0 B11R1.91 c1ccc(cc1)CC[N+](=O)[O-] WXC02076 [1,0,0,0,0,0|2,0,1]=4 1 B13R1.353 CC(C)(C)C(=O)Nc1ccccc1 WXC02631 [0,1,0,0,0,0|2,0,1]=4 2 B13R1.3523 CS(=O)(=O)NCCc1ccccc1 WX682926 [0,0,0,0,0,1|2,0,1]=4 3 B10R1.17 C1C=CCC(=C1)CCCO WX640164 [2,0,0,0,0,0|0,0,2]=4 4 B12R1.125 c1ccc(c(c1)CCC(=O)O)F WXC03386 [1,1,0,0,0,0|1,0,1]=4 5 B12R1.226 c1cc(cc(c1)O)CCC(=O)O WXC02798 [1,1,0,0,0,0|1,0,1]=4 6 B12R1.564 CC(C)(C(=O)c1ccccc1)N WX600267 [0,1,0,0,1,0|1,0,1]=4 7 B12R1.564 CC(C)([C@@H](c1ccccc1)N)O WXC04676 [0,1,0,0,1,0|0,0,0]=2 8 B12R2.24 CC1CNc2ccccc2O1 WX602053 [1,0,0,1,0,0|1,0,0]=3 9 B12R2.24 CC1CNc2ccccc2S1 WX604425 [1,0,0,1,0,0|1,1,0]=4 10 B12R2.24 CC1COc2ccccc2N1 WX604081 [1,0,0,1,0,0|2,0,0]=4 11 B12R2.24 CC1CSc2ccccc2N1 WX604182 [1,0,0,1,0,0|2,0,0]=4 12 B12R2.24 c1ccc2c(c1)CC(CN2)N WX604740 [1,0,0,1,0,0|2,0,0]=4 13 B12R2.2403 CC1(CCc2c1cccc2)O WX644012 [1,0,0,1,0,0|0,0,0]=2 14 B12R2.2403 CC1(CNc2c1cccn2)C WXC02325 [1,0,0,1,0,0|2,0,0]=4 15 B14R2.29496 CC1(NC(=O)c2ccccc2O1)C WX619065 [0,1,0,1,0,0|1,0,1]=4 16 B10R1.28 CC(C)(c1ccccc1)N WX600125 [0,0,0,0,2,0|1,0,0]=3 17 B10R1.28 CC(C)(c1cccnc1)N WX600235 [0,0,0,0,2,0|2,0,0]=4 18 B12R1.252 CC(C)CNCc1ccccc1 WX600341 [1,0,0,0,0,1|0,0,0]=2 19 B12R1.252 c1ccc(cc1)CNCC(=O)O WX610175 [1,0,0,0,0,1|1,0,1]=4 20 B12R1.252 c1ccc(cc1)NCCC(=O)O WX665022 [1,0,0,0,0,1|1,0,1]=4