0 B19R2.4430 CC1=C(C(=CC=C1)NC2=CC=CC=C2C(=O)[O-])C R434833 [0,0,0,0,0,0|0,0,1]=1 1 B19R2.4430 O=C(O)C1=CC=CC=C1NC2=CC=CC(=C2Cl)Cl PH002250 [0,0,0,0,0,0|2,0,0]=2 2 B18R2.3919 CC1=CC(=CC=C1)NC2=CC=CC=C2C(=O)O PH009774 [1,0,0,0,0,0|0,0,0]=1 3 B18R2.3919 CC1=CC(=CC=C1)OC2=C(C=CC=C2)B(O)O CDS021430 [1,0,0,0,0,0|2,0,1]=4 4 B18R2.3919 CC1=CC=CC(=C1)SC2=CC=CC=C2[N+](=O)[O-] S836338 [1,0,0,0,0,0|2,0,1]=4 5 B18R2.3919 O=C(O)C1=CC=CN=C1OC2=CC(=CC=C2)F PH010480 [1,0,0,0,0,0|3,0,0]=4 6 B18R2.3919 O=C(O)C1=CC=CN=C1OC2=CC=CC(=C2)Cl PH010481 [1,0,0,0,0,0|3,0,0]=4 7 B18R2.4750 CC1=C(C=CC=C1)NC2=C(C=CC=C2)C(=O)O PH004265 [1,0,0,0,0,0|0,0,0]=1 8 B18R2.4750 CC1=C(C=CC=C1)OC2=CC=CC=C2[N+](=O)[O-] PH008694 [1,0,0,0,0,0|2,0,1]=4 9 B18R2.4750 CC1=C(C=CC=C1)SC2=CC=CC=C2[N+](=O)[O-] S836311 [1,0,0,0,0,0|2,0,1]=4 10 B18R2.4750 CC1=CC=CC=C1OC2=C(C=CC=C2)B(O)O CDS021425 [1,0,0,0,0,0|2,0,1]=4 11 B18R2.4750 NC(=O)C1=C(C=CC=C1)OC2=CC=CC=C2Cl S80730 [1,0,0,0,0,0|3,0,0]=4 12 B18R2.4750 O=C(O)C1=CC=CC=C1OC2=CC=CC=C2F JRD1281 [1,0,0,0,0,0|2,0,0]=3 13 B20R2.156109 CC1=C(C(=C(C=C1)Cl)NC2=C(C=CC=C2)C(=O)O)Cl PH000121 [0,1,0,0,0,0|1,0,0]=2 14 B20R2.248768 COC(=O)C1=CC=CC=C1NC2=CC=CC(=C2C)C PH006200 [0,1,0,0,0,0|0,0,0]=1 15 B17R2.1470 CC1=CC=CC=C1OC2=CC=CC=C2C=O JRD1282 [2,0,0,0,0,0|1,0,0]=3 16 B17R2.5618 CC(=O)C1=C(C=CC=C1)SC2=CC=CC=C2 L255416 [2,0,0,0,0,0|2,0,0]=4 17 B17R2.5618 NC(=O)C1=CC=CN=C1NC2=CC=CC=C2 T313106 [2,0,0,0,0,0|2,0,0]=4 18 B17R2.5618 O=C([O-])C1=C(C=CC=C1)[I+]C2=CC=CC=C2 S695564 [2,0,0,0,0,0|1,0,1]=4 19 B17R2.5618 O=C([O-])C1=CC=CC=C1[I+]C2=CC=CC=C2 L159824 [2,0,0,0,0,0|1,0,1]=4 20 B19R2.4109 CC1=CC(=NC(=N1)NC2=CC=CC=C2C(=O)O)C L118710 [1,1,0,0,0,0|2,0,0]=4 21 B19R2.4555 O=C(O)C1=CC=CC=C1SC2=CC(=CC=C2Cl)Cl PH002285 [1,1,0,0,0,0|2,0,0]=4 22 B19R2.103168 CC1=CC(=C(C=C1)CC2=CC=CC=C2C(=O)O)C R245186 [1,1,0,0,0,0|1,0,0]=3 23 B19R2.103168 CC1=CC=C(C(=C1)Br)NC2=CC=CC=C2C(=O)O PH002269 [1,1,0,0,0,0|1,0,0]=3 24 B19R2.156713 COC(=O)C1=C(C=CC=C1)SC2=C(C=CC=C2)N PH004419 [1,1,0,0,0,0|2,0,0]=4 25 B21R2.222341 CC1=C(C=CC=C1Cl)NC(=O)C2=CC=CC=C2C(=O)O S555274 [0,1,0,0,0,1|1,0,0]=3 26 B21R2.222341 CC1=CC=CC(=C1C)NC(=O)C2=C(C=CC=C2)[N+](=O)[O-] R575356 [0,1,0,0,0,1|1,0,1]=4 27 B21R2.222341 CC1=CC=CC(=C1C)NC(=O)C2=CC=CC=C2C(=O)O S719080 [0,1,0,0,0,1|0,0,0]=2 28 B21R2.222341 O=C(O)C1=CC=CC=C1C(=O)NC2=C(C(=CC=C2)Cl)Cl S764329 [0,1,0,0,0,1|2,0,0]=4 29 B21R2.458131 COC1=C(C(=CC=C1)OC2=NC=CC=C2C(=O)O)OC PH018016 [0,2,0,0,0,0|2,0,0]=4 30 B21R2.811289 COC(=O)C1=CC=CC=C1NC2=C(C=CC(=C2Cl)C)Cl PH002442 [0,2,0,0,0,0|1,0,0]=3 31 B19R2.115 CCC1=CC=C(C=C1)NC2=C(C=CC=C2)C(=O)O PH007252 [0,0,1,1,0,0|0,0,2]=4 32 B19R3.160267 O=C1NC2=C(C=C(C=C2)Cl)NC3=C1C=CC=C3 PH009283 [1,0,0,1,0,0|2,0,0]=4 33 B17R2.3363 O=C(O)C1=C(C=CC=C1)C2=CC=CC(=C2)Cl CDS020899 [1,0,0,0,1,0|1,0,0]=3 34 B17R2.3445 CC1=CC=CC=C1C2=C(C=CC=C2)C(=O)O CBR00346 [1,0,0,0,1,0|0,0,0]=2 35 B17R2.3445 O=C(O)C1=C(C=CC=C1)C2=CC=CC=C2O S840114 [1,0,0,0,1,0|1,0,0]=3 36 B19R2.4395 O=C(O)CC1=CC=CC=C1OC2=CC=CC(=C2)Cl PH017275 [1,0,0,0,0,1|2,0,0]=4 37 B19R2.101532 CC1=CC=CC(=C1)COC2=CC=CC=C2C(=O)O OTV000152 [1,0,0,0,0,1|1,0,0]=3