0 B13R2.369 NC1=C(N)C=C2C=CC=CC2=C1 T18881 [0,0,0,0,0,0|3,0,0]=3 1 B13R2.369 NC1=Cc2ccccc2OC1=O TN1243 [0,0,0,0,0,0|1,0,0]=1 2 B13R2.369 O=C1Oc2ccccc2C=C1O T8002 [0,0,0,0,0,0|0,0,0]=0 3 B12R2.24 O=C1CCc2ccccc2C1 T0660 [1,0,0,0,0,0|1,0,2]=4 4 B12R2.24 O=C1CCc2ccccc2O1 T2S0300 [1,0,0,0,0,0|0,0,2]=3 5 B12R2.24 O=c1ccc2ccccc2o1 T0775 [1,0,0,0,0,0|0,0,0]=1 6 B12R2.24 Oc1ccc2ccccc2c1 T0671 [1,0,0,0,0,0|1,0,0]=2 7 B14R2.8239 O=c1ccc2cc(O)c(O)cc2o1 T2798 [0,1,0,0,0,0|2,0,1]=4 8 B12R1.43 N[C@@H](Cc1ccccc1)C(=O)O T3377 [0,0,1,0,0,0|1,0,2]=4 9 B12R1.43 N[C@@H](Cc1ccccc1)C(=O)O TN1592 [0,0,1,0,0,0|1,0,2]=4 10 B12R1.43 N[C@H](Cc1ccccc1)C(=O)O T0689 [0,0,1,0,0,0|1,0,2]=4 11 B12R1.43 O=C(O)C(=O)Cc1ccccc1 T5251 [0,0,1,0,0,0|0,0,2]=3 12 B12R1.43 O=C(O)C(O)Cc1ccccc1 T4455 [0,0,1,0,0,0|0,0,2]=3 13 B12R1.43 O=C(O)[C@@H](O)Cc1ccccc1 T5290 [0,0,1,0,0,0|0,0,2]=3 14 B12R1.43 O=C(O)[C@H](O)Cc1ccccc1 T5274 [0,0,1,0,0,0|0,0,2]=3 15 B12R1.43 O=C([O-])C(=O)Cc1ccccc1 T4891 [0,0,1,0,0,0|0,0,3]=4 16 B12R2.18 CC1C(=O)Nc2ccccc21 T0538 [0,0,0,0,1,0|2,0,1]=4 17 B12R2.18 O=C1Nc2ccccc2C1=O T6862 [0,0,0,0,1,0|1,0,1]=3 18 B11R1.91 CC(=O)\C=C\c1ccccc1 TCS1554 [1,0,1,0,0,0|1,0,0]=3 19 B11R1.91 O=C(O)CCc1ccccc1 T3731 [1,0,1,0,0,0|0,0,2]=4 20 B11R1.91 O=C(O)\C=C\c1ccccc1 T2740 [1,0,1,0,0,0|0,0,0]=2 21 B11R1.91 O=C(O)\C=C\c1ccccc1 T5646 [1,0,1,0,0,0|0,0,0]=2 22 B11R1.86 O=C(O)Cc1ccccc1O T5308 [1,0,1,0,0,0|0,0,1]=3 23 B13R1.133 O=C(O)C(=O)Cc1ccc(O)cc1 T4858 [0,1,1,0,0,0|0,0,2]=4 24 B13R1.133 O=C(O)C(O)Cc1ccc(O)cc1 TQ0284 [0,1,1,0,0,0|0,0,2]=4 25 B13R1.152 N[C@@H](c1ccccc1)[C@@H](O)C(=O)O T5683 [0,1,1,0,0,0|0,0,2]=4 26 B13R2.57 COc1ccc2ccccc2c1 T0573 [1,1,0,0,0,0|1,0,0]=3 27 B13R2.155 Cc1ccc2ccc(=O)oc2c1 T7934 [1,1,0,0,0,0|0,0,0]=2 28 B13R2.155 O=c1ccc2ccc(O)cc2o1 T1693 [1,1,0,0,0,0|0,0,0]=2 29 B13R2.162 O=C1C=CC2=C(N1)C(O)=CC=C2 T2291 [1,1,0,0,0,0|1,0,0]=3 30 B13R2.328 O=C1NC(=O)c2ccccc2N1 T8020 [1,1,0,0,0,0|2,0,0]=4 31 B13R2.328 O=c1cc(O)c2ccccc2o1 PDK0015 [1,1,0,0,0,0|0,0,0]=2 32 B13R2.328 O=c1nc(=O)c2ccccc2o1 T0258 [1,1,0,0,0,0|1,0,0]=3 33 B13R2.3683 Cc1ccc2oc(=O)ccc2c1 T5647 [1,1,0,0,0,0|0,0,0]=2 34 B13R2.3683 O=c1ccc2cc(O)ccc2o1 T2S0357 [1,1,0,0,0,0|0,0,0]=2 35 B13R2.5179 O=c1ccoc2cc(O)ccc12 T7345 [1,1,0,0,0,0|2,0,0]=4 36 B15R2.984 CC(=O)c1cc2ccccc2oc1=O Fr12596 [0,2,0,0,0,0|0,0,1]=3 37 B15R2.984 O=C(O)C1=CC2=CC=CC=C2OC1=O TJS0339 [0,2,0,0,0,0|0,0,0]=2 38 B15R2.984 O=C1OC2=CC=CC=C2C=C1[N+](=O)[O-] T10115 [0,2,0,0,0,0|0,0,1]=3 39 B11R1.36 C=C(C(=O)O)c1ccccc1 T0629 [0,0,1,0,1,0|1,0,0]=3 40 B11R1.36 O=C(O)C(=O)c1ccccc1 T8025 [0,0,1,0,1,0|0,0,1]=3 41 B11R1.36 O=C(O)C(O)c1ccccc1 T4848 [0,0,1,0,1,0|0,0,1]=3 42 B11R1.36 O=C(O)[C@H](O)c1ccccc1 T2S0122 [0,0,1,0,1,0|0,0,1]=3 43 B11R2.1 O=C1CCc2ccccc21 T0564 [1,0,0,0,1,0|0,0,2]=4 44 B11R2.10 O=C1Cc2ccccc2N1 Fr16741 [1,0,0,0,1,0|1,0,1]=4 45 B11R2.10 O=c1nc2ccccc2n1 T0662 [1,0,0,0,1,0|2,0,0]=4