0 B13R2.328 CC1=C2C=CC=CC2=NC(O)=C1 M6685 [0,0,0,0,0,0|4,0,0]=4 1 B13R2.328 CC1=NC2=C(C=CC=C2)C(=O)O1 M1949 [0,0,0,0,0,0|3,0,0]=3 2 B13R2.328 NC1=CC(=O)OC2=C1C=CC=C2 A15438 [0,0,0,0,0,0|3,0,1]=4 3 B13R2.328 NC1=NC2=C(C=CC=C2)C(=O)N1 A15472 [0,0,0,0,0,0|4,0,0]=4 4 B13R2.328 O=C1C=C(O)C2=CC=CC=C2O1 H1762 [0,0,0,0,0,0|2,0,2]=4 5 B13R2.328 O=C1CC2=C(C=CC=C2)C(=O)O1 H7527 [0,0,0,0,0,0|2,0,1]=3 6 B13R2.328 O=C1NC(=O)C2=C(C=CC=C2)O1 B6500 [0,0,0,0,0,0|2,0,1]=3 7 B13R2.328 O=C1NC(Cl)=NC2=C1C=CC=C2 C19400 [0,0,0,0,0,0|4,0,0]=4 8 B13R2.328 O=C1NC2=CC=CC=C2C(=O)O1 I16602 [0,0,0,0,0,0|2,0,1]=3 9 B12R2.1081 O=C1NN=CC2=CC=CC=C12 P11077 [1,0,0,0,0,0|3,0,0]=4 10 B12R2.1081 O=C1NN=NC2=CC=CC=C12 B16499 [1,0,0,0,0,0|3,0,0]=4 11 B14R2.8045 CC1=NC2=C(Br)C=CC=C2C(=O)O1 B19361 [0,1,0,0,0,0|3,0,0]=4 12 B14R2.8235 NC1=CC=C2NC(=O)OC(=O)C2=C1 A18689 [0,1,0,0,0,0|2,0,1]=4 13 B14R2.8235 O=C1NC2=C(C=C(O)C=C2)C(=O)O1 H8161 [0,1,0,0,0,0|2,0,1]=4 14 B14R2.8235 O=C1NC2=CC=C(F)C=C2C(=O)O1 F3984 [0,1,0,0,0,0|2,0,1]=4 15 B14R2.8235 O=C1NC2=CC=C(F)C=C2C(=O)O1 F3984 [0,1,0,0,0,0|2,0,1]=4 16 B14R2.29365 CC1=CC2=C(C=C1)C(=O)NC(=O)O2 M8089 [0,1,0,0,0,0|2,0,1]=4 17 B12R1.75 O=CC1=C(OC(F)F)C=CC=C1 D7899 [0,0,1,0,0,0|3,0,0]=4 18 B12R1.283 CCOC1=C(C(=O)O)C=CC=C1 E7704 [0,0,1,0,0,0|2,0,0]=3 19 B12R1.283 CCOC1=C(C(C)=O)C=CC=C1 E7636 [0,0,1,0,0,0|3,0,0]=4 20 B12R1.283 CCOC1=CC=CC=C1C(=O)Cl E4438 [0,0,1,0,0,0|3,0,0]=4 21 B12R1.308 CCCC(=O)C1=C(O)C=CC=C1 H7637 [0,0,1,0,0,0|3,0,0]=4 22 B12R1.308 CCOC(=O)C1=C(O)C=CN=C1 H14849 [0,0,1,0,0,0|3,0,0]=4 23 B12R1.308 CCOC(=O)C1=CC=NC=C1O E16239 [0,0,1,0,0,0|3,0,0]=4 24 B12R2.18 O=C1CC2=C(C=CC=C2)C1=O I12742 [0,0,0,0,1,0|2,0,1]=4 25 B12R2.18 O=C1NC2=CC=CC=C2C1=O I0531 [0,0,0,0,1,0|2,0,1]=4 26 B12R2.2028 O=C1NC(=O)C2=CC=CC=C12 P16661 [0,0,0,0,1,0|2,0,1]=4 27 B12R2.2028 O=C1OC(=O)C2=CC=CC=C12 P16660 [0,0,0,0,1,0|1,0,1]=3 28 B12R2.2028 O=C1OC(Br)C2=C1C=CC=C2 B9580 [0,0,0,0,1,0|2,0,0]=3 29 B11R1.53 COC1=C(C(=O)Cl)C=CC=C1 M7841 [1,0,1,0,0,0|2,0,0]=4 30 B11R1.53 COC1=NC=CC=C1C(=O)O M5360 [1,0,1,0,0,0|2,0,0]=4 31 B11R1.53 O=C(O)C1=CC=CC=C1CBr B0445 [1,0,1,0,0,0|2,0,0]=4 32 B11R1.53 O=C(O)C1=CC=CC=C1CCl C4255 [1,0,1,0,0,0|2,0,0]=4 33 B11R1.53 O=CC1=CC=CC=C1C(=O)O C6121 [1,0,1,0,0,0|1,0,1]=4 34 B11R1.222 CCC(=O)C1=C(O)C=CC=C1 H0511 [1,0,1,0,0,0|2,0,0]=4 35 B11R1.222 COC(=O)C1=C(O)C=CN=C1 H14883 [1,0,1,0,0,0|2,0,0]=4 36 B11R1.222 COC(=O)C1=CC=CC=C1C P3622 [1,0,1,0,0,0|2,0,0]=4 37 B11R1.222 COC(=O)C1=CC=CC=C1Cl M16628 [1,0,1,0,0,0|2,0,0]=4 38 B11R1.222 COC(=O)C1=CC=CC=C1N M16626 [1,0,1,0,0,0|2,0,0]=4 39 B11R1.222 COC(=O)C1=CC=NC=C1O M17192 [1,0,1,0,0,0|2,0,0]=4 40 B13R1.382 CCOC1=C(C(=O)OC)C=CC=C1 M8211 [0,1,1,0,0,0|2,0,0]=4 41 B13R1.572 CCCOC1=CC=CC=C1C(=O)O P11773 [0,1,1,0,0,0|2,0,0]=4 42 B13R1.572 O=C(O)C1=C(OCCO)C=CC=C1 H14862 [0,1,1,0,0,0|1,0,0]=3 43 B13R1.464 CCOC(=O)C1=C(OC)C=CC=C1 E8208 [0,1,1,0,0,0|2,0,0]=4 44 B13R1.4453 CCOC(=O)C1=C(O)C=CC=C1C M8217 [0,1,1,0,0,0|2,0,0]=4 45 B13R2.4857 O=C1OC(=O)C2=C1C=CC=C2Cl C8298 [0,1,0,0,1,0|1,0,1]=4 46 B13R2.4857 O=C1OC(=O)C2=C1C=CC=C2F F5241 [0,1,0,0,1,0|1,0,1]=4 47 B13R2.5187 CC1=CC2=C(C=C1)C(=O)OC2=O M0653 [0,1,0,0,1,0|1,0,1]=4 48 B13R2.5187 O=C1OC(=O)C2=C1C=CC(Br)=C2 B10173 [0,1,0,0,1,0|1,0,1]=4 49 B13R2.5187 O=C1OC(=O)C2=C1C=CC(Cl)=C2 C8299 [0,1,0,0,1,0|1,0,1]=4 50 B13R2.5187 O=C1OC(=O)C2=C1C=CC(Cl)=C2 C8299 [0,1,0,0,1,0|1,0,1]=4 51 B13R2.5187 O=C1OC(=O)C2=C1C=CC(F)=C2 F5242 [0,1,0,0,1,0|1,0,1]=4 52 B13R2.12159 O=C1OS(=O)(=O)C2=CC=CC=C12 S16664 [0,1,0,0,1,0|1,0,1]=4 53 B13R2.12159 O=C1O[IH2+]([O-])(O)C2=CC=CC=C12 H13416 [0,1,0,0,1,0|1,0,0]=3 54 B15R2.14951 O=C(O)C1=CC(=O)C2=C(C=CC=C2)O1 C8597 [0,2,0,0,0,0|2,0,0]=4