0 B9R1.8 c1ccc(cc1)CCBr 20087 [1,0,0,0,0,0|1,0,0]=2 1 B9R1.8 c1ccc(cc1)CCN 14206 [1,0,0,0,0,0|1,0,0]=2 2 B11R1.16 CC(CNC)c1ccccc1 18563 [0,1,0,0,0,0|2,0,0]=3 3 B11R1.40 CCC(Cc1ccccc1)N 9001864 [0,1,0,0,0,0|1,0,1]=3 4 B11R1.40 C[C@@H](Cc1ccccc1)NC 13997 [0,1,0,0,0,0|2,0,0]=3 5 B11R1.40 C[C@H](Cc1ccccc1)NC 13998 [0,1,0,0,0,0|2,0,0]=3 6 B11R1.91 CC(=N)NCc1ccccc1 13570 [0,1,0,0,0,0|2,0,0]=3 7 B11R1.91 c1cnc(nc1)CCC(=O)O 10007109 [0,1,0,0,0,0|2,0,0]=3 8 B11R2.4 c1ccc(cc1)[C@H]2C[C@@H]2N 10010494 [0,0,0,1,0,0|1,0,1]=3 9 B8R1.2 c1ccc(cc1)N=O 21009 [2,0,0,0,0,0|1,0,0]=3 10 B10R1.1 c1cc(ccc1CCN)O 18601 [1,1,0,0,0,0|1,0,0]=3 11 B10R1.15 CC(CN)c1ccccc1 17742 [1,1,0,0,0,0|1,0,0]=3 12 B10R1.15 c1ccc(cc1)[C@H](CO)N 10007132 [1,1,0,0,0,0|0,0,1]=3 13 B10R1.18 CC(=O)Cc1ccccc1 16103 [1,1,0,0,0,0|0,0,0]=2 14 B10R1.18 CC(=O)Cc1ccccc1 16444 [1,1,0,0,0,0|0,0,0]=2 15 B10R1.18 C[C@@H](Cc1ccccc1)N 14204 [1,1,0,0,0,0|0,0,1]=3 16 B10R1.18 C[C@@H](Cc1ccccc1)N 15650 [1,1,0,0,0,0|0,0,1]=3 17 B10R1.18 c1ccc(cc1)CC(=O)O 18709 [1,1,0,0,0,0|0,0,0]=2 18 B10R1.18 c1cnc(nc1)CC(=O)O 10007116 [1,1,0,0,0,0|2,0,0]=4 19 B12R1.21 CN(C)CCc1ccc(cc1)O 21626 [0,2,0,0,0,0|2,0,0]=4 20 B12R1.21 c1cc(ccc1\C=C\C(=O)O)O 20929 [0,2,0,0,0,0|0,0,2]=4 21 B12R1.49 CC(Cc1ccc(cc1)Cl)NC 9002185 [0,2,0,0,0,0|2,0,0]=4 22 B12R1.49 CC(Cc1ccc(cc1)F)NC 9001070 [0,2,0,0,0,0|2,0,0]=4 23 B12R1.49 CCC(Cc1ccc(cc1)Cl)N 13893 [0,2,0,0,0,0|1,0,1]=4 24 B12R1.49 Cc1ccc(cc1)CC(C)NC 9001345 [0,2,0,0,0,0|2,0,0]=4 25 B12R1.17 CNC[C@@H](c1cccc(c1)O)O 17205 [0,2,0,0,0,0|2,0,0]=4 26 B12R1.17 CNC[C@@H](c1cccc(c1)O)O 18619 [0,2,0,0,0,0|2,0,0]=4 27 B12R1.34 C[C@@H]([C@H](c1ccccc1)Cl)NC 9002347 [0,2,0,0,0,0|2,0,0]=4 28 B12R1.371 CC(Cc1ccccc1F)NC 11420 [0,2,0,0,0,0|2,0,0]=4 29 B12R1.50 CC(Cc1cccc(c1)F)NC 9001185 [0,2,0,0,0,0|2,0,0]=4 30 B12R1.226 c1cc(cc(c1)I)CNC(=N)N 19998 [0,2,0,0,0,0|2,0,0]=4 31 B12R1.226 c1cc(cc(c1)I)CNC(=N)N 19998 [0,2,0,0,0,0|2,0,0]=4 32 B12R1.8 c1ccc(cc1)\C=C\CCCO 75751 [0,2,0,0,0,0|0,0,2]=4 33 B12R1.32 CC(Cc1ccccc1)NC=O 18597 [0,2,0,0,0,0|0,0,0]=2 34 B12R1.32 CCNC(C)Cc1ccccc1 11557 [0,2,0,0,0,0|1,0,1]=4 35 B12R1.32 CCNC(C)Cc1ccccc1 15658 [0,2,0,0,0,0|1,0,1]=4 36 B12R1.32 CN(CC#C)Cc1ccccc1 10007852 [0,2,0,0,0,0|1,0,1]=4 37 B12R1.252 c1ccc(cc1)CCCC(=O)[O-] 11323 [0,2,0,0,0,0|0,0,0]=2 38 B12R1.43 CC(Cc1ccccc1)N(C)C 11556 [0,2,0,0,0,0|2,0,0]=4 39 B12R1.43 CC(Cc1ccccc1)N(C)C 15659 [0,2,0,0,0,0|2,0,0]=4 40 B12R1.43 CC(Cc1ncccn1)C(=O)O 10007118 [0,2,0,0,0,0|2,0,0]=4 41 B12R1.43 c1ccc(cc1)CC(C(=O)O)S 17261 [0,2,0,0,0,0|0,0,0]=2 42 B12R1.118 CCC(Cc1ccccc1)NC 15961 [0,2,0,0,0,0|1,0,1]=4 43 B12R2.32 CNC1Cc2ccccc2C1 14897 [0,1,0,1,0,0|2,0,0]=4