0 B7R1.3 ClC1=CN=CC=N1 3020065 [1,0,0,0,0,0|3,0,0]=4 1 B9R1.2 CC1=CC(CN)=NC=C1 4088971 [0,1,0,0,0,0|3,0,0]=4 2 B9R1.2 CC1=CC(NN)=NC=C1 4032386 [0,1,0,0,0,0|3,0,0]=4 3 B9R1.2 CC1=CC=CC(NN)=N1 4089071 [0,1,0,0,0,0|3,0,0]=4 4 B9R1.2 CC1=NC=CC(CCl)=C1 4089416 [0,1,0,0,0,0|3,0,0]=4 5 B9R1.2 CC1=NC=CC(NN)=C1 4088178 [0,1,0,0,0,0|3,0,0]=4 6 B9R1.2 CCC1=CC=NC(O)=N1 4043209 [0,1,0,0,0,0|3,0,0]=4 7 B9R1.2 CNC1=CC(Cl)=CC=C1 3020438 [0,1,0,0,0,0|2,0,0]=3 8 B9R1.2 NCC1=CC(Cl)=NC=C1 4088253 [0,1,0,0,0,0|3,0,0]=4 9 B9R1.2 NCC1=CC(O)=NC=N1 4089851 [0,1,0,0,0,0|3,0,0]=4 10 B9R1.2 NCC1=CC(O)=NC=N1 4110390 [0,1,0,0,0,0|3,0,0]=4 11 B9R1.2 NCC1=NC=CC(O)=C1 4014665 [0,1,0,0,0,0|2,0,0]=3 12 B9R1.2 O=CC1=CC(O)=NC=N1 4110682 [0,1,0,0,0,0|2,0,1]=4 13 B9R1.2 OCC1=NC=CC(Cl)=C1 4088987 [0,1,0,0,0,0|2,0,0]=3 14 B9R1.3 NC1=C(O)C(Cl)=NC=C1 4054311 [0,1,0,0,0,0|3,0,0]=4 15 B9R1.69 CC1=CC(=O)C(O)=CO1 4045348 [0,1,0,0,0,0|2,0,1]=4 16 B9R1.69 CC1=CN=C(N)C(C)=C1 4090966 [0,1,0,0,0,0|3,0,0]=4 17 B9R1.69 CC1=CN=C(O)N=C1C 4089252 [0,1,0,0,0,0|3,0,0]=4 18 B7R1.2 CC1=COC(C)=C1 4091270 [0,0,0,0,1,0|3,0,0]=4 19 B8R1.2 BrCC1=CN=CC=C1 4090400 [1,1,0,0,0,0|2,0,0]=4 20 B8R1.2 NNC1=CC=CN=C1 4090882 [1,1,0,0,0,0|2,0,0]=4 21 B8R1.2 NNC1=CC=NC=C1 4089280 [1,1,0,0,0,0|2,0,0]=4 22 B8R1.3 CC1=CN=C(O)N=C1 4090925 [1,1,0,0,0,0|2,0,0]=4 23 B10R1.2 CC1=C(Cl)C=CC=C1NN 4088656 [0,2,0,0,0,0|2,0,0]=4 24 B10R1.10 NNCC1=CC=CC(Cl)=C1 4088727 [0,2,0,0,0,0|2,0,0]=4 25 B10R1.30 CCC1=C(N)C=CC(I)=C1 4091033 [0,2,0,0,0,0|2,0,0]=4 26 B10R1.30 CCC1=CC(Cl)=CC=C1N 4091185 [0,2,0,0,0,0|2,0,0]=4 27 B10R1.113 CC(N)C1=CC(Cl)=CC=C1 3002152 [0,2,0,0,0,0|2,0,0]=4 28 B10R1.113 CC(N)C1=CC=CC(Br)=C1 4045598 [0,2,0,0,0,0|2,0,0]=4 29 B10R1.113 CC1=CC=CC(C(C)N)=C1 3001756 [0,2,0,0,0,0|2,0,0]=4 30 B10R1.113 CC1=CC=CC([C@@H](C)N)=C1 4095694 [0,2,0,0,0,0|2,0,0]=4 31 B10R1.113 CC1=CC=CC([C@H](C)N)=C1 4099223 [0,2,0,0,0,0|2,0,0]=4 32 B10R1.113 N=C(N)C1=CC(F)=CC=C1 4088368 [0,2,0,0,0,0|2,0,0]=4 33 B10R1.172 COC1=CC(CCl)=NC=C1 4087877 [0,2,0,0,0,0|2,0,0]=4 34 B10R1.172 COC1=CC(CN)=NC=C1 4016645 [0,2,0,0,0,0|2,0,0]=4 35 B10R1.172 COC1=CC(CN)=NC=C1 4091226 [0,2,0,0,0,0|2,0,0]=4 36 B10R1.172 CSC1=CC=CC(CN)=C1 4089405 [0,2,0,0,0,0|1,1,0]=4 37 B10R1.172 N#CC1=CC(CN)=CC=C1 4088569 [0,2,0,0,0,0|2,0,0]=4 38 B10R1.172 NCC1=CC=CC(CO)=C1 4088760 [0,2,0,0,0,0|1,0,0]=3 39 B10R1.22 CC1=CC(N)=CC(C)=C1O 4089353 [0,2,0,0,0,0|2,0,0]=4 40 B10R1.119 CC1=C(Cl)C(N)=CC=C1Cl 4089648 [0,2,0,0,0,0|2,0,0]=4 41 B10R1.119 CC1=CC=C(N)C(N)=C1C 3002687 [0,2,0,0,0,0|2,0,0]=4 42 B10R1.25 NCC1=C(O)C=C(O)C=C1 4089662 [0,2,0,0,0,0|0,0,0]=2 43 B8R1.7 N=C(N)C1=CC=CO1 4088503 [0,0,1,1,0,0|2,0,0]=4 44 B8R1.8 OCCC1=CC=CO1 4039978 [0,0,1,1,0,0|0,0,2]=4 45 B6R1.2 OC1=CNN=C1 4089099 [1,0,0,0,1,0|2,0,0]=4