0 B13R1.433 COC1=CC(OC)=C(N)C(OC)=C1 Q69529 [0,0,0,0,0,0|3,0,0]=3 1 B13R1.433 COC1=CC(OC)=NC(OC)=C1O L19900 [0,0,0,0,0,0|3,0,0]=3 2 B12R1.58 C#CC1=CC(OC)=CC(OC)=C1 P40588 [1,0,0,0,0,0|1,0,1]=3 3 B12R1.58 COC1=CC(C#N)=CC(OC)=N1 Q62343 [1,0,0,0,0,0|2,0,1]=4 4 B12R1.58 COC1=CC(C=O)=CC(OC)=N1 O29090 [1,0,0,0,0,0|1,0,0]=2 5 B12R1.58 COC1=CC(CO)=CC(OC)=N1 O29107 [1,0,0,0,0,0|1,0,2]=4 6 B12R1.58 COC1=CC(OC)=NC(C=O)=N1 Q56409 [1,0,0,0,0,0|2,0,0]=3 7 B12R1.58 COC1=CC(OC)=NC(OC)=C1 N26326 [1,0,0,0,0,0|3,0,0]=4 8 B12R1.235 COC1=C(Br)C(SC)=CC(Br)=C1 N26640 [1,0,0,0,0,0|2,1,0]=4 9 B12R1.235 COC1=NC(Br)=CC(OC)=C1N L19873 [1,0,0,0,0,0|3,0,0]=4 10 B12R1.300 COC1=C(F)C(C)=CC(C=O)=C1 N27419 [1,0,0,0,0,0|1,0,0]=2 11 B12R1.300 COC1=C(F)C(F)=CC(C=O)=C1 Q68418 [1,0,0,0,0,0|2,0,0]=3 12 B12R1.300 COC1=CC(C#N)=CC(C)=C1O C-3738 [1,0,0,0,0,0|1,0,1]=3 13 B12R1.300 COC1=CC(CO)=CC(F)=C1O N27150 [1,0,0,0,0,0|1,0,2]=4 14 B14R1.576 COC1=CC(OC)=C(CO)C(OC)=C1 P37096 [0,1,0,0,0,0|2,0,0]=3 15 B11R1.9 CCC1=NC(C)=CC(C=O)=C1 Q60463 [2,0,0,0,0,0|2,0,0]=4 16 B11R1.9 COC1=CC(C)=CC(C=O)=C1 N25376 [2,0,0,0,0,0|0,0,0]=2 17 B11R1.9 COC1=CC(C)=CC(CO)=C1 N25630 [2,0,0,0,0,0|0,0,2]=4 18 B11R1.9 COC1=CC(C)=NC(C=O)=N1 Q60438 [2,0,0,0,0,0|2,0,0]=4 19 B11R1.9 COC1=CC(C=O)=CC(Br)=C1 F-4624 [2,0,0,0,0,0|1,0,0]=3 20 B11R1.9 COC1=CC(C=O)=CC(F)=C1 Q67636 [2,0,0,0,0,0|1,0,0]=3 21 B11R1.9 COC1=CC(Cl)=CC(C=O)=C1 Q67280 [2,0,0,0,0,0|1,0,0]=3 22 B11R1.9 CSC1=CC(C=O)=CC(C)=C1 N26647 [2,0,0,0,0,0|0,1,0]=3 23 B11R1.9 CSC1=CC(F)=CC(C=O)=C1 N26522 [2,0,0,0,0,0|1,1,0]=4 24 B11R1.8 COC1=C(Cl)C(O)=CC(Cl)=C1 O29075 [2,0,0,0,0,0|2,0,0]=4 25 B11R1.8 COC1=C(F)C(C)=CC(Br)=C1 N24869 [2,0,0,0,0,0|2,0,0]=4 26 B11R1.8 COC1=C(O)C(C)=CC(Br)=C1 C-2954 [2,0,0,0,0,0|1,0,0]=3 27 B11R1.8 COC1=C(O)C(F)=CC(Br)=C1 Q68415 [2,0,0,0,0,0|2,0,0]=4 28 B11R1.8 COC1=CC(C)=CC(F)=C1O N26988 [2,0,0,0,0,0|1,0,1]=4 29 B11R1.267 COC1=CC=CC(OC)=C1F N24357 [2,0,0,0,0,0|1,0,0]=3 30 B11R1.267 COC1=NC=CC(OC)=C1N O31443 [2,0,0,0,0,0|2,0,0]=4 31 B11R1.14 CC1=CC(C=O)=CC(C)=C1Br Q67068 [2,0,0,0,0,0|1,0,0]=3 32 B11R1.14 CC1=CC(C=O)=CC(C)=C1Cl N25389 [2,0,0,0,0,0|1,0,0]=3 33 B11R1.14 CC1=CC(C=O)=CC(C)=C1F Q67677 [2,0,0,0,0,0|1,0,0]=3 34 B11R1.14 CC1=CC(C=O)=CC(C)=C1I N27200 [2,0,0,0,0,0|1,0,0]=3 35 B11R1.14 COC1=CC(C)=C(O)C(C)=C1 N24530 [2,0,0,0,0,0|2,0,0]=4 36 B11R1.14 O=CC1=CC(Cl)=C(O)C(Br)=C1 Q66937 [2,0,0,0,0,0|2,0,0]=4 37 B11R1.14 O=CC1=CC(Cl)=C(O)C(Cl)=C1 Q67942 [2,0,0,0,0,0|2,0,0]=4 38 B11R1.14 O=CC1=CC(F)=C(O)C(Cl)=C1 Q68394 [2,0,0,0,0,0|2,0,0]=4 39 B11R1.14 O=CC1=CC(F)=C(O)C(F)=C1 Q67383 [2,0,0,0,0,0|2,0,0]=4 40 B11R1.280 CCC1=C(Cl)C=CC(C=O)=C1 N24684 [2,0,0,0,0,0|2,0,0]=4 41 B11R1.280 COC1=CC(C=O)=CC=C1Br O30813 [2,0,0,0,0,0|1,0,0]=3 42 B11R1.280 COC1=CC(C=O)=CC=C1C Q66680 [2,0,0,0,0,0|1,0,0]=3 43 B11R1.280 COC1=CC(C=O)=CN=C1Br N26263 [2,0,0,0,0,0|2,0,0]=4 44 B11R1.280 COC1=CC(C=O)=CN=C1Cl N26264 [2,0,0,0,0,0|2,0,0]=4 45 B11R1.280 COC1=CC(C=O)=CN=C1F N25807 [2,0,0,0,0,0|2,0,0]=4 46 B11R1.280 COC1=CC(C=O)=NC=C1C S72552 [2,0,0,0,0,0|2,0,0]=4 47 B11R1.280 CSC1=C(C)C=CC(C=O)=C1 N27220 [2,0,0,0,0,0|1,1,0]=4 48 B11R1.280 CSC1=C(F)C=CC(C=O)=C1 N27188 [2,0,0,0,0,0|1,1,0]=4 49 B11R1.280 CSC1=CC(C=O)=CC=C1Br Q68493 [2,0,0,0,0,0|1,1,0]=4 50 B13R1.313 COC1=CC(C(=O)O)=CC(OC)=N1 N25617 [1,1,0,0,0,0|1,0,0]=3 51 B13R1.313 COC1=CC(C=O)=CC(B(O)O)=C1 N26030 [1,1,0,0,0,0|2,0,0]=4 52 B13R1.358 COC1=CC(CCN)=CC(OC)=C1 P38842 [1,1,0,0,0,0|1,0,1]=4 53 B13R1.358 COC1=CC(CNN)=CC(OC)=C1 L21046 [1,1,0,0,0,0|1,0,1]=4 54 B13R1.302 COC1=CC(Br)=CC(OC)=C1C=O P51347 [1,1,0,0,0,0|1,0,1]=4 55 B13R1.298 COC1=C(F)C(F)=CC(C(=O)O)=C1 N25323 [1,1,0,0,0,0|2,0,0]=4 56 B13R1.425 COC1=C(Cl)C(F)=C(F)C(C=O)=C1 N27374 [1,1,0,0,0,0|2,0,0]=4 57 B13R1.434 COC1=CC(C=O)=CC(F)=C1OC N26205 [1,1,0,0,0,0|1,0,0]=3 58 B13R1.3981 CCOC1=C(O)C(Br)=CC(C=O)=C1 Q65595 [1,1,0,0,0,0|1,0,0]=3 59 B15R1.378 COC1=CC(B(O)O)=CC(OC)=C1OC P40357 [0,2,0,0,0,0|1,0,1]=4 60 B15R1.688 CC(C)C1=CC(C=O)=CC(C(C)C)=C1O P51105 [0,2,0,0,0,0|2,0,0]=4 61 B15R1.10175 COC1=CC(OC)=C(B(O)O)C(OC)=C1 O29015 [0,2,0,0,0,0|2,0,0]=4 62 B13R1.2200 COC1=CC(C)=C(OC)C=C1C=O Q68416 [0,0,0,0,1,1|1,0,0]=3