc1cccnc1 CSC000200674 [0,0,0,1,0,0|3,0,0]=4 5 B12R1.8 CCCCNCc1ccncc1 CSC000200698 [0,0,0,1,0,0|3,0,0]=4 6 B12R1.8 CCOCCSc1ccccn1 CSC000006452 [0,0,0,1,0,0|3,0,0]=4 7 B12R1.8 CCSCCCc1ccccc1 CSC000053059 [0,0,0,1,0,0|2,0,0]=3 8 B12R1.8 OCCCNCc1ccccn1 CSC000200612 [0,0,0,1,0,0|3,0,0]=4 9 B12R1.37 CCCCCNCc1ccco1 CSC000199926 [0,0,0,1,0,0|1,0,2]=4 10 B12R1.37 CCCCCNCc1cccs1 CSC000186957 [0,0,0,1,0,0|1,1,1]=4 11 B12R1.267 CCCCOc1ccccc1C CSC011212280 [0,0,0,1,0,0|2,0,1]=4 12 B12R1.267 CCCNCc1ccccc1C CSC000196471 [0,0,0,1,0,0|2,0,1]=4 13 B12R1.267 CCCNCc1ccccc1Cl CSC000196458 [0,0,0,1,0,0|2,0,1]=4 14 B12R1.372 CCCCNCc1cccn1C CSC000215829 [0,0,0,1,0,0|3,0,0]=4 15 B12R1.372 CCCCNCc1sccc1Br CSC011541509 [0,0,0,1,0,0|3,0,0]=4 16 B12R1.372 CCCCNCc1sccc1C CSC000200699 [0,0,0,1,0,0|3,0,0]=4 17 B11R0.81 CCCCCCC(=O)OCC=C CSC000033353 [1,1,0,0,0,0|1,0,1]=4 18 B11R1.4 CCCCNCc1ccco1 CSC000200681 [1,0,0,1,0,0|1,0,1]=4 19 B11R1.4 CCCCNCc1cccs1 CSC000200673 [1,0,0,1,0,0|1,1,0]=4 20 B11R1.4 CCCCNCc1ccsc1 CSC000200702 [1,0,0,1,0,0|2,0,0]=4 21 B11R1.17 CCCCn1cnccc1=O CSC012650617 [1,0,0,1,0,0|2,0,0]=4 22 B11R1.28 CCCCNc1ccccc1 CSC000211623 [1,0,0,1,0,0|1,0,1]=4 23 B11R1.28 CCCCNc1ccccn1 CSC000156416 [1,0,0,1,0,0|2,0,0]=4 24 B11R1.28 CCCCOc1ccccc1 CSC011212283 [1,0,0,1,0,0|1,0,1]=4 25 B11R1.28 CCCNCc1ccccn1 CSC000201641 [1,0,0,1,0,0|2,0,0]=4 26 B11R1.28 CCCSCc1ccccc1 CSC000006446 [1,0,0,1,0,0|1,0,1]=4 27 B11R1.28 CSCCCc1ccccc1 CSC000051364 [1,0,0,1,0,0|1,0,1]=4 28 B13R1.6 CCCCNCc1cccc(c1)Br CSC000196034 [0,1,0,1,0,0|2,0,0]=4 29 B13R1.6 CCCCNCc1cccc(c1)C CSC000196050 [0,1,0,1,0,0|2,0,0]=4 30 B13R1.6 CCCCNCc1cccc(c1)Cl CSC000188330 [0,1,0,1,0,0|2,0,0]=4 31 B13R1.42 CCCC(C)NCc1ccccc1 CSC000196585 [0,1,0,1,0,0|2,0,0]=4 32 B13R1.42 CCCC(O)CSc1ccccc1 CSC012179918 [0,1,0,1,0,0|2,0,0]=4 33 B13R1.119 CCCCCCNCc1ccco1 CSC000201047 [0,1,0,1,0,0|0,0,2]=4 34 B13R1.119 CCCCCCNCc1cccs1 CSC000186966 [0,1,0,1,0,0|0,1,1]=4 35 B13R1.654 CCCCCNCc1cccn1C CSC000188279 [0,1,0,1,0,0|2,0,0]=4 36 B13R1.654 CCCCCNCc1sccc1C CSC000187238 [0,1,0,1,0,0|2,0,0]=4 37 B13R1.28 CCCCCCNc1ccccc1 CSC000219565 [0,1,0,1,0,0|1,0,0]=3 38 B13R1.28 CCCCCNCc1ccccc1 CSC000180875 [0,1,0,1,0,0|1,0,0]=3 39 B13R1.28 CCCCCNCc1ccccn1 CSC000199920 [0,1,0,1,0,0|1,0,0]=3 40 B13R1.28 CCCCCNCc1cccnc1 CSC000199921 [0,1,0,1,0,0|2,0,0]=4 41 B13R1.28 CCCCCNCc1ccncc1 CSC000186958 [0,1,0,1,0,0|2,0,0]=4 42 B13R1.28 CCNCCNCc1ccccc1 CSC011556070 [0,1,0,1,0,0|2,0,0]=4 43 B13R1.28 CCOCCSCc1ccccc1 CSC000006442 [0,1,0,1,0,0|2,0,0]=4 44 B13R1.28 CNCCCNCc1ccccc1 CSC000215872 [0,1,0,1,0,0|2,0,0]=4 45 B13R1.28 CNCCCNCc1ccccn1 CSC000216241 [0,1,0,1,0,0|2,0,0]=4 46 B13R1.28 COCCCNCc1ccccn1 CSC000200562 [0,1,0,1,0,0|2,0,0]=4 47 B13R1.28 OCCCCNCc1ccccc1 CSC000186360 [0,1,0,1,0,0|2,0,0]=4 48 B13R1.28 OCCCCNCc1ccccn1 CSC011521226 [0,1,0,1,0,0|2,0,0]=4 49 B13R1.555 CCCCCOc1ccccc1Br CSC011214832 [0,1,0,1,0,0|1,0,1]=4 50 B13R1.555 CCCCNCc1ccccc1C CSC000196038 [0,1,0,1,0,0|1,0,1]=4 51 B13R1.24 CCCNCC(C)c1ccccc1 CSC000201663 [0,1,0,1,0,0|2,0,0]=4 52 B13R1.48 CCCCCNC(=O)c1ccco1 CSC000157983 [0,1,0,1,0,0|1,0,1]=4 53 B13R1.48 CCCCCNC(=O)c1cccs1 CSC000157995 [0,1,0,1,0,0|1,1,0]=4 54 B13R1.44 CCCCN(C)Cc1ccccc1 CSC000006983 [0,1,0,1,0,0|2,0,0]=4 55 B13R1.44 CCCCS(=O)Cc1ccccc1 CSC019146419 [0,1,0,1,0,0|2,0,0]=4 56 B13R1.337 CC(C)CCNCc1ccccc1 CSC000196072 [0,1,0,1,0,0|2,0,0]=4 57 B13R1.337 CC(C)CCNCc1ccccn1 CSC000200824 [0,1,0,1,0,0|2,0,0]=4 58 B13R1.337 CC(C)NCCCc1ccccc1 CSC000200232 [0,1,0,1,0,0|2,0,0]=4 59 B13R1.9 CCCCNCc1ccc(cc1)Br CSC000196029 [0,1,0,1,0,0|2,0,0]=4 60 B13R1.9 CCCCNCc1ccc(cc1)C CSC000196039 [0,1,0,1,0,0|2,0,0]=4 61 B13R1.9 CCCCNCc1ccc(cc1)Cl CSC000196030 [0,1,0,1,0,0|2,0,0]=4 62 B13R1.9 CCCCNCc1ccc(cc1)F CSC000196033 [0,1,0,1,0,0|2,0,0]=4 63 B13R1.718 CCC(C)NCCc1ccccc1 CSC000199858 [0,1,0,1,0,0|2,0,0]=4 64 B13R1.718 CCC(C)NCCc1ccccn1 CSC000177427 [0,1,0,1,0,0|2,0,0]=4 65 B13R2.3 C1CCN(CC1)c2ccccn2 CSC000156112 [0,0,0,2,0,0|2,0,0]=4 66 B13R2.64 C(N1CCCC1)c2ccccc2 CSC000174533 [0,0,0,2,0,0|2,0,0]=4 67 B13R2.64 C(N1CCCC1)c2ccccn2 CSC011191286 [0,0,0,2,0,0|2,0,0]=4 68 B13R2.64 C1CCC(C1)Nc2ccccn2 CSC000156706 [0,0,0,2,0,0|2,0,0]=4 69 B13R2.64 C1CCC(C1)Oc2ccccc2 CSC000702741 [0,0,0,2,0,0|2,0,0]=4 70 B13R2.1613 CCN1CCCc2c1cccc2 CSC000014527 [0,0,0,2,0,0|2,0,0]=4 71 B13R2.2382 C(NCc1ccccc1)C2CC2 CSC000186374 [0,0,0,2,0,0|2,0,0]=4 72 B13R2.2383 C(Nc1ccccc1)C2CCC2 CSC000685713 [0,0,0,2,0,0|2,0,0]=4