0 B12R2.18 Cn1c2ccccc2oc1=O CSC000171226 [0,1,0,0,0,0|1,0,1]=3 1 B12R2.32 CCN1Cc2ccccc2C1 CSC016200629 [0,1,0,0,0,0|3,0,0]=4 2 B12R2.32 CSc1nc2ccccc2[nH]1 CSC000169833 [0,1,0,0,0,0|1,0,0]=2 3 B12R2.32 CSc1nc2ccccc2o1 CSC000000691 [0,1,0,0,0,0|0,0,0]=1 4 B12R2.32 CSc1nc2ccccc2s1 CSC000000696 [0,1,0,0,0,0|0,1,0]=2 5 B10R1.4 CCNc1ccccc1Cl CSC000219383 [0,0,1,0,0,0|1,0,2]=4 6 B10R1.4 CCOc1ccccc1Cl CSC000169953 [0,0,1,0,0,0|1,0,1]=3 7 B10R1.4 CCOc1ccccc1F CSC000172994 [0,0,1,0,0,0|1,0,1]=3 8 B10R1.4 CCSc1ccccc1C CSC000053911 [0,0,1,0,0,0|1,1,1]=4 9 B10R1.4 CCSc1ccccc1Cl CSC000006683 [0,0,1,0,0,0|1,1,1]=4 10 B10R1.4 CSCc1ccccc1Br CSC000148299 [0,0,1,0,0,0|3,0,0]=4 11 B10R1.4 CSCc1ccccc1Cl CSC000051354 [0,0,1,0,0,0|3,0,0]=4 12 B10R1.18 CS(=O)Cc1ccccc1 CSC000064350 [0,0,1,0,0,0|2,0,1]=4 13 B9R1.15 CNc1ccccc1Cl CSC000219374 [1,0,1,0,0,0|1,0,1]=4 14 B9R1.15 COc1ccccc1Br CSC000174000 [1,0,1,0,0,0|1,0,0]=3 15 B9R1.15 COc1ccccc1Cl CSC000169952 [1,0,1,0,0,0|1,0,0]=3 16 B9R1.15 COc1ccccc1I CSC000210334 [1,0,1,0,0,0|1,0,0]=3 17 B9R1.15 CSc1ccccc1Br CSC000230855 [1,0,1,0,0,0|1,1,0]=4 18 B9R1.15 CSc1ccccc1Cl CSC000000335 [1,0,1,0,0,0|1,1,0]=4 19 B9R1.15 CSc1ccccc1F CSC000000233 [1,0,1,0,0,0|1,1,0]=4 20 B9R1.15 CSc1ccccc1O CSC011216402 [1,0,1,0,0,0|1,0,0]=3 21 B11R1.13 CCOc1cccc(c1C)Cl CSC010783795 [0,1,1,0,0,0|1,0,1]=4 22 B11R1.13 CCOc1cccc(c1F)Cl CSC010883641 [0,1,1,0,0,0|1,0,1]=4 23 B11R1.13 CCOc1cccc(c1F)F CSC000042309 [0,1,1,0,0,0|1,0,1]=4 24 B11R1.17 Brc1ccccc1OCC=C CSC000173964 [0,1,1,0,0,0|1,0,1]=4 25 B11R1.17 CCCOc1ccccc1Br CSC000174042 [0,1,1,0,0,0|1,0,1]=4 26 B11R1.17 CCCOc1ccccc1C CSC000169983 [0,1,1,0,0,0|1,0,1]=4 27 B11R1.17 CCCOc1ccccc1F CSC000173322 [0,1,1,0,0,0|1,0,1]=4 28 B11R1.17 Cc1ccccc1OCC=C CSC000172067 [0,1,1,0,0,0|1,0,1]=4 29 B11R1.17 Cc1ccccc1OCCO CSC011305843 [0,1,1,0,0,0|1,0,1]=4 30 B11R1.17 Clc1ccccc1OCC=C CSC000172057 [0,1,1,0,0,0|1,0,1]=4 31 B11R1.17 Fc1ccccc1OCC=C CSC000173442 [0,1,1,0,0,0|1,0,1]=4 32 B11R1.17 OCCOc1ccccc1Cl CSC000230518 [0,1,1,0,0,0|1,0,1]=4 33 B11R1.17 OCCOc1ccccc1F CSC000756447 [0,1,1,0,0,0|1,0,1]=4 34 B11R1.41 CCNc1ccccc1OC CSC000219754 [0,1,1,0,0,0|0,0,2]=4 35 B11R1.41 CCOc1ccccc1CO CSC000708577 [0,1,1,0,0,0|1,0,1]=4 36 B11R1.41 CCOc1ccccc1OC CSC000005897 [0,1,1,0,0,0|1,0,1]=4 37 B11R1.41 CCOc1ccccc1SC CSC010366423 [0,1,1,0,0,0|1,0,1]=4 38 B11R1.41 CCSc1ccccc1OC CSC000055740 [0,1,1,0,0,0|1,0,1]=4 39 B11R1.41 COc1ccccc1CSC CSC000053060 [0,1,1,0,0,0|2,0,0]=4 40 B11R1.81 CCOc1ccc(cc1Br)C CSC000230997 [0,1,1,0,0,0|1,0,1]=4 41 B11R1.81 CCOc1ccc(cc1Br)Cl CSC000171684 [0,1,1,0,0,0|1,0,1]=4 42 B11R1.81 CCOc1ccc(cc1C)Br CSC011308936 [0,1,1,0,0,0|1,0,1]=4 43 B11R1.81 CCOc1ccc(cc1C)C CSC000174096 [0,1,1,0,0,0|1,0,1]=4 44 B11R1.81 CCOc1ccc(cc1Cl)Br CSC000149648 [0,1,1,0,0,0|1,0,1]=4 45 B11R1.81 CCOc1ccc(cc1Cl)Cl CSC000005818 [0,1,1,0,0,0|1,0,1]=4 46 B11R1.81 CCOc1ccc(cc1Cl)F CSC000005860 [0,1,1,0,0,0|1,0,1]=4 47 B11R1.81 CCOc1ccc(cc1F)Br CSC000171753 [0,1,1,0,0,0|1,0,1]=4 48 B11R1.81 CCOc1ccc(cc1F)Cl CSC011212613 [0,1,1,0,0,0|1,0,1]=4 49 B11R1.86 CC(=O)Nc1ccccc1Br CSC000153524 [0,1,1,0,0,0|1,0,1]=4 50 B11R1.86 CC(=O)Nc1ccccc1C CSC000153662 [0,1,1,0,0,0|1,0,1]=4 51 B11R1.86 CC(=O)Nc1ccccc1Cl CSC000153741 [0,1,1,0,0,0|1,0,1]=4 52 B11R1.86 CC(=O)Nc1ccccc1F CSC000154224 [0,1,1,0,0,0|1,0,1]=4 53 B11R1.86 CC(=O)Nc1ccccc1I CSC000154044 [0,1,1,0,0,0|1,0,1]=4 54 B11R1.86 CC(=O)Nc1ncccc1O CSC000022013 [0,1,1,0,0,0|1,0,1]=4 55 B11R1.86 CC(=O)Oc1ccccc1C CSC000001913 [0,1,1,0,0,0|1,0,0]=3 56 B11R1.86 CC(=O)Oc1ccccc1F CSC000001835 [0,1,1,0,0,0|1,0,0]=3 57 B11R1.86 CC(C)Oc1ccccc1F CSC000173055 [0,1,1,0,0,0|1,0,1]=4 58 B11R1.182 CCOc1cc(ccc1C)Br CSC012361169 [0,1,1,0,0,0|1,0,1]=4 59 B11R1.182 CCOc1cc(ccc1Cl)F CSC011216996 [0,1,1,0,0,0|1,0,1]=4 60 B11R1.182 CCOc1cc(ccc1F)Br CSC012344967 [0,1,1,0,0,0|1,0,1]=4 61 B11R1.182 CCOc1cc(ccc1F)Cl CSC000035111 [0,1,1,0,0,0|1,0,1]=4 62 B11R1.222 CNC(=O)c1ccccc1O CSC000185920 [0,1,1,0,0,0|2,0,0]=4 63 B11R1.605 CCOc1c(cccc1C)C CSC011198585 [0,1,1,0,0,0|1,0,1]=4 64 B11R1.605 CCOc1c(cccc1Cl)F CSC010732145 [0,1,1,0,0,0|1,0,1]=4 65 B11R1.605 CCOc1c(cccc1F)F CSC000024509 [0,1,1,0,0,0|1,0,1]=4 66 B11R1.20 CC(=O)Nc1ccc(cc1)Br CSC000153570 [0,1,1,0,0,0|0,0,2]=4 67 B11R1.20 CC(=O)Nc1ccc(cc1)Cl CSC000154020 [0,1,1,0,0,0|0,0,2]=4 68 B11R1.20 CC(=O)Oc1ccc(cc1)Br CSC009811594 [0,1,1,0,0,0|1,0,0]=3 69 B11R1.20 CC(=O)Oc1ccc(cc1)C CSC000001885 [0,1,1,0,0,0|1,0,0]=3 70 B11R1.20 CC(=O)Oc1ccc(cc1)Cl CSC000001863 [0,1,1,0,0,0|1,0,0]=3 71 B11R1.20 CC(=O)Oc1ccc(cc1)F CSC000001924 [0,1,1,0,0,0|1,0,0]=3 72 B11R1.40 CCC(=O)Nc1ccccc1 CSC000153483 [0,1,1,0,0,0|0,0,2]=4 73 B11R1.40 CCC(=O)Oc1ccccc1 CSC000001944 [0,1,1,0,0,0|1,0,0]=3 74 B11R1.40 CNC(=O)Nc1ccccc1 CSC000178567 [0,1,1,0,0,0|0,0,2]=4 75 B11R1.40 COC(=O)Oc1ccccc1 CSC000020726 [0,1,1,0,0,0|1,0,0]=3 76 B11R1.40 NCC(=O)Nc1ccccc1 CSC000168422 [0,1,1,0,0,0|0,0,2]=4 77 B11R1.157 CC(=O)Nc1cccc(c1)Br CSC000153616 [0,1,1,0,0,0|0,0,2]=4 78 B11R1.157 CC(=O)Nc1cccc(c1)C CSC000153650 [0,1,1,0,0,0|0,0,2]=4 79 B11R1.157 CC(=O)Nc1cccc(c1)F CSC000153968 [0,1,1,0,0,0|0,0,2]=4 80 B11R1.157 CC(=O)Oc1cccc(c1)Br CSC009811612 [0,1,1,0,0,0|1,0,0]=3 81 B11R1.157 CC(=O)Oc1cccc(c1)C CSC000001900 [0,1,1,0,0,0|1,0,0]=3 82 B11R1.157 CC(=O)Oc1cccc(c1)Cl CSC000001977 [0,1,1,0,0,0|1,0,0]=3 83 B11R1.157 CC(=O)Oc1cccc(c1)F CSC000002014 [0,1,1,0,0,0|1,0,0]=3 84 B11R1.157 CC(C)Oc1cccc(c1)F CSC000170039 [0,1,1,0,0,0|1,0,1]=4 85 B13R2.32 Cn1ncc2ccccc2c1=O CSC015946782 [0,1,0,0,0,1|2,0,0]=4 86 B13R2.57 COc1cnc2ccccc2c1 CSC012187421 [0,1,0,0,0,1|1,0,0]=3 87 B13R2.57 CSc1ccc2ccccc2c1 CSC000000181 [0,1,0,0,0,1|2,0,0]=4 88 B13R2.57 CSc1ccc2ccccc2n1 CSC015436161 [0,1,0,0,0,1|1,0,0]=3 89 B13R2.26 CCSc1nc2ccccc2o1 CSC015611995 [0,2,0,0,0,0|0,0,0]=2 90 B13R2.26 CSCc1nc2ccccc2[nH]1 CSC000186718 [0,2,0,0,0,0|1,0,0]=3 91 B13R2.43 CSc1nc2cc(ccc2[nH]1)C CSC000000315 [0,2,0,0,0,0|1,0,0]=3 92 B13R2.43 CSc1nc2cc(ccc2o1)Cl CSC000006466 [0,2,0,0,0,0|0,0,0]=2 93 B13R2.43 CSc1nc2ccc(cc2[nH]1)Cl CSC016038704 [0,2,0,0,0,0|1,0,0]=3 94 B13R2.43 CSc1nc2nc(ccc2o1)C CSC009847803 [0,2,0,0,0,0|1,0,0]=3 95 B13R2.435 NC(=O)c1cc2ccccc2o1 CSC000162263 [0,2,0,0,0,0|1,0,1]=4 96 B13R2.435 NC(=O)c1nc2ccccc2s1 CSC000016678 [0,2,0,0,0,0|0,1,1]=4 97 B9R1.6 CS(=O)c1ccccc1 CSC000038873 [0,0,1,0,1,0|1,0,1]=4 98 B11R1.91 CC(=C)COc1ccccc1 CSC000171512 [0,0,1,0,0,1|1,0,0]=3 99 B11R1.91 CC(=C)CSc1ccccc1 CSC000006268 [0,0,1,0,0,1|1,1,0]=4 100 B11R1.91 CC(=O)NNc1ccccc1 CSC000153448 [0,0,1,0,0,1|0,0,2]=4 101 B11R1.91 CC(=O)OCc1ccccc1 CSC000000625 [0,0,1,0,0,1|1,0,0]=3 102 B11R1.91 CC(O)CNc1ccccc1 CSC011364939 [0,0,1,0,0,1|0,0,2]=4 103 B11R1.91 NC(=O)COc1ccccc1 CSC000150575 [0,0,1,0,0,1|1,0,1]=4