0 B14R2.28472 O=C1NC2=C(NC1=O)C(O)=CC=C2 Y4363 [0,0,0,0,0,0|2,0,1]=3 1 B13R2.162 BrC1=CC=C2C=CC=C(Br)C2=N1 Z5228 [1,0,0,0,0,0|1,1,1]=4 2 B13R2.162 CC1=NC2=C(C=C1)N=CC=C2Cl 3778AJ [1,0,0,0,0,0|2,0,1]=4 3 B13R2.162 NC1=C2N=C(Cl)C=CC2=CC=C1 2067AL [1,0,0,0,0,0|2,0,1]=4 4 B13R2.162 O=C1C=C2C(Br)=CC=CC2=CN1 Y5733 [1,0,0,0,0,0|2,1,0]=4 5 B13R2.162 O=C1COC2=C(C1)C(Cl)=CC=C2 2517AA [1,0,0,0,0,0|2,0,1]=4 6 B13R2.369 CC1=C(C)N=C2C=CC=CC2=C1 8854AA [1,0,0,0,0,0|2,0,1]=4 7 B13R2.369 CC1=CC2=C(C=CN=C2)C=C1O 0240AC [1,0,0,0,0,0|3,0,0]=4 8 B13R2.369 CC1=CC2=CC=CC=C2N=C1N 2809AA [1,0,0,0,0,0|2,0,1]=4 9 B13R2.369 CC1=CC2=CC=CC=C2NC1=O 2544AB [1,0,0,0,0,0|1,0,0]=2 10 B13R2.369 CC1SC2=CC=CC=C2NC1=O 8425AE [1,0,0,0,0,0|2,0,1]=4 11 B13R2.369 NC1=NC2=C(C=CC=C2)C=C1Cl 6755AB [1,0,0,0,0,0|2,0,1]=4 12 B13R2.369 NC1=NC2=CC=CC=C2NC1=O 2364AL [1,0,0,0,0,0|2,0,0]=3 13 B13R2.369 O=C1NC2=CC=CC=C2C=C1Cl 6012AC [1,0,0,0,0,0|1,0,0]=2 14 B13R2.5179 BrC1=C2N=CC(I)=CC2=CC=C1 Y6498 [1,0,0,0,0,0|1,1,1]=4 15 B13R2.5179 CC1=CC2=CC=CC(C)=C2C=C1 5914AE [1,0,0,0,0,0|3,0,0]=4 16 B13R2.5179 NC1=C2C=CC(Br)=CC2=CC=C1 X5325 [1,0,0,0,0,0|3,0,0]=4 17 B13R2.5179 NC1=C2N=CC(I)=CC2=CC=C1 4280AE [1,0,0,0,0,0|2,0,1]=4 18 B13R2.5179 NC1=CC2=C(C=C1)C(Cl)=CC=N2 6223AB [1,0,0,0,0,0|3,0,0]=4 19 B13R2.5179 NC1=CC2=C(C=C1)C(Cl)=NC=C2 4216AB [1,0,0,0,0,0|3,0,0]=4 20 B13R2.5179 O=C1CNC2=C(C=CC=C2Cl)N1 7370AA [1,0,0,0,0,0|1,0,2]=4 21 B13R2.5179 OC1=CC=CC2=C1N=CC(Cl)=C2 2407AL [1,0,0,0,0,0|2,0,1]=4 22 B12R1.371 O=C(CS)NC1=CC=CC=C1Cl 5539AD [1,0,1,0,0,0|0,1,1]=4 23 B12R1.226 CC(=O)\C=C\C1=CC=CC(Br)=C1 V7132 [1,0,1,0,0,0|1,1,0]=4 24 B12R1.226 NC(=O)C=CC1=CC(F)=CC=C1 0635AQ [1,0,1,0,0,0|0,1,0]=3 25 B12R1.226 NC(=O)\C=C\C1=CC(Br)=CC=C1 1108AC [1,0,1,0,0,0|0,1,0]=3 26 B12R2.24 FC1=CN=C2C=CC=CC2=C1 5204AB [2,0,0,0,0,0|1,0,1]=4 27 B12R2.24 IC1=CC=C2C=CC=CC2=N1 0061AC [2,0,0,0,0,0|1,0,1]=4 28 B12R2.24 OC1=CC2=CN=CC=C2C=C1 Y7545 [2,0,0,0,0,0|2,0,0]=4 29 B12R2.24 SC1=CC2=CC=CC=C2N=C1 Y4019 [2,0,0,0,0,0|0,1,1]=4 30 B12R2.1081 OC1=C2N=CC=CC2=CC=C1 I394 [2,0,0,0,0,0|1,0,1]=4 31 B14R2.142 O=CC1=NC2=C(Br)C=CC=C2C=C1 3088AL [1,1,0,0,0,0|0,1,1]=4 32 B14R2.8045 O=C1CC(=O)C2=CC=CC(F)=C2N1 7386AA [1,1,0,0,0,0|0,1,1]=4 33 B14R2.1128 CCC1=NC2=C(C=CC=C2)NC1=O 6031AA [1,1,0,0,0,0|2,0,0]=4 34 B14R2.1128 COC1=C(O)C=C2C=CC=CC2=C1 V5678 [1,1,0,0,0,0|1,0,1]=4 35 B14R2.1128 NCC1=C(O)C=C2C=CC=CC2=C1 5677AJ [1,1,0,0,0,0|2,0,0]=4 36 B14R2.1128 O=C1OC2=C(C=CC=C2)N\C1=N\O 5043AC [1,1,0,0,0,0|2,0,0]=4 37 B14R2.1128 O=C1SC2=C(C=CC=C2)N\C1=N\O 5044AC [1,1,0,0,0,0|2,0,0]=4 38 B14R2.8188 CC1=C(O)C(=O)C2=CC=CC=C2N1 4162AB [1,1,0,0,0,0|1,0,0]=3 39 B14R2.8239 NC1=NC2=C(C=CC(Br)=C2)NC1=O 1680AA [1,1,0,0,0,0|2,0,0]=4 40 B14R2.8239 O=C1NC2=CC=C(O)C=C2OC1O W2723 [1,1,0,0,0,0|1,0,1]=4 41 B14R2.2151 CC1=C(C=O)NC2=C1C=CC=C2Cl 2880AF [0,1,0,0,1,0|1,0,0]=3 42 B14R2.8620 O=C1NC2=C(Cl)C=CC(F)=C2C1=O 3699AJ [0,1,0,0,1,0|0,0,1]=3 43 B14R2.8620 O=C1NC2=C(F)C=CC(Br)=C2C1=O 2509AA [0,1,0,0,1,0|0,1,1]=4 44 B14R2.8737 O=C1NC2=C(F)C(Cl)=CC=C2C1=O 6093AC [0,1,0,0,1,0|0,1,1]=4 45 B14R2.4529 NC(=O)C1=CC2=C(C=CC(F)=C2)S1 8652AC [0,0,1,1,0,0|0,2,0]=4 46 B14R2.4529 NC(=O)C1=NC2=C(C=CC(Br)=C2)O1 3156AJ [0,0,1,1,0,0|1,1,0]=4 47 B14R2.4529 O=C(O)C1=NC2=C(C=CC(Cl)=C2)O1 6711AB [0,0,1,1,0,0|2,0,0]=4 48 B12R1.225 O=C(O)[C@@H](O)C1=CC(Cl)=CC=C1 3581AB [0,0,1,0,1,0|1,0,1]=4 49 B12R1.124 CC(=O)C(=O)C1=C(Cl)C=CC=C1 9878AB [0,0,1,0,1,0|0,0,2]=4 50 B12R1.124 O=C(O)C(=O)C1=CC=CC=C1Br Z4523 [0,0,1,0,1,0|1,1,0]=4 51 B12R2.202 CC1=C2NC(=O)SC2=CC=C1 1411AC [1,0,0,0,1,0|2,0,0]=4 52 B12R2.202 CC1=CC2=CC=CC(Cl)=C2N1 3695AJ [1,0,0,0,1,0|1,0,0]=3 53 B12R2.202 NC1=C2NC(=O)OC2=CC=C1 2682AC [1,0,0,0,1,0|2,0,0]=4 54 B12R2.202 O=C1NC2=C(C=CC=C2Br)S1 1412AC [1,0,0,0,1,0|1,1,0]=4 55 B12R2.202 O=C1NC2=C(N1)C(O)=CC=C2 2826AJ [1,0,0,0,1,0|2,0,0]=4 56 B12R2.203 O=C1NCC2=CC=CC(Cl)=C12 0108AC [1,0,0,0,1,0|1,0,1]=4 57 B12R2.203 O=C1NOC2=C1C(Cl)=CC=C2 9372AA [1,0,0,0,1,0|2,0,0]=4 58 B12R2.18 O=C1NC2=CN=CC=C2C1=O 9885AH [1,0,0,0,1,0|1,0,1]=4 59 B12R2.196 CC1=CNC2=C1C=CC=C2Cl 3073AL [1,0,0,0,1,0|1,0,0]=3 60 B12R2.196 CC1=CSC2=C(Cl)C=CC=C12 Z5476 [1,0,0,0,1,0|2,0,0]=4 61 B12R2.196 ClC1=NC=CC2=C1NC=C2Br 0694AD [1,0,0,0,1,0|2,0,0]=4 62 B12R2.196 NC1=CNC2=C(Cl)C=CN=C12 2086AA [1,0,0,0,1,0|2,0,0]=4