0 B12R2.612 Clc1ccc2c(c1)s[nH]c2=O T20972 [0,0,0,0,0,0|0,1,2]=3 1 B12R2.612 Fc1ccc2c(c1)s[nH]c2=O T5601 [0,0,0,0,0,0|0,2,2]=4 2 B12R2.612 OB1OCc2cc(Cl)ccc12 T4040 [0,0,0,0,0,0|3,0,0]=3 3 B12R2.612 OB1OCc2cc(F)ccc12 T3349 [0,0,0,0,0,0|3,1,0]=4 4 B12R2.612 Oc1n[nH]c2cc(F)ccc12 T5206 [0,0,0,0,0,0|1,1,0]=2 5 B11R2.1 Cc1c[nH]c2ccccc12 T5281 [1,0,0,0,0,0|3,0,0]=4 6 B11R2.1 Nn1nnc2ccccc12 T5953 [1,0,0,0,0,0|3,0,0]=4 7 B11R2.1 O=C1CCc2ccccc12 T0564 [1,0,0,0,0,0|2,0,1]=4 8 B11R2.36 Oc1ccc2OCOc2c1 T3676 [1,0,0,0,0,0|3,0,0]=4 9 B11R2.36 Oc1ccc2cc[nH]c2c1 T5682 [1,0,0,0,0,0|3,0,0]=4 10 B11R1.22 C/C(=N\O)c1ccc(O)cc1 T10143 [0,0,1,0,0,0|2,0,0]=3 11 B11R1.22 Clc1ccc(cc1)C(=O)CBr T8908 [0,0,1,0,0,0|2,0,1]=4 12 B11R1.166 CC(=O)c1ccc(C)cc1O Fr14298 [0,0,1,0,0,0|2,0,1]=4 13 B11R1.166 CC(=O)c1ccc(O)cc1O T3751 [0,0,1,0,0,0|2,0,1]=4 14 B11R1.166 Cc1ccc(C(O)=O)c(O)c1 T22225 [0,0,1,0,0,0|2,0,0]=3 15 B11R1.166 Nc1ccc(C(O)=O)c(O)c1 T0441 [0,0,1,0,0,0|2,0,0]=3 16 B11R1.166 Nc1ccc(C(O)=O)c(O)c1 T1296 [0,0,1,0,0,0|2,0,0]=3 17 B11R1.166 Nc1ccc(C([O-])=O)c(O)c1 T0020 [0,0,1,0,0,0|2,0,1]=4 18 B11R1.166 OC(=O)c1ccc(Cl)cc1O T0666 [0,0,1,0,0,0|1,0,0]=2 19 B11R1.166 OC(=O)c1ccc(O)cc1O T5890 [0,0,1,0,0,0|2,0,0]=3 20 B13R2.3683 Oc1ccc2cc(Br)ccc2c1 T9432 [0,0,0,0,0,1|2,1,0]=4 21 B13R2.5179 Clc1ccc2C(=O)CCCc2c1 T21355 [0,0,0,0,0,1|2,0,1]=4 22 B13R2.5179 Oc1ccc2c(c1)occc2=O T7345 [0,0,0,0,0,1|2,0,1]=4 23 B10R1.13 Cc1ccc(cc1)C(O)=O Fr14438 [1,0,1,0,0,0|1,0,1]=4 24 B10R1.13 Nc1ccc(cc1)C(O)=O T1311 [1,0,1,0,0,0|1,0,1]=4 25 B10R1.13 OC(=O)c1ccc(O)cc1 T2989 [1,0,1,0,0,0|1,0,1]=4 26 B10R1.15 NC(=NO)c1ccccn1 T20580 [1,0,1,0,0,0|2,0,0]=4 27 B10R1.15 OCC(O)c1ccccc1 T1346 [1,0,1,0,0,0|1,0,1]=4 28 B10R1.17 OCCOc1ccccc1 T20293 [1,0,1,0,0,0|1,0,1]=4 29 B10R1.25 Cc1ccc(C=O)c(O)c1 T36786 [1,0,1,0,0,0|1,0,1]=4 30 B10R1.25 Oc1ccc(C=O)c(O)c1 TN7051 [1,0,1,0,0,0|1,0,1]=4 31 B10R1.30 COc1cc(C)ccc1O T20446 [1,0,1,0,0,0|2,0,0]=4 32 B10R1.30 COc1cc(N)ccc1O T21072 [1,0,1,0,0,0|2,0,0]=4 33 B10R1.61 CC(=O)c1ccccc1O TCS1856 [1,0,1,0,0,0|1,0,1]=4 34 B10R1.61 Cc1ccccc1C(O)=O T8068 [1,0,1,0,0,0|2,0,0]=4 35 B10R1.61 NC(=O)c1ccccc1O T0004 [1,0,1,0,0,0|0,0,2]=4 36 B10R1.61 OC(=O)c1ccccc1I T20881 [1,0,1,0,0,0|2,0,0]=4 37 B10R1.61 OC(=O)c1ccccc1O T0649 [1,0,1,0,0,0|1,0,0]=3 38 B10R1.61 OC(=O)c1ccccc1O T27597 [1,0,1,0,0,0|1,0,0]=3 39 B10R1.61 OC(=O)c1ncccc1O T5986 [1,0,1,0,0,0|2,0,0]=4 40 B10R1.61 Oc1ccccc1C(S)=S T31535 [1,0,1,0,0,0|1,1,0]=4 41 B10R1.61 Oc1ccccc1C([O-])=O T0335 [1,0,1,0,0,0|1,0,1]=4 42 B10R1.61 Oc1ccccc1C([O-])=O T20668 [1,0,1,0,0,0|1,0,1]=4 43 B10R2.7 C1Cc2ccccc2O1 Fr14127 [2,0,0,0,0,0|1,0,1]=4 44 B10R2.7 c1[nH]nc2ccccc12 T2192 [2,0,0,0,0,0|1,0,1]=4 45 B10R2.7 c1cc2ccccc2[nH]1 T4799 [2,0,0,0,0,0|2,0,0]=4 46 B12R1.226 Cc1cccc(OCC(O)=O)c1 T21217 [0,1,1,0,0,0|2,0,0]=4 47 B12R1.452 COc1ccc(C(O)=O)c(O)c1 T2A2428 [0,1,1,0,0,0|2,0,0]=4 48 B12R1.893 OC(=O)c1ccc(O)c(O)c1O T8023 [0,1,1,0,0,0|2,0,0]=4 49 B12R1.1000 Cc1cc(O)cc(O)c1C(O)=O T2839 [0,1,1,0,0,0|2,0,0]=4 50 B12R1.1000 OC(=O)c1c(O)cc(O)cc1O TN2710 [0,1,1,0,0,0|2,0,0]=4 51 B12R2.1 O=Cc1coc2ccccc12 T7973 [1,1,0,0,0,0|1,0,1]=4 52 B12R2.1 OCc1c[nH]c2ccccc12 T2947 [1,1,0,0,0,0|2,0,0]=4 53 B14R2.29365 Oc1ccc2c(O)cc(=O)oc2c1 T4137 [0,1,0,0,0,1|2,0,0]=4 54 B12R1.233 OC(=O)Cc1ccc(O)cc1O TMA1130 [0,0,1,0,0,1|2,0,0]=4