0 B13R2.32 c1ccc2c(c1)CCC(C2O)Br MB00774 [1,0,0,0,0,0|2,0,1]=4 1 B13R2.369 CC1C(=O)Nc2c(cccn2)O1 AB65764 [1,0,0,0,0,0|3,0,0]=4 2 B13R2.369 CC1C(=O)Nc2ccccc2N1 PB10143 [1,0,0,0,0,0|2,0,0]=3 3 B13R2.369 CC1Cc2ccccc2NC1=O MB08929 [1,0,0,0,0,0|1,0,0]=2 4 B13R2.369 c1ccc2=NC(=O)C(C=c2c1)Br MB06803 [1,0,0,0,0,0|1,0,2]=4 5 B13R2.369 c1ccc2=NC(=O)C(N=c2c1)Cl PB24182 [1,0,0,0,0,0|2,0,1]=4 6 B13R2.369 c1ccc2=NC(=O)C(N=c2c1)N PB34919 [1,0,0,0,0,0|1,0,1]=3 7 B13R1.135 COC(=O)C(Cc1ccccc1)N AB01980 [0,0,1,0,0,0|2,0,0]=3 8 B13R1.135 COC(=O)[C@H](Cc1ccccc1)N AB01100 [0,0,1,0,0,0|2,0,0]=3 9 B12R1.121 COc1ccccc1CCC=O AB42265 [1,0,1,0,0,0|2,0,0]=4 10 B12R1.43 C[C@@H](C(=O)Nc1ccccc1)O AB72181 [1,0,1,0,0,0|1,0,0]=3 11 B12R1.43 c1cc(cnc1)CC(C(=O)O)N AB11720 [1,0,1,0,0,0|1,0,0]=3 12 B12R1.43 c1cc(cnc1)C[C@@H](C(=O)O)N AB03059 [1,0,1,0,0,0|1,0,0]=3 13 B12R1.43 c1cc(cnc1)C[C@H](C(=O)O)N AB03057 [1,0,1,0,0,0|1,0,0]=3 14 B12R1.43 c1cc(cnc1)C[C@H](C(=O)O)N AB13745 [1,0,1,0,0,0|1,0,0]=3 15 B12R1.43 c1ccc(cc1)CC(C(=O)O)N AB02573 [1,0,1,0,0,0|0,0,0]=2 16 B12R1.43 c1ccc(cc1)C[C@@H](C(=O)O)N AB02575 [1,0,1,0,0,0|0,0,0]=2 17 B12R1.43 c1ccc(cc1)C[C@H](C(=O)O)Br AB04813 [1,0,1,0,0,0|1,0,0]=3 18 B12R1.43 c1ccc(cc1)C[C@H](C(=O)O)N AB00345 [1,0,1,0,0,0|0,0,0]=2 19 B12R1.43 c1ccnc(c1)CC(C(=O)O)N AB05436 [1,0,1,0,0,0|1,0,0]=3 20 B12R1.43 c1ccnc(c1)C[C@H](C(=O)O)N AB05414 [1,0,1,0,0,0|1,0,0]=3 21 B12R1.43 c1cnccc1CC(C(=O)O)N AB21677 [1,0,1,0,0,0|1,0,0]=3 22 B12R1.43 c1cnccc1C[C@H](C(=O)O)N AB10088 [1,0,1,0,0,0|1,0,0]=3 23 B12R1.34 CN(c1ccccc1)C(=O)CO AB13884 [1,0,1,0,0,0|2,0,0]=4 24 B12R1.283 c1ccc(c(c1)CCN)[N+](=O)[O-] AB23295 [1,0,1,0,0,0|0,0,2]=4 25 B12R2.24 c1cc2c(nc1)CCC(=O)C2 AB26260 [2,0,0,0,0,0|2,0,0]=4 26 B12R2.24 c1cc2c(nc1)NC(=O)CC2 PB12351 [2,0,0,0,0,0|1,0,0]=3 27 B12R2.24 c1ccc2c(c1)CC(=O)NC2 AB15535 [2,0,0,0,0,0|2,0,0]=4 28 B12R2.24 c1ccc2c(c1)CC(CO2)N AB18483 [2,0,0,0,0,0|1,0,1]=4 29 B12R2.24 c1ccc2c(c1)CC(CS2)N AB18484 [2,0,0,0,0,0|1,0,1]=4 30 B12R2.24 c1ccc2c(c1)CCC(C2)N AB02010 [2,0,0,0,0,0|1,0,1]=4 31 B12R2.24 c1ccc2c(c1)C[C@@H](CO2)N AB56580 [2,0,0,0,0,0|1,0,1]=4 32 B12R2.24 c1ccc2c(c1)C[C@H](CO2)N AB56598 [2,0,0,0,0,0|1,0,1]=4 33 B12R2.24 c1ccc2c(c1)NC(=O)CO2 AB04166 [2,0,0,0,0,0|1,0,0]=3 34 B12R2.24 c1ccc2c(c1)NCC(=O)N2 AB04744 [2,0,0,0,0,0|1,0,0]=3 35 B12R2.24 c1cncc2c1CCC(=O)N2 MB05928 [2,0,0,0,0,0|1,0,0]=3 36 B12R2.24 c1cncc2c1NC(=O)CC2 MB05707 [2,0,0,0,0,0|1,0,0]=3 37 B14R1.3135 COc1ccccc1CC(C(=O)O)N AB14409 [0,1,1,0,0,0|2,0,0]=4 38 B14R1.3135 COc1ccccc1C[C@@H](C(=O)O)N AB09424 [0,1,1,0,0,0|2,0,0]=4 39 B14R1.3135 COc1ccccc1C[C@H](C(=O)O)N AB15916 [0,1,1,0,0,0|2,0,0]=4 40 B14R1.134 COC(=O)[C@@H](Cc1ccc(cc1)N)N AB25031 [0,1,1,0,0,0|2,0,0]=4 41 B14R1.1031 COC(=O)[C@@H](Cc1ccccc1)CN MB69440 [0,1,1,0,0,0|2,0,0]=4 42 B14R2.29369 CN1c2ccc(cc2CCC1=O)Br PB13814 [1,1,0,0,0,0|1,0,0]=3 43 B14R2.639 CC1(C(=O)Nc2ccccc2O1)C AB64917 [1,1,0,0,0,0|2,0,0]=4 44 B14R2.8239 CC1C(=O)Nc2cc(ccc2O1)Br MB06176 [1,1,0,0,0,0|2,0,0]=4 45 B14R2.8239 CC1C(=O)Nc2cc(ccc2O1)Cl MB02033 [1,1,0,0,0,0|2,0,0]=4 46 B14R2.8239 CC1C(=O)Nc2cc(ccc2O1)N AB09976 [1,1,0,0,0,0|2,0,0]=4 47 B14R2.8239 CC1C(=O)Nc2ccc(cc2O1)N AB54532 [1,1,0,0,0,0|2,0,0]=4 48 B14R2.8239 c1cc2c(cc1Cl)NC(=O)C(C2)N AB27601 [1,1,0,0,0,0|0,0,0]=2 49 B14R2.28472 CC1C(=O)Nc2cccc(c2O1)N MB05445 [1,1,0,0,0,0|2,0,0]=4