0 B14R2.22 NC1=NN=C(C2=CC=CC(Cl)=C2)S1 AK186706 [0,0,0,0,0,0|3,0,1]=4 1 B14R2.22 O=C1NCC(C2=CC=CC(Br)=C2)C1 AK-77912 [0,0,0,0,0,0|3,1,0]=4 2 B13R2.10 BrC1=NC(C2=CC=CC=C2)=NO1 AK-42004 [1,0,0,0,0,0|2,0,1]=4 3 B13R2.10 C1=C(C2CC(=O)NC2)C=CC=C1 AK-23788 [1,0,0,0,0,0|3,0,0]=4 4 B13R2.10 NC1=CC(C2=CC=CC=C2)=NO1 AK-98958 [1,0,0,0,0,0|2,0,1]=4 5 B13R2.10 NC1=NC(C2=CC=CC=C2)=CN1 AK477790 [1,0,0,0,0,0|1,0,2]=4 6 B13R2.10 NC1=NN(C2=CC=CC=C2)C=C1 AK126060 [1,0,0,0,0,0|2,0,1]=4 7 B13R2.10 O=C1OC[C@@H](C2=CC=CC=C2)N1 AK-68242 [1,0,0,0,0,0|1,0,1]=3 8 B13R2.10 OC1=NC(C2=CC=CC=C2)=NO1 AK-67990 [1,0,0,0,0,0|2,0,1]=4 9 B13R2.10 [C@H]1(NC(OC1)=O)C2=CC=CC=C2 AK-47582 [1,0,0,0,0,0|1,0,1]=3 10 B13R2.13 ClC1=CC([C@@H]2NCCC2)=CC=C1 AK172650 [1,0,0,0,0,0|1,0,2]=4 11 B15R2.299 ClC1=CC=C(C2=CSC(N)=N2)C=C1Cl AK-39998 [0,1,0,0,0,0|0,1,2]=4 12 B13R1.15 COC(=O)CCC1=CC=CC(O)=C1 AK-79037 [0,0,1,0,0,0|3,0,0]=4 13 B13R1.15 O=C(OC)CCC1=CC=CC(Br)=C1 AK-83017 [0,0,1,0,0,0|2,1,0]=4 14 B12R1.27 C1=C(CCC(OC)=O)C=CC=C1 AK-41212 [1,0,1,0,0,0|2,0,0]=4 15 B12R1.226 C1=C(C=CC=C1CCC(O)=O)Cl AK-48858 [1,0,1,0,0,0|2,0,0]=4 16 B14R2.4476 O=C(C1C(C2=CC=CC(Cl)=C2)C1)O AK167718 [0,0,1,1,0,0|2,0,0]=4 17 B12R1.50 O=C(OC)CC1=CC=CC(Br)=C1 AK-33399 [0,0,1,0,1,0|1,1,0]=4 18 B12R1.50 O=C(OC)CC1=CC=CC(F)=C1 AK161785 [0,0,1,0,1,0|1,1,0]=4 19 B12R1.50 O=C(OC)CC1=CC=CC(N)=C1 AK-35502 [0,0,1,0,1,0|2,0,0]=4 20 B12R1.50 O=C(OC)CC1=CC=CC(N)=C1 AK-86789 [0,0,1,0,1,0|2,0,0]=4 21 B12R1.50 O=C(OC)CC1=NC(Cl)=CC=C1 AK-63367 [0,0,1,0,1,0|2,0,0]=4 22 B12R1.225 CC(C(O)=O)C1=CC=CC(Cl)=C1 AK-59290 [0,0,1,0,1,0|1,0,0]=3 23 B12R1.225 O=C(O)C(N)C1=CC=CC(Cl)=C1 AK-45445 [0,0,1,0,1,0|2,0,0]=4 24 B12R1.225 O=C(O)[C@H](N)C1=CC=CC(Cl)=C1 AK167541 [0,0,1,0,1,0|2,0,0]=4 25 B12R2.22 NC1CC(C2=CC=CC=C2)C1 AK186081 [1,0,0,0,1,0|1,0,1]=4 26 B14R2.19 O=C1OCC(CC2=CC=CC=C2)C1 AK174602 [1,0,0,0,0,1|2,0,0]=4 27 B14R2.19 O=C1OC[C@H](CC2=CC=CC=C2)N1 AK-73049 [1,0,0,0,0,1|1,0,1]=4 28 B14R2.19 [C@H]1(CC2=CC=CC=C2)NC(OC1)=O AK-47452 [1,0,0,0,0,1|1,0,1]=4 29 B14R2.68 O=C1CN[C@@H](C2=CC=CC=C2)CO1 AK143261 [1,0,0,0,0,1|1,0,1]=4