0 B10R2.7 C1=CC2=C(C=C1)NC=C2 DB04532 [0,0,0,0,0,0|0,0,0]=0 1 B10R2.7 C1=CC2=C(C=C1)OC=C2 DB04179 [0,0,0,0,0,0|1,0,0]=1 2 B10R2.7 C1=CC=C2NC=NC2=C1 DB02962 [0,0,0,0,0,0|1,0,0]=1 3 B11R2.10 NC1N=C2C=CC=CC2=N1 DB01665 [0,1,0,0,0,0|1,0,2]=4 4 B11R2.36 CC1=CC2=C(C=C1)N=CN2 DB03177 [0,1,0,0,0,0|1,0,0]=2 5 B11R2.106 CC1=C2NC=NC2=NC=N1 DB02113 [0,1,0,0,0,0|3,0,0]=4 6 B11R2.106 N=C1NC=NC2=C1NC=C2 DB03506 [0,1,0,0,0,0|2,0,0]=3 7 B11R2.106 OC1=NC=NC2=C1NC=C2 DB04095 [0,1,0,0,0,0|2,0,0]=3 8 B11R2.106 OC1=NC=NC2=C1NC=N2 DB04076 [0,1,0,0,0,0|3,0,0]=4 9 B9R1.8 NCCC1=CC=CC=C1 DB04325 [0,0,1,0,0,0|0,0,2]=3 10 B9R1.8 O=CCC1=CC=CC=C1 DB02178 [0,0,1,0,0,0|1,0,1]=3 11 B9R1.8 OCCC1=CC=CC=C1 DB02192 [0,0,1,0,0,0|1,0,2]=4 12 B9R1.15 NC1=CC=CC=C1CO DB03058 [0,0,1,0,0,0|1,0,1]=3 13 B9R1.15 SCC1=CC=CC=C1I DB03630 [0,0,1,0,0,0|2,0,1]=4 14 B11R2.20 C1=CC=C2C=NC=CC2=C1 DB04329 [0,0,0,0,0,1|0,0,1]=2 15 B8R1.2 NCC1=CC=CC=C1 DB02464 [1,0,1,0,0,0|0,0,1]=3 16 B8R1.5 ClC1=C(Cl)C=CC=C1 DB13963 [1,0,1,0,0,0|2,0,0]=4 17 B8R1.5 NC1=CC=CC=C1F DB02403 [1,0,1,0,0,0|1,0,0]=3 18 B8R1.5 NC1=CC=CC=C1O DB01726 [1,0,1,0,0,0|1,0,0]=3 19 B8R1.5 OC1=CC=CC=C1Br DB04586 [1,0,1,0,0,0|2,0,0]=4 20 B8R1.5 OC1=CC=CC=C1Cl DB03110 [1,0,1,0,0,0|2,0,0]=4 21 B8R1.5 OC1=CC=CC=C1O DB02232 [1,0,1,0,0,0|2,0,0]=4 22 B10R1.4 C=CCC1=CC=CC=C1O DB02534 [0,1,1,0,0,0|1,0,0]=3 23 B10R1.15 O=C(NO)C1=CC=CC=C1 DB01924 [0,1,1,0,0,0|2,0,0]=4 24 B10R1.17 C=CCNC1=CC=CC=C1 DB02870 [0,1,1,0,0,0|0,0,0]=2 25 B10R1.17 NCCCC1=CC=CC=C1 DB04410 [0,1,1,0,0,0|0,0,2]=4 26 B10R1.17 O=CNCC1=CC=CC=C1 DB02481 [0,1,1,0,0,0|1,0,0]=3 27 B10R1.17 O=COCC1=CC=CC=C1 DB04569 [0,1,1,0,0,0|1,0,1]=4 28 B10R1.17 O=C\C=C\C1=CC=CC=C1 DB14184 [0,1,1,0,0,0|1,0,0]=3 29 B10R1.17 OC\C=C\C1=CC=CC=C1 DB14186 [0,1,1,0,0,0|1,0,0]=3 30 B10R1.18 NC(=S)NC1=CC=CC=C1 DB03694 [0,1,1,0,0,0|1,0,0]=3 31 B10R1.66 O=C(O)\C=C\C1=CNC=N1 DB01971 [0,1,1,0,0,0|2,0,0]=4 32 B10R1.61 NC1=CC=CC=C1C(=O)O DB04166 [0,1,1,0,0,0|1,0,0]=3 33 B10R1.61 O=C(O)C1=C(S)C=CC=C1 DB14026 [0,1,1,0,0,0|2,0,0]=4 34 B12R2.24 IC1=CC2=C(C=C1)CCNC2 DB03824 [0,1,0,0,0,1|0,0,2]=4 35 B12R2.24 O=C1C=CC2=CC=CC=C2N1 DB04745 [0,1,0,0,0,1|0,0,0]=2 36 B12R2.24 O=C1C=CC2=CC=CC=C2O1 DB04665 [0,1,0,0,0,1|1,0,0]=3 37 B12R2.1081 NC1=CC=CC2=C1C=CN=C2 DB04605 [0,1,0,0,0,1|0,0,1]=3 38 B12R2.18 O=C1NC2=CC=CC=C2C1=O DB02095 [0,2,0,0,0,0|0,0,0]=2 39 B12R2.606 N=C1NC2=C(C=C(O)C=C2)N1 DB03729 [0,2,0,0,0,0|1,0,0]=3 40 B12R2.44 COC1=CC2=C(C=C1)N=CN2 DB04130 [0,2,0,0,0,0|1,0,0]=3 41 B12R2.100 CC1=CC2=C(C=C1C)NC=N2 DB02591 [0,2,0,0,0,0|1,0,0]=3 42 B12R2.100 OC1=C(O)C=C2NC=CC2=C1 DB01811 [0,2,0,0,0,0|0,0,0]=2 43 B12R2.246 N=C1N=C(O)C2=C(C=CN2)N1 DB04356 [0,2,0,0,0,0|2,0,0]=4