0 B16R2.2256 C(NCC1=NC=CC=C1)C2=NC=CC=C2 AK-81500 [0,0,0,0,0,0|3,0,0]=3 1 B16R2.2256 C1(N\N=C\C2=CC=CC=C2)=CC=CC=C1 AK167459 [0,0,0,0,0,0|2,0,1]=3 2 B16R2.2256 C1(OCCC2=CC=CC=C2)=CC=CC=C1 AK-84443 [0,0,0,0,0,0|2,0,0]=2 3 B17R2.143 CN(CC1=CC=CC=C1)CC2=CC=CC=C2 AK162499 [0,1,0,0,0,0|1,0,0]=2 4 B17R2.143 O=C(CC1=CC=CC=C1)CC2=CC=CC=C2 AK158939 [0,1,0,0,0,0|1,0,0]=2 5 B17R2.143 O=C(NC1=CC=CC=C1)CC2=CC=CC=C2 AK139966 [0,1,0,0,0,0|2,0,0]=3 6 B17R2.2342 CC(C1=CC=CC=C1)CCC2=CC=CC=C2 AK545141 [0,1,0,0,0,0|1,0,0]=2 7 B17R2.2342 C[C@@H](C1=CC=CC=C1)NCC2=CC=CC=C2 AK-41497 [0,1,0,0,0,0|1,0,0]=2 8 B17R2.2342 C[C@@H](NCC1=CC=CC=C1)C2=CC=CC=C2 AK-41673 [0,1,0,0,0,0|1,0,0]=2 9 B17R2.2342 O=C(C1=CC=CC=C1)CCC2=CC=CC=C2 AK-93469 [0,1,0,0,0,0|1,0,1]=3 10 B17R2.2342 O=C(C1=CC=CC=C1)\C=C\C2=CC=CC=C2 AK-93565 [0,1,0,0,0,0|1,0,2]=4 11 B17R2.2342 O=C(NCC1=CC=CC=C1)C2=CC=CC=C2 AK323209 [0,1,0,0,0,0|1,0,1]=3 12 B17R2.2342 O=C(OCC1=CC=CC=C1)C2=CN=CC=C2 AK114370 [0,1,0,0,0,0|1,0,1]=3 13 B17R2.2342 OC(C1=CC=CC=C1)COC2=CC=CC=C2 AK318401 [0,1,0,0,0,0|2,0,0]=3 14 B17R3.8 C1(C2=CC=CC=C2)=NNC3=C1C=CC=C3 AK-57502 [0,0,0,1,0,0|2,0,1]=4 15 B17R3.8 N1(C2=CC=CC=C2)C=CC3=C1C=CC=C3 AK-45364 [0,0,0,1,0,0|2,0,1]=4 16 B17R3.8 N1(C2=CC=CC=C2)C=NC3=CC=CC=C13 AK123264 [0,0,0,1,0,0|3,0,0]=4 17 B17R3.8 N1(C2=CC=CC=C2)N=NC3=CC=CC=C31 AK149942 [0,0,0,1,0,0|3,0,0]=4 18 B15R2.2195 C1(OCC2=CC=CC=C2)=CC=NC=C1 AK140678 [0,0,0,0,1,0|1,0,0]=2 19 B15R2.2195 C1(SCC2=CC=CC=C2)=CC=CC=C1 AK116684 [0,0,0,0,1,0|0,1,0]=2 20 B16R2.71 ClC1=NC=NC=C1OCC2=CC=CC=C2 AK120110 [0,1,0,0,1,0|2,0,0]=4 21 B16R2.71 NC1=C(NCC2=CC=CC=C2)C=NC=C1 AK-89865 [0,1,0,0,1,0|2,0,0]=4 22 B16R2.71 NC1=CC=CC=C1C#CC2=CC=CC=C2 AK193571 [0,1,0,0,1,0|0,0,2]=4 23 B16R2.71 NC1=NC=CN=C1OCC2=CC=CC=C2 AK-23602 [0,1,0,0,1,0|2,0,0]=4 24 B16R2.71 O=C1C(OCC2=CC=CC=C2)=COC=C1 AK103191 [0,1,0,0,1,0|1,0,0]=3 25 B16R2.71 OC1=CC=CN=C1OCC2=CC=CC=C2 AK-36731 [0,1,0,0,1,0|1,0,0]=3 26 B16R2.88 CN(CC1=CC=CC=C1)C2=CC=CC=C2 AK114558 [0,1,0,0,1,0|1,0,0]=3 27 B16R2.88 O=C(CC1=CC=NC=C1)C2=CC=CC=C2 AK100106 [0,1,0,0,1,0|1,0,1]=4 28 B16R2.132 BrC1=CN=C(OCC2=CC=CC=C2)C=C1 AK-29563 [0,1,0,0,1,0|1,0,0]=3 29 B16R2.132 BrC1=NC=C(OCC2=CC=CC=C2)C=C1 AK143482 [0,1,0,0,1,0|1,0,0]=3 30 B16R2.132 C(C1=CC=CC=C1)OC2=CN=C(C=C2)N AK-30591 [0,1,0,0,1,0|1,0,0]=3 31 B16R2.132 C(C1=CC=CC=C1)OC2=CN=C(N=C2)Cl AK-25004 [0,1,0,0,1,0|2,0,0]=4 32 B16R2.132 C1=C(C=CC=C1)COC2=CC=C(C=C2)Br AK-46330 [0,1,0,0,1,0|0,0,0]=2 33 B16R2.132 C1=C(OCC2=CC=CC=C2)C=CC(=C1)N AK-35954 [0,1,0,0,1,0|0,0,0]=2 34 B16R2.132 C1=C(OCC2=CC=CC=C2)C=CC(=C1)O AK-41211 [0,1,0,0,1,0|0,0,0]=2 35 B16R2.132 ClC1=NN=C(OCC2=CC=CC=C2)C=C1 AK115297 [0,1,0,0,1,0|2,0,0]=4 36 B16R2.132 NC1=CC=C(CCC2=CC=CC=C2)C=C1 AK399667 [0,1,0,0,1,0|0,0,0]=2 37 B16R2.132 NC1=CC=C(NCC2=CC=CC=C2)C=C1 AK118190 [0,1,0,0,1,0|1,0,0]=3 38 B16R2.132 NC1=CC=C(OCC2=CC=CC=C2)C=C1 AK-44726 [0,1,0,0,1,0|0,0,0]=2 39 B16R2.132 OC1=CC=C(NCC2=CC=CC=C2)C=C1 AK135637 [0,1,0,0,1,0|1,0,0]=3 40 B16R2.132 OC1=CC=C(OCC2=CC=CC=C2)N=C1 AK-90896 [0,1,0,0,1,0|1,0,0]=3 41 B16R2.252 BrC1=CC(OCC2=CC=CC=C2)=NC=C1 AK-91398 [0,1,0,0,1,0|1,0,0]=3 42 B16R2.252 BrC1=CC=CC(OCC2=CC=CC=C2)=C1 AK-61852 [0,1,0,0,1,0|0,0,0]=2 43 B16R2.252 BrC1=CN=CC(OCC2=CC=CC=C2)=C1 AK-57446 [0,1,0,0,1,0|1,0,0]=3 44 B16R2.252 C(C1=CC=CC=C1)OC2=CC(=NC=C2)N AK-47614 [0,1,0,0,1,0|1,0,0]=3 45 B16R2.252 C(C1=CC=CC=C1)OC2=CC(NC=C2)=O AK-28511 [0,1,0,0,1,0|1,0,0]=3 46 B16R2.252 C(C1=CC=CC=C1)OC2=NC(=CN=C2)Cl AK-29281 [0,1,0,0,1,0|2,0,0]=4 47 B16R2.252 C1=C(C=CC=C1N)OCC2=CC=CC=C2 AK-47462 [0,1,0,0,1,0|0,0,0]=2 48 B16R2.252 C1=C(CCC2=CC=CC=C2)C=CC=C1O AK-27011 [0,1,0,0,1,0|0,0,0]=2 49 B16R2.252 C1=CC=CC=C1COC2=NC=CC(=N2)N AK-24174 [0,1,0,0,1,0|2,0,0]=4 50 B16R2.252 ClC1=NC=CC(OCC2=CC=CC=C2)=N1 AK-54508 [0,1,0,0,1,0|2,0,0]=4 51 B16R2.252 IC1=CC(OCC2=CC=CC=C2)=NC=C1 AK143745 [0,1,0,0,1,0|1,0,0]=3 52 B16R2.252 OC1=CC=CC(OCC2=CC=CC=C2)=C1 AK111125 [0,1,0,0,1,0|0,0,0]=2 53 B18R2.7189 O[C@@H](C1=CC=CC=C1)CNCC2=CC=CC=C2 AK-43946 [0,1,0,0,0,1|1,0,0]=3 54 B18R2.7204 CC(OC1=CC=CC=C1)C(C2=CC=CC=C2)O AK318409 [0,2,0,0,0,0|2,0,0]=4 55 B18R2.253 C(C1=CC=CC=C1)OC(C2=CC=C(C=C2)I)=O AK-39970 [0,2,0,0,0,0|0,0,1]=3 56 B18R2.253 O=C(C1=CC=C(Cl)C=C1)CCC2=CC=CC=C2 AK178388 [0,2,0,0,0,0|1,0,1]=4 57 B18R2.253 O=C(OCC1=CC=CC=C1)C2=CC=C(C)C=C2 AK155074 [0,2,0,0,0,0|0,0,1]=3 58 B18R2.253 O=C(OCC1=CC=CC=C1)C2=CN=C(N)C=C2 AK131047 [0,2,0,0,0,0|1,0,1]=4 59 B18R2.3634 O=C(OC(C1=CC=CC=C1)=O)C2=CC=CC=C2 AK114006 [0,2,0,0,0,0|0,0,2]=4 60 B18R2.4001 O=C(OCC1=CC=CC=C1)C2=CC=CC=C2O AK113973 [0,2,0,0,0,0|0,0,1]=3 61 B16R3.9 C12=CC=CC=C1C=CC3=CC=CC=C23 AK113960 [0,0,0,1,1,0|0,0,2]=4 62 B18R3.2098 C(C1=NNC2=CC=CC=C12)C3=CC=CC=C3 AK111049 [0,0,0,1,0,1|2,0,0]=4 63 B18R3.2098 N1(CC2=CC=CC=C2)N=NC3=CC=CC=C31 AK149946 [0,0,0,1,0,1|2,0,0]=4 64 B18R3.2108 C1=CC=C(C=C1)[C@H]2C3=CC=CC=C3CCN2 AK-23529 [0,0,0,1,0,1|1,0,0]=3 65 B18R3.2108 C1=CC=CC2=C1C(NCC2)C3=CC=CC=C3 AK-23557 [0,0,0,1,0,1|1,0,0]=3 66 B18R3.2108 C1CC2=C(C=CC=C2)[C@H](N1)C3=CC=CC=C3 AK-67663 [0,0,0,1,0,1|1,0,0]=3 67 B18R3.12875 C1(CC2=CC=CC=C2)=NC3=CC=CC=C3N1 AK106243 [0,1,0,1,0,0|2,0,0]=4 68 B18R3.4253 ClC1=CC2=C(C3=CC=CC=C3)ON=C2C=C1 AK122550 [0,1,0,1,0,0|1,0,1]=4 69 B18R3.11551 O=C1CC(C2=CC=CC=C12)C3=CC=CC=C3 AK-60954 [0,1,0,1,0,0|1,0,1]=4 70 B14R2.6 C1(CC2=CC=CC=C2)=CC=CN=C1 AK116666 [0,0,0,0,2,0|1,0,0]=3 71 B14R2.6 C1(OC2=CC=CC=C2)=NC=CC=C1 AK-86394 [0,0,0,0,2,0|1,0,0]=3 72 B14R2.6 C1([I+]C2=CC=CC=C2)=CC=CC=C1 AK126347 [0,0,0,0,2,0|1,0,0]=3 73 B14R2.6 C1([I+]C2=CC=CC=C2)=CC=CC=C1 AK325425 [0,0,0,0,2,0|1,0,0]=3 74 B14R2.6 C1([I+]C2=CC=CC=C2)=CC=CC=C1 AK397830 [0,0,0,0,2,0|1,0,0]=3 75 B14R2.6 C1=C(OC2=CC=CC=C2)C=CN=C1 AK-44680 [0,0,0,0,2,0|1,0,0]=3 76 B14R2.6 O(C1=CC=CC=C1)C2=CC=CN=C2 AK-79452 [0,0,0,0,2,0|1,0,0]=3