0 B12R1.27 COC(=O)CCc1ccccc1 CM13745 [0,0,0,0,0,0|0,0,2]=2 1 B11R1.91 CC(=O)COc1ccccc1 CM11227 [1,0,0,0,0,0|1,0,1]=3 2 B13R1.14 COC(=O)C=Cc1ccc(cc1)Cl CM13579 [0,1,0,0,0,0|0,0,0]=1 3 B13R1.14 COC(=O)CCc1ccc(cc1)O CM13750 [0,1,0,0,0,0|0,0,2]=3 4 B13R1.15 COC(=O)C=Cc1cccc(c1)Br CM13574 [0,1,0,0,0,0|0,0,0]=1 5 B13R1.15 COC(=O)CCc1cccc(c1)Br CM13748 [0,1,0,0,0,0|0,0,2]=3 6 B13R1.528 COC(=O)CCc1ccccc1Br CM13746 [0,1,0,0,0,0|0,0,2]=3 7 B13R2.32 c1ccc2c(c1)ccc(c2O)Br CM11054 [0,0,0,1,0,0|3,0,0]=4 8 B13R2.33 c1ccc2c(c1)CCC(=O)CC2 CM10091 [0,0,0,1,0,0|1,0,2]=4 9 B13R2.57 [C-]#[N+]c1ccc2ccccc2c1 CM14093 [0,0,0,1,0,0|2,0,1]=4 10 B13R2.57 c1ccc2cc(ccc2c1)CCl CM13877 [0,0,0,1,0,0|3,0,0]=4 11 B12R1.21 c1cc(ncc1C=CC(=O)O)N CM11013 [1,1,0,0,0,0|1,0,0]=3 12 B12R1.43 CC(=Cc1ccccc1)[N+](=O)[O-] CM13917 [1,1,0,0,0,0|1,0,1]=4 13 B12R1.107 CC(c1ccccc1)NC(=O)C CM11017 [1,1,0,0,0,0|1,0,1]=4 14 B12R1.125 c1ccc(c(c1)CCC(=O)O)Br CM13747 [1,1,0,0,0,0|0,0,2]=4 15 B12R1.226 c1cc(cc(c1)Br)C=CC(=O)O CM13573 [1,1,0,0,0,0|0,0,0]=2 16 B12R1.49 COC(=O)Cc1ccc(cc1)O CM13716 [0,1,0,0,1,0|0,0,1]=3 17 B12R1.50 COC(=O)Cc1cccc(c1)F CM13702 [0,1,0,0,1,0|0,0,1]=3 18 B12R1.50 COC(=O)Cc1cccc(c1)N CM13647 [0,1,0,0,1,0|0,0,1]=3 19 B14R1.163 COC(=O)CCC(=O)c1ccccc1 CM11064 [0,1,0,0,0,1|0,0,1]=3 20 B14R1.10 COC(=O)CC(=O)c1ccc(cc1)Cl CM13756 [0,2,0,0,0,0|0,0,1]=3 21 B14R1.10 COC(=O)CC(=O)c1ccc(cc1)F CM13758 [0,2,0,0,0,0|0,0,1]=3 22 B14R1.587 COC(=O)CC(=O)c1ccccc1Cl CM13755 [0,2,0,0,0,0|0,0,1]=3 23 B14R1.502 CCOC(=O)C#Cc1ccc(cc1)Cl CM13879 [0,2,0,0,0,0|0,0,2]=4 24 B14R1.502 CCOC(=O)C=Cc1ccc(cc1)Cl CM13578 [0,2,0,0,0,0|0,0,0]=2 25 B14R1.502 CCOC(=O)CCc1ccc(cc1)N CM10283 [0,2,0,0,0,0|0,0,2]=4 26 B12R1.77 COC(=O)c1ccccc1CBr CM12526 [0,0,1,1,0,0|1,0,1]=4 27 B12R1.354 COC(=O)c1cc(ccc1Br)F CM12489 [0,0,1,1,0,0|2,0,0]=4 28 B12R1.354 COC(=O)c1cc(ccc1Cl)Br CM12466 [0,0,1,1,0,0|2,0,0]=4 29 B12R1.354 COC(=O)c1cc(ccc1F)Br CM12503 [0,0,1,1,0,0|2,0,0]=4 30 B12R1.354 COC(=O)c1cc(ccc1F)I CM12734 [0,0,1,1,0,0|2,0,0]=4 31 B12R1.354 COC(=O)c1cc(ccc1I)Br CM12520 [0,0,1,1,0,0|2,0,0]=4 32 B12R1.354 COC(=O)c1cc(ccc1N)Br CM12350 [0,0,1,1,0,0|2,0,0]=4 33 B12R1.354 COC(=O)c1cc(ccc1N)F CM12397 [0,0,1,1,0,0|2,0,0]=4 34 B12R1.354 Cc1ccc(cc1C(=O)OC)Br CM12536 [0,0,1,1,0,0|1,0,1]=4 35 B12R1.354 Cc1ccc(cc1C(=O)OC)F CM12768 [0,0,1,1,0,0|1,0,1]=4 36 B12R1.354 Cc1ccc(cc1C(=O)OC)I CM12826 [0,0,1,1,0,0|1,0,1]=4 37 B12R1.354 Cc1ccc(cc1C(=O)OC)O CM12807 [0,0,1,1,0,0|1,0,1]=4 38 B12R1.435 COC(=O)c1cccc(c1)C#N CM12614 [0,0,1,1,0,0|1,0,1]=4 39 B12R1.435 COC(=O)c1cccc(c1)CN CM12426 [0,0,1,1,0,0|1,0,1]=4 40 B12R1.435 COC(=O)c1cccc(c1)SCl CM13757 [0,0,1,1,0,0|2,0,0]=4 41 B12R2.1081 c1ccc2c(c1)cccc2I CM13878 [1,0,0,1,0,0|2,0,0]=4 42 B12R2.24 c1cc(=O)[nH]c2c1cncc2 CM10284 [1,0,0,1,0,0|2,0,0]=4 43 B12R2.24 c1cc(cc2c1ccnc2)O CM10593 [1,0,0,1,0,0|2,0,0]=4 44 B12R2.24 c1cc2c(ccc(n2)O)nc1 CM10314 [1,0,0,1,0,0|2,0,0]=4 45 B12R2.24 c1ccc2c(c1)[nH]c(=O)cn2 CM14099 [1,0,0,1,0,0|2,0,0]=4 46 B12R2.18 Cn1c2ccccc2oc1=O CM14408 [0,0,0,1,1,0|2,0,0]=4 47 B14R2.1019 COc1cc2cccnc2c(c1)Cl CM10082 [0,1,0,1,0,0|2,0,0]=4 48 B14R2.2332 COc1ccc2cc(ccc2c1)Br CM14460 [0,1,0,1,0,0|1,0,0]=3 49 B10R1.15 COC(=O)c1cccnc1 CM10959 [0,0,0,0,2,0|1,0,0]=3 50 B10R1.15 c1ccc(cc1)C(=O)CF CM11196 [0,0,0,0,2,0|2,0,0]=4