0 B12R2.18 CC1C(=O)Nc2ccccc12 T0538 [1,0,0,0,0,0|2,0,0]=3 1 B12R2.18 O=C1Nc2ccccc2C1=O T6862 [1,0,0,0,0,0|1,0,1]=3 2 B12R2.606 Clc1ccc2oc(=O)[nH]c2c1 T1650 [1,0,0,0,0,0|1,1,0]=3 3 B12R2.606 Clc1ccc2sc(=O)[nH]c2c1 T0577 [1,0,0,0,0,0|1,1,0]=3 4 B12R2.606 Oc1ccc2NC(=O)Cc2c1 T37710 [1,0,0,0,0,0|2,0,0]=3 5 B12R2.606 Oc1ccc2sc(=O)oc2c1 T0515 [1,0,0,0,0,0|3,0,0]=4 6 B12R2.612 OB1OCc2cc(F)ccc12 T3349 [1,0,0,0,0,0|3,0,0]=4 7 B12R2.612 Oc1n[nH]c2cc(F)ccc12 T5206 [1,0,0,0,0,0|2,0,0]=3 8 B14R2.1815 C[O]1C(=O)Nc2cc(C=O)ccc12 T32315 [0,1,0,0,0,0|3,0,0]=4 9 B12R1.20 N[C@H](C(O)=O)c1ccc(F)cc1 T21102 [0,0,1,0,0,0|3,0,0]=4 10 B12R1.20 OC(C(O)=O)c1ccc(O)cc1 T5263 [0,0,1,0,0,0|3,0,0]=4 11 B12R1.50 CCC(=O)Nc1cccc(O)c1 T34153 [0,0,1,0,0,0|3,0,0]=4 12 B12R1.50 CNC(=O)Oc1cccc(C)c1 T21216 [0,0,1,0,0,0|3,0,0]=4 13 B12R1.50 CSC(=O)Nc1cccc(O)c1 T30736 [0,0,1,0,0,0|3,0,0]=4 14 B12R1.50 O=C(NC1=CC=CC(C)=C1)CO T29382 [0,0,1,0,0,0|2,0,0]=3 15 B14R2.29365 Oc1ccc2c(O)cc(=O)oc2c1 T4137 [0,0,0,0,0,1|3,0,0]=4 16 B11R1.20 CC(=O)Nc1ccc(C)cc1 T33859 [1,0,1,0,0,0|2,0,0]=4 17 B11R1.20 CC(=O)Nc1ccc(O)cc1 T0065 [1,0,1,0,0,0|2,0,0]=4 18 B11R1.20 NC(=O)Nc1ccc(Cl)cc1 T20454 [1,0,1,0,0,0|0,1,0]=3 19 B11R1.20 NC(Nc1ccc(cc1)Cl)=N T21703 [1,0,1,0,0,0|1,1,0]=4 20 B11R1.36 OC(C(O)=O)c1ccccc1 T33320 [1,0,1,0,0,0|2,0,0]=4 21 B11R1.36 OC(C(O)=O)c1ccccc1 T4848 [1,0,1,0,0,0|2,0,0]=4 22 B11R1.36 OC(C([O-])=O)c1ccccc1 T30005 [1,0,1,0,0,0|2,0,0]=4 23 B11R1.36 O[C@@H](C(O)=O)c1ccccc1 T2S0122 [1,0,1,0,0,0|2,0,0]=4 24 B11R1.40 C=CC(Nc1ccccc1)=O T9322 [1,0,1,0,0,0|2,0,0]=4 25 B11R1.157 CC(=O)Nc1cccc(C)c1 T21117 [1,0,1,0,0,0|2,0,0]=4 26 B11R1.157 CC(=O)Nc1cccc(O)c1 T0914 [1,0,1,0,0,0|2,0,0]=4 27 B11R1.157 Cc1cccc(CC(O)=O)c1 T19409 [1,0,1,0,0,0|2,0,0]=4 28 B11R1.157 NC(=O)Nc1cccc(O)c1 T21201 [1,0,1,0,0,0|1,0,0]=3 29 B11R1.157 OC(=O)Cc1cccc(O)c1 T4829 [1,0,1,0,0,0|2,0,0]=4 30 B11R2.1 Cc1c[nH]c2ccccc12 T5281 [2,0,0,0,0,0|2,0,0]=4 31 B11R2.10 O=C1Cc2ccccc2N1 Fr16741 [2,0,0,0,0,0|1,0,0]=3 32 B11R2.10 O=c1[nH]c2ccccc2[nH]1 T0662 [2,0,0,0,0,0|0,0,0]=2 33 B11R2.10 O=c1[nH]c2ccccc2o1 T5572 [2,0,0,0,0,0|1,0,0]=3 34 B11R2.10 [S-]c1nc2ccccc2[nH]1 T21238 [2,0,0,0,0,0|0,1,1]=4 35 B11R2.36 Brc1ccc2[nH]ccc2c1 T7473 [2,0,0,0,0,0|1,1,0]=4 36 B11R2.36 Oc1ccc2cc[nH]c2c1 T5682 [2,0,0,0,0,0|2,0,0]=4 37 B13R2.135 CCn1c2ccccc2[nH]c1=O T2604 [1,1,0,0,0,0|1,0,0]=3 38 B13R2.135 O/N=C1\C(=O)Nc2ccccc12 T21219 [1,1,0,0,0,0|1,0,0]=3 39 B13R2.2121 COc1ccc2[nH]c(=O)oc2c1 T2S2108 [1,1,0,0,0,0|2,0,0]=4 40 B15R2.37942 CCn1c2cc(Cl)c(Cl)cc2[nH]c1=O T10977 [0,2,0,0,0,0|1,1,0]=4 41 B15R2.22335 Cn1c2ccc(C=O)cc2n(C)c1=O T4239 [0,2,0,0,0,0|2,0,0]=4 42 B15R2.6574 Cc1c2NC(=O)/C(=N\O)c2ccc1Cl T24969 [0,2,0,0,0,0|1,1,0]=4 43 B15R2.6574 O/N=C1/C(=O)Nc2c1ccc(Cl)c2Cl T4612 [0,2,0,0,0,0|1,1,0]=4 44 B11R1.23 NNC(=O)c1cccc(O)c1 T21202 [0,0,1,0,1,0|2,0,0]=4 45 B13R2.328 Oc1cc(=O)oc2ccccc12 PDK0015 [1,0,0,0,0,1|2,0,0]=4 46 B13R2.369 CN1Cc2ccccc2NC1=O T50006 [1,0,0,0,0,1|1,0,0]=3 47 B13R2.369 Cc1cc2ccccc2[nH]c1=O T50035 [1,0,0,0,0,1|2,0,0]=4 48 B13R2.369 O=c1[nH]c2ccccc2[nH]c1=O T20436 [1,0,0,0,0,1|1,0,1]=4 49 B13R2.369 Oc1cc2ccccc2oc1=O T8002 [1,0,0,0,0,1|2,0,0]=4