0 B10R1.1 CNCC1=CC=C(C)C=C1 4089741 [0,0,0,0,0,0|2,0,1]=3 1 B10R1.1 CNCC1=CC=C(Cl)N=C1 4088428 [0,0,0,0,0,0|3,0,1]=4 2 B10R1.1 NNCC1=CC=C(Cl)C=C1 4088846 [0,0,0,0,0,0|3,0,0]=3 3 B10R1.1 NNCC1=CC=C(F)C=C1 4088591 [0,0,0,0,0,0|3,0,0]=3 4 B9R1.1 CC1=CN=C(CN)C=C1 4010338 [1,0,0,0,0,0|3,0,0]=4 5 B9R1.1 CC1=CN=C(CN)C=C1 4089721 [1,0,0,0,0,0|3,0,0]=4 6 B9R1.1 CCC1=CN=C(O)N=C1 4090949 [1,0,0,0,0,0|2,0,1]=4 7 B9R1.8 CNCC1=CC=NC=C1 3002392 [1,0,0,0,0,0|2,0,1]=4 8 B9R1.8 NCCC1=NC=CC=C1 3020070 [1,0,0,0,0,0|2,0,1]=4 9 B11R1.1 C#CCOC1=CC=C(N)C=C1 4089055 [0,1,0,0,0,0|1,0,2]=4 10 B11R1.1 CCCSC1=CC=C(N)C=C1 4090004 [0,1,0,0,0,0|1,0,2]=4 11 B11R1.1 NCCOC1=CC=C(Br)C=C1 4090090 [0,1,0,0,0,0|2,0,1]=4 12 B11R1.1 NCCOC1=CC=C(Cl)C=C1 4088197 [0,1,0,0,0,0|2,0,1]=4 13 B11R1.22 CCC(N)C1=CC=C(Cl)C=C1 3002119 [0,1,0,0,0,0|1,0,2]=4 14 B11R1.22 CCC(N)C1=CC=C(O)C=C1 4088665 [0,1,0,0,0,0|0,0,2]=3 15 B11R1.22 CNC(C)C1=CC=C(Cl)C=C1 4088802 [0,1,0,0,0,0|2,0,1]=4 16 B11R1.83 CCC1=CC=C(CNN)C=C1 4090815 [0,1,0,0,0,0|3,0,0]=4 17 B11R1.83 COC1=CC=C(CNN)C=C1 4085299 [0,1,0,0,0,0|2,0,0]=3 18 B11R2.36 BrC1=CC2=C(C=C1)OC=N2 4002139 [0,0,0,1,0,0|3,0,0]=4 19 B11R2.36 ClC1=CC2=C(C=C1)NC=C2 3020104 [0,0,0,1,0,0|2,0,0]=3 20 B11R2.36 ClC1=CC2=C(C=CN2)C=C1 3020088 [0,0,0,1,0,0|2,0,1]=4 21 B11R2.36 NC1=CC2=C(C=C1)SC=N2 4087784 [0,0,0,1,0,0|3,0,0]=4 22 B11R2.36 NC1=CC2=C(C=C1)SC=N2 4087785 [0,0,0,1,0,0|3,0,0]=4 23 B11R2.36 OC1=CC=C2NC=NC2=C1 4088281 [0,0,0,1,0,0|2,0,0]=3 24 B8R1.2 BrCC1=CN=CC=C1 4090400 [2,0,0,0,0,0|2,0,0]=4 25 B8R1.3 CC1=CN=C(O)N=C1 4090925 [2,0,0,0,0,0|2,0,0]=4 26 B10R1.13 CC1=CC=C(C(C)N)C=C1 3002653 [1,1,0,0,0,0|1,0,1]=4 27 B10R1.13 N=C(N)C1=CC=C(Br)C=C1 4090345 [1,1,0,0,0,0|2,0,0]=4 28 B10R1.13 N=C(N)C1=CC=C(F)C=C1 4089401 [1,1,0,0,0,0|2,0,0]=4 29 B10R1.25 NCC1=C(O)C=C(O)C=C1 4089662 [1,1,0,0,0,0|1,0,0]=3 30 B10R1.4 CC1=C(CNN)C=CC=C1 4089820 [1,1,0,0,0,0|2,0,0]=4 31 B10R1.4 CNCC1=CC=CC=C1C 4090872 [1,1,0,0,0,0|1,0,1]=4 32 B10R1.4 NNCC1=C(Cl)C=CC=C1 4090851 [1,1,0,0,0,0|2,0,0]=4 33 B10R1.10 NNCC1=CC=CC(Cl)=C1 4088727 [1,1,0,0,0,0|2,0,0]=4 34 B10R1.15 O[C@@H](CBr)C1=CC=CC=C1 4053875 [1,1,0,0,0,0|1,0,1]=4 35 B10R1.15 O[C@H](CBr)C1=CC=CC=C1 4068902 [1,1,0,0,0,0|1,0,1]=4 36 B10R1.17 NCCSC1=CC=CC=C1 4002675 [1,1,0,0,0,0|1,0,1]=4 37 B10R1.17 NC\C=C\C1=CC=CC=C1 4090564 [1,1,0,0,0,0|0,0,2]=4 38 B10R1.18 CC(=O)CC1=CC=CN=C1 4090943 [1,1,0,0,0,0|1,0,1]=4 39 B10R1.18 N=C(N)CC1=CC=CN=C1 4089686 [1,1,0,0,0,0|2,0,0]=4 40 B10R1.18 N=C(N)CC1=NC=CC=C1 4088302 [1,1,0,0,0,0|2,0,0]=4 41 B12R1.4 COC1=CC=C(CC(=N)N)C=C1 4088669 [0,2,0,0,0,0|1,0,0]=3 42 B12R1.113 CNCC1=CC=C(C(=O)O)C=C1 4089273 [0,2,0,0,0,0|1,0,1]=4 43 B12R2.606 CC1=CC2=C(C=CC(N)=C2)O1 4088493 [0,1,0,1,0,0|2,0,0]=4 44 B12R2.606 CC1=NC2=CC(O)=CC=C2N1 4088891 [0,1,0,1,0,0|1,0,1]=4 45 B12R2.606 NC1=CC2=C(C=C1)CC(=O)N2 4087893 [0,1,0,1,0,0|2,0,0]=4 46 B12R2.44 COC1=CC2=C(C=C1)NC=C2 3020313 [0,1,0,1,0,0|1,0,0]=3