0 B12R1.4 COc1ccc(CC(=O)O)cc1 T5590 [0,0,0,0,0,0|1,0,0]=1 1 B11R1.20 CC(=O)Nc1ccc(O)cc1 T0065 [1,0,0,0,0,0|1,0,0]=2 2 B11R1.20 CC(=O)Oc1ccc(O)cc1 T8704 [1,0,0,0,0,0|1,0,0]=2 3 B11R1.20 O=C(O)Cc1ccc(O)cc1 T3743 [1,0,0,0,0,0|1,0,0]=2 4 B11R1.20 [C@H](C)(N)Cc1ccc(O)cc1 T8577 [1,0,0,0,0,0|1,0,1]=3 5 B11R1.83 C=CCc1ccc(OC)cc1 T5649 [1,0,0,0,0,0|0,0,1]=2 6 B11R1.83 C\C=C\c1ccc(OC)cc1 T0014 [1,0,0,0,0,0|0,0,1]=2 7 B11R1.83 C\C=C\c1ccc(OC)cc1 T0762 [1,0,0,0,0,0|0,0,1]=2 8 B13R1.35 COC1=C(O)C=C(CC(=O)O)C=C1 T0542 [0,1,0,0,0,0|1,0,0]=2 9 B13R1.142 CCOC1=CC=C(NC(C)=O)C=C1 T0778 [0,1,0,0,0,0|1,0,0]=2 10 B13R1.585 CC(=O)Nc1ccc(C(=O)O)cc1 T0315 [0,1,0,0,0,0|3,0,0]=4 11 B11R1.3 COC1=CC=C(C(=O)O)C=C1 TCS0862 [0,0,0,0,1,0|1,0,0]=2 12 B11R1.3 NCc1ccc(C(=O)O)cc1 T1252 [0,0,0,0,1,0|3,0,0]=4 13 B11R1.3 O=Cc1ccc(C(=O)O)cc1 T1691 [0,0,0,0,1,0|3,0,0]=4 14 B13R1.3 COc1ccc(CCC(C)=O)cc1 Fr12339 [0,0,0,0,0,1|0,0,0]=1 15 B13R1.3 COc1ccc(\C=C\C(=O)O)cc1 T5875 [0,0,0,0,0,1|1,0,1]=3 16 B10R1.1 N#CCc1ccc(O)cc1 Fr16745 [2,0,0,0,0,0|1,0,1]=4 17 B10R1.1 NCCC1=CC=C(O)C=C1 T0307 [2,0,0,0,0,0|1,0,1]=4 18 B10R1.1 NCCc1ccc(O)cc1 T3095 [2,0,0,0,0,0|1,0,1]=4 19 B10R1.1 NCCc1ccc(O)cc1 T7851 [2,0,0,0,0,0|1,0,1]=4 20 B10R1.1 OCCc1ccc(O)cc1 T2861 [2,0,0,0,0,0|0,0,2]=4 21 B10R1.18 CC(=O)Oc1ccccc1 T0650 [2,0,0,0,0,0|1,0,0]=3 22 B10R1.18 O=C(O)Cc1cccnc1 T1366 [2,0,0,0,0,0|2,0,0]=4 23 B10R1.3 COc1ccc(C=O)cc1 T7910 [2,0,0,0,0,0|0,0,0]=2 24 B12R1.19 CC(=O)NC1=CC(O)=C(O)C=C1 T19175 [1,1,0,0,0,0|1,0,0]=3 25 B12R1.19 O=C(O)Cc1ccc(O)c(O)c1 T4907 [1,1,0,0,0,0|1,0,0]=3 26 B12R1.20 N[C@H](C(=O)O)C1=CC=C(F)C=C1 T21102 [1,1,0,0,0,0|2,0,0]=4 27 B12R1.20 N[C@H](C(=O)O)c1ccc(O)cc1 T4785 [1,1,0,0,0,0|1,0,0]=3 28 B12R1.20 O=C(O)C(O)c1ccc(O)cc1 T5263 [1,1,0,0,0,0|1,0,0]=3 29 B12R1.49 COC(=O)Cc1ccc(O)cc1 TN1436 [1,1,0,0,0,0|0,0,0]=2 30 B12R1.48 COC1=C(O)C=C(C(C)=O)C=C1 T10112 [0,1,0,0,1,0|0,0,0]=2 31 B12R1.48 COc1ccc(C(=O)O)cc1O T5767 [0,1,0,0,1,0|1,0,0]=3 32 B12R1.452 COc1ccc(C(=O)O)c(O)c1 T2A2428 [0,1,0,0,1,0|1,0,0]=3 33 B12R1.452 COc1ccc(C(C)=O)c(O)c1 T2900 [0,1,0,0,1,0|0,0,0]=2 34 B14R1.3653 COc1ccc(\C=C\C(=O)O)cc1O T2889 [0,1,0,0,0,1|1,0,1]=4 35 B14R1.3651 COc1ccc(CC(=O)O)cc1OC T0568 [0,2,0,0,0,0|1,0,0]=3 36 B14R1.805 CC(=O)Nc1ccc(CC(=O)O)cc1 T0310 [0,2,0,0,0,0|2,0,0]=4 37 B12R1.453 COC1=CC(C(C)=O)=C(O)C=C1 T3760 [0,0,1,1,0,0|1,0,1]=4 38 B12R2.606 O=c1oc2cc(O)ccc2s1 T0515 [1,0,0,1,0,0|2,0,0]=4 39 B14R2.134 COc1ccc2ccc(=O)oc2c1 T7049 [0,0,0,1,0,1|1,0,1]=4 40 B14R2.1008 O=C(O)Cc1ccc2c(c1)CCO2 T1359 [0,1,0,1,0,0|1,0,0]=3 41 B10R1.13 CC(=O)C1=CC=C(O)C=C1 T3750 [1,0,0,0,1,0|0,0,0]=2 42 B10R1.13 Cc1ccc(C(=O)O)cc1 Fr14438 [1,0,0,0,1,0|1,0,0]=3 43 B10R1.13 Nc1ccc(C(=O)O)cc1 T1311 [1,0,0,0,1,0|2,0,0]=4 44 B10R1.13 O=C(O)C1=CC=C(O)C=C1 T2989 [1,0,0,0,1,0|1,0,0]=3 45 B10R1.13 O=C(O)c1ccc(O)nc1 T4816 [1,0,0,0,1,0|2,0,0]=4 46 B12R1.21 CC(=O)CCc1ccc(O)cc1 T2S0633 [1,0,0,0,0,1|0,0,0]=2 47 B12R1.21 CN(C)CCc1ccc(O)cc1 T2890 [1,0,0,0,0,1|2,0,0]=4 48 B12R1.21 O=C(O)CCc1ccc(O)cc1 T2862 [1,0,0,0,0,1|1,0,0]=3 49 B12R1.21 O=C(O)\C=C\c1ccc(O)cc1 T2863 [1,0,0,0,0,1|1,0,1]=4 50 B12R1.21 O=C(O)\C=C\c1ccc(O)cc1 T7053 [1,0,0,0,0,1|1,0,1]=4 51 B12R1.438 COc1cccc(CC(=O)O)c1 Fr13883 [0,0,0,0,1,1|1,0,0]=3