0 B7R1.1 CCC1=NNC=C1 BB12-3522 [0,0,0,0,0,0|3,0,1]=4 1 B7R1.1 NCC1=CC=NN1 BB01-4712 [0,0,0,0,0,0|3,0,1]=4 2 B7R1.1 NCC1=NC=CN1 BB12-2726 [0,0,0,0,0,0|3,0,1]=4 3 B7R1.1 OCC1=COC=C1 BB12-2281 [0,0,0,0,0,0|2,0,2]=4 4 B6R1.2 CC1=CC=NN1 BB56-1939 [1,0,0,0,0,0|2,0,1]=4 5 B6R1.2 CC1=NC=CS1 BB20-4630 [1,0,0,0,0,0|1,1,1]=4 6 B6R1.2 NC1=NC=CS1 BB17-0298 [1,0,0,0,0,0|2,1,0]=4 7 B8R1.1 CC1=CC(C=O)=NN1 BB12-3191 [0,1,0,0,0,0|2,0,0]=3 8 B8R1.1 CC1=CC=C(C#N)O1 BB12-3501 [0,1,0,0,0,0|1,0,1]=3 9 B8R1.1 CC1=NOC(C#N)=C1 BB55-4173 [0,1,0,0,0,0|2,0,1]=4 10 B8R1.1 CC1=NOC(CCl)=C1 BB55-3987 [0,1,0,0,0,0|2,0,1]=4 11 B8R1.1 CN1C=C(C=O)C=N1 BB12-1724 [0,1,0,0,0,0|3,0,0]=4 12 B8R1.1 OCC1=CC=C(Br)O1 BB90-0114 [0,1,0,0,0,0|0,0,2]=3 13 B8R1.7 CC(=O)C1=NN=CN1 BB17-0204 [0,1,0,0,0,0|3,0,0]=4 14 B8R1.7 O=C(O)C1=CN=NN1 BB90-0079 [0,1,0,0,0,0|3,0,0]=4 15 B8R1.7 O=C(O)C1=CNN=C1 BB01-4399 [0,1,0,0,0,0|3,0,0]=4 16 B8R1.7 O=C(O)C1=NOC=C1 BB20-4533 [0,1,0,0,0,0|2,0,0]=3 17 B8R1.7 O=[N+]([O-])C1=NC=CN1 BB12-3037 [0,1,0,0,0,0|3,0,0]=4 18 B8R1.7 O=[N+]([O-])C1=NNC=C1 BB55-3830 [0,1,0,0,0,0|3,0,0]=4 19 B8R1.7 O=[N+]([O-])N1C=CC=N1 BB55-3955 [0,1,0,0,0,0|3,0,0]=4 20 B8R1.7 OB(O)C1=CC=CO1 BB56-0777 [0,1,0,0,0,0|1,0,1]=3 21 B8R1.8 NCCC1=CC=CO1 BB01-5388 [0,1,0,0,0,0|1,0,1]=3 22 B8R1.11 CC1=C(C=O)NC=N1 BB12-3119 [0,1,0,0,0,0|2,0,0]=3 23 B8R1.11 CC1=C(CN)SC=C1 BB12-1657 [0,1,0,0,0,0|1,1,1]=4 24 B8R1.11 CN1C=CC=C1CO BB90-0093 [0,1,0,0,0,0|1,0,2]=4 25 B8R1.11 CN1N=CC=C1C=O BB55-3814 [0,1,0,0,0,0|2,0,0]=3 26 B8R1.2 O=CC1CC=CCC1 BB01-8334 [0,0,0,0,0,1|1,0,2]=4 27 B7R1.2 CC1=CC(C)=NO1 BB01-6357 [1,1,0,0,0,0|1,0,1]=4 28 B7R1.2 CC1=NOC(N)=C1 BB12-3489 [1,1,0,0,0,0|2,0,0]=4 29 B7R1.2 O=C1C=C(O)CC1 BB12-0743 [1,1,0,0,0,0|1,0,1]=4 30 B7R1.4 CC1=C(Br)SC=C1 BB56-2325 [1,1,0,0,0,0|1,1,0]=4 31 B9R1.1 CC1=CN=C(C=O)C=C1 BB12-2174 [0,1,0,0,0,1|1,0,0]=3 32 B9R1.6 NC(=S)C1=CC=NC=C1 BB12-3482 [0,1,0,0,0,1|1,1,0]=4 33 B9R1.6 NC(=S)C1=CN=CC=C1 BB12-3483 [0,1,0,0,0,1|1,1,0]=4 34 B9R1.6 NC(=S)C1=NC=CC=N1 BB12-3525 [0,1,0,0,0,1|1,1,0]=4 35 B9R1.6 NC(=S)C1=NC=CN=C1 BB12-3484 [0,1,0,0,0,1|1,1,0]=4 36 B9R1.8 O=C=NC1=CC=NC=C1 BB01-6559 [0,1,0,0,0,1|1,0,1]=4 37 B9R1.15 O=CC1=CC=CN=C1Br BB56-0225 [0,1,0,0,0,1|1,0,0]=3 38 B9R1.22 CC1=CC(C=O)=C(C)N1 BB17-1648 [0,2,0,0,0,0|2,0,0]=4 39 B9R1.23 O=CC1=CC(Br)=C(Br)O1 BB17-1111 [0,2,0,0,0,0|0,0,0]=2 40 B9R1.35 CC1=CC(C(N)=O)=NO1 BB12-1502 [0,2,0,0,0,0|2,0,0]=4 41 B9R1.35 CC1=CC=C(C(=N)N)O1 BB12-3708 [0,2,0,0,0,0|1,0,0]=3 42 B9R1.35 CC1=CNC(C(=O)O)=N1 BB12-3671 [0,2,0,0,0,0|2,0,0]=4 43 B9R1.35 CC1=NC(C(=O)O)=CS1 BB01-2835 [0,2,0,0,0,0|2,0,0]=4 44 B9R1.35 NC1=CC(C(=O)O)=NN1 BB55-3807 [0,2,0,0,0,0|2,0,0]=4 45 B9R1.35 O=C1NC=C(C(=O)O)N1 BB26-0164 [0,2,0,0,0,0|2,0,0]=4 46 B9R1.132 CC1=NNC(C=O)=C1Br BB12-3454 [0,2,0,0,0,0|2,0,0]=4 47 B9R1.11 COC(=O)C1=CNC=N1 BB20-4625 [0,2,0,0,0,0|2,0,0]=4 48 B9R1.11 NNC(=O)C1=CC=CO1 BB01-6372 [0,2,0,0,0,0|0,0,0]=2 49 B9R1.11 NNC(=O)C1=NC=CN1 BB01-6031 [0,2,0,0,0,0|2,0,0]=4 50 B9R1.41 CC1=C(C(=O)O)N=CN1 BB12-2055 [0,2,0,0,0,0|2,0,0]=4 51 B9R1.41 CC1=C(C(=O)O)N=CS1 BB26-0189 [0,2,0,0,0,0|2,0,0]=4 52 B9R1.41 CC1=C(C(=O)O)SC=N1 BB12-3519 [0,2,0,0,0,0|1,1,0]=4 53 B9R1.41 NC1=C(C(=O)O)NN=C1 BB55-4193 [0,2,0,0,0,0|2,0,0]=4 54 B9R1.41 NC1=C(C(=O)O)SC=C1 BB53-1404 [0,2,0,0,0,0|0,1,0]=3 55 B9R1.41 O=C(O)C1=C(Br)C=NN1 BB55-3823 [0,2,0,0,0,0|2,0,0]=4 56 B9R1.41 O=C(O)C1=C(Cl)C=NN1 BB56-2893 [0,2,0,0,0,0|2,0,0]=4 57 B9R1.41 O=[N+]([O-])C1=C(Br)C=CS1 BB20-4586 [0,2,0,0,0,0|1,1,0]=4 58 B9R1.12 O=C=NCC1=CC=CS1 BB12-1538 [0,2,0,0,0,0|0,1,1]=4 59 B9R1.13 CC(=O)CC1=CC=CS1 BB12-3710 [0,2,0,0,0,0|0,1,0]=3 60 B9R1.13 N=C(N)CC1=CC=CS1 BB12-3709 [0,2,0,0,0,0|1,1,0]=4 61 B9R1.33 CN1C=CC=C1\C=N\O BB20-3210 [0,2,0,0,0,0|1,0,1]=4