0 B18R2.4001 O=C(NCC1=CC=CC=C1)C2=CC=CC=C2O 7119720005 [0,0,0,0,0,0|1,0,0]=1 1 B17R2.2342 O=C(NNC1=CC=CC=C1)C2=CC=NC=C2 0118671291 [1,0,0,0,0,0|3,0,0]=4 2 B17R2.2342 O=C(\C=C\C1=CC=CC=C1)C2=CC=CC=C2 1370720 [1,0,0,0,0,0|1,0,1]=3 3 B19R2.4553 O=C(\C=C\C1=CC=CC=C1)C2=CC(Cl)=CC=C2O 11639069 [0,1,0,0,0,0|1,0,1]=3 4 B19R2.12083 NC1=C(C(=O)NCC2=CNC(=O)C=C2)C=CC=C1 5669097 [0,1,0,0,0,0|3,0,0]=4 5 B19R3.9171 O=C1CC(C2=CC=CC=C2)OC3=C1C=CC=C3 3003450 [0,0,0,1,0,0|1,0,0]=2 6 B19R3.9171 O=C1NC(C2=CC=CC=C2)=NC3=CC=CC=C13 7010010205 [0,0,0,1,0,0|2,0,1]=4 7 B19R3.9171 O=C1NC(C2=CC=CN=C2)NC3=CC=CC=C13 3463528 [0,0,0,1,0,0|3,0,0]=4 8 B17R2.3417 O=C(NC1=CC=CC=C1)C2=CC=CC=C2O 1016285 [0,0,0,0,1,0|1,0,0]=2 9 B19R2.4485 O=C(\C=C\C1=CC=CC=C1)OC2=C(O)C=CC=C2 14661684 [0,0,0,0,0,1|1,0,1]=3 10 B16R2.2256 C1=CC=C(CNCC2=CC=CC=C2)C=C1 1369508 [2,0,0,0,0,0|1,0,1]=4 11 B16R2.2256 C1=CC=C(CNCC2=CC=CC=C2)C=C1 7020610973 [2,0,0,0,0,0|1,0,1]=4 12 B18R2.253 NC1=CC=C(C(=O)OCC2=CN=CC=C2)C=N1 3698308 [1,1,0,0,0,0|2,0,0]=4 13 B18R2.253 O=C(NCC1=CC=CC=C1)C2=CC=C(O)C=C2 7013541207 [1,1,0,0,0,0|1,0,0]=3 14 B18R2.257 O=C(CNC1=CC=C(F)C=C1)C2=CC=CC=C2 7011960077 [1,1,0,0,0,0|2,0,0]=4 15 B18R2.257 O=C(COC1=CC=C(I)C=C1)C2=CC=CC=C2 7011960004 [1,1,0,0,0,0|2,0,0]=4 16 B18R2.3634 O=C(CC(=O)C1=CC=CC=C1)C2=CC=CC=C2 1912585 [1,1,0,0,0,0|1,0,1]=4 17 B18R2.3634 O=C(OC(=O)C1=CC=CC=C1)C2=CC=CC=C2 3112302 [1,1,0,0,0,0|0,0,1]=3 18 B18R2.6543 O=C(CC1=CC=CC=C1)C2=CC=C(O)C=C2O 0107930004 [0,1,0,0,1,0|0,0,0]=2 19 B18R2.6543 O=C(C[N+]1=CC=CC=C1)C2=CC=C(O)C=C2O 7014350029 [0,1,0,0,1,0|1,0,0]=3 20 B18R2.32648 O=C(NC1=C(O)C=CC=C1)C2=C(F)C=CC=C2 1016762 [0,1,0,0,1,0|2,0,0]=4 21 B18R2.65851 O=C(NC1=CC=CC(O)=C1)C2=CC=CC=C2Br 1000356 [0,1,0,0,1,0|2,0,0]=4 22 B20R2.235908 O=C(N\N=C\C1=CC=C(F)C=C1)C2=C(O)C=CC=C2 1298225 [0,1,0,0,0,1|1,0,1]=4 23 B20R2.235908 O=C(N\N=C\C1=CC=C(O)C=C1)C2=CC=CC=C2O 7510790388 [0,1,0,0,0,1|1,0,1]=4 24 B20R2.10746 O=C(O)C1=C(C(=O)OCC2=CC=CC=C2)C=CC=C1 7113231786 [0,2,0,0,0,0|0,0,0]=2 25 B20R2.15570 CC1=CC=C(C(=O)\C=C\C2=CC=C(F)C=C2)C(O)=C1 12405430 [0,2,0,0,0,0|1,0,1]=4 26 B20R2.15570 O=C(COC1=CC=C(Cl)C=C1)C2=C(O)C=C(O)C=C2 0103010087 [0,2,0,0,0,0|2,0,0]=4 27 B20R2.15570 O=C(COC1=CC=C(F)C=C1)C2=C(O)C=C(O)C=C2 1109019 [0,2,0,0,0,0|2,0,0]=4 28 B20R2.75884 O=C(COC1=C(Br)C=CC=C1)C2=CC=C(O)C=C2O 7010250206 [0,2,0,0,0,0|2,0,0]=4 29 B20R2.75884 O=C(COC1=C(Cl)C=CC=C1)C2=CC=C(O)C=C2O 7013161806 [0,2,0,0,0,0|2,0,0]=4 30 B20R2.153374 CC1=CC(OCC(=O)C2=CC=C(O)C=C2O)=CC=C1 7013161803 [0,2,0,0,0,0|2,0,0]=4 31 B20R2.15574 CC1=CC=C(O)C(C(=O)\C=C\C2=CC=C(Br)C=C2)=C1 7715560006 [0,2,0,0,0,0|1,0,1]=4 32 B18R2.7138 O=C(O)C1=CC=CC=C1OCC2=CC=CC=C2 7119572541 [0,0,1,1,0,0|2,0,0]=4 33 B18R3.111 O=C1C2=CC=CC=C2CN1C3=CC=CC=C3 1284250 [0,0,0,1,1,0|2,0,0]=4 34 B18R3.47120 OC1=C(C2=CC3=C(C=CC=C3)N2)C=CC=C1 7116990222 [0,0,0,1,1,0|1,0,1]=4 35 B20R3.96524 CN1C(=O)C2=C(C=CC=C2)NC1C3=CC=CC=C3 6665629 [0,1,0,1,0,0|2,0,0]=4 36 B20R3.277680 O=C1C2=CC=C(O)C=C2O\C1=C/C3=CC=CC=C3 1089686 [0,1,0,1,0,0|1,0,1]=4 37 B20R3.263189 NC1=CC=C2OC(C3=CC=CC=C3)=CC(=O)C2=C1 1089815 [0,1,0,1,0,0|1,0,1]=4 38 B20R3.5740 O=C1NC(C2=C(Cl)C=CC=C2)NC3=C1C=CC=C3 7015160127 [0,1,0,1,0,0|2,0,0]=4 39 B20R3.19277 O=C1C2=C(C=CC=C2)O\C1=C/C3=CC=C(O)C=C3 3702373 [0,1,0,1,0,0|1,0,1]=4 40 B20R3.19283 O=C1NC(C2=CC=C(O)C=C2)NC3=CC=CC=C13 7015160135 [0,1,0,1,0,0|2,0,0]=4 41 B20R3.5484 O=C1C2=CC=CC=C2O\C1=C/C3=CC=CC(O)=C3 9961284 [0,1,0,1,0,0|1,0,1]=4 42 B16R2.88 O=C(CC1=CC=CC=C1)C2=CC=CC=C2 0117381123 [1,0,0,0,1,0|0,0,0]=2 43 B16R2.71 NC1=C(OCC2=CC=CC=C2)C=CC=C1 1314508 [1,0,0,0,1,0|1,0,0]=3 44 B16R2.71 NC1=NC=CC=C1OCC2=CC=CC=C2 1515201 [1,0,0,0,1,0|2,0,0]=4 45 B16R2.71 OC1=C(NCC2=NC=CC=C2)C=CC=C1 4859307 [1,0,0,0,1,0|2,0,0]=4 46 B16R2.71 OC1=CC=CC=C1OCC2=CC=CC=C2 1195896 [1,0,0,0,1,0|0,0,0]=2 47 B20R2.8343 O=C(OCCCC1=CC=CC=C1)C2=CC=CC=C2O 1867385 [0,0,0,0,0,2|0,0,0]=2