Compound Name

SMILES String

Cn1cc(cn1)-c1nc(cnc1C#N)N1CCC2(CCC(=O)N2CC2CC2)CC1

Cn1cc(cn1)-c1nc(cnc1C#N)N1CCC2(COC(=O)N2CC2(C)COC2)CC1

Cn1cc(cn1)-c1nc(cnc1C#N)N1CCC2(CNC(=O)N2CC2CC2)CC1

CN(C)CCN1CC2(CCN(CC2)c2cnc(C#N)c(n2)-c2cnn(C)c2)N(CC2CC2)C1=O

CC(N1C(=O)N(CCN(C)C)CC11CCN(CC1)c1cnc(C#N)c(n1)-c1cnn(C)c1)C(F)(F)F

Cn1cc(cn1)-c1nc(cnc1C#N)N1CCC2(CNS(=O)(=S)N2CC2CC2)CC1

Cn1cc(cn1)-c1nc(cnc1C#N)N1CCC2(CC1)NC(=O)OC2CC1CC1

CCC1C(=O)NCC11CCN(CC1)c1cnc(C#N)c(n1)-c1cnn(C)c1

COCCN1CC2(CCN(CC2)c2cnc(C#N)c(n2)-c2cnn(C)c2)N(CC2CC2)C1=O

CC(C)CC1OC(=O)NCC11CCN(CC1)c1cnc(C#N)c(n1)-c1cnn(C)c1

Cn1cc(cn1)-c1nc(cnc1C#N)N1CCC2(CNC(=O)N2CC(F)(F)F)CC1

FC(F)n1cc(cn1)-c1nc(cnc1C#N)N1CCC2(COC(=O)N2CC2CC2)CC1

C[C@@H]1CN(CCN1C(=O)C1CC1)c1nc(cnc1C#N)-c1cnn(C)c1 |r|

C[C@@H]1C[C@H]1C(=O)N1CCN(C[C@H]1C)c1cnc(C#N)c(n1)-c1cnn(C)c1 |r|

C[C@@H]1CN(CCN1C(=O)C1CC1)c1cnc(C#N)c(n1)-c1cnn(C)c1 |r|

C[C@@H]1CN(CCN1C(=O)NC1CC1)c1cnc(C#N)c(n1)-c1cnn(C)c1 |r|

C[C@@H]1C[C@H]1C(=O)N1CCN(C[C@H]1C)c1cnc(C#N)c(n1)-c1cnn(c1)C(F)F |r|

CC(C)C[C@@H]1CN(CCN1C(=O)C1CC1)c1cnc(C#N)c(n1)-c1cnn(C)c1 |r|

Cn1cc(cn1)-c1nc(cnc1C#N)N1CCC2(CCC(=O)N2CC2CC(F)(F)C2)CC1

Cn1cc(cn1)-c1nc(cnc1C#N)N1CCC2(CCC(=O)N2CC(F)(F)F)CC1

CCCN1C(=O)OCC11CCN(CC1)c1cnc(C#N)c(n1)-c1cnn(C)c1

Cn1cc(cn1)-c1nc(cnc1C#N)N1CCC2(COC(=O)N2CC2CCC2)CC1

Cn1cc(cn1)-c1nc(cnc1C#N)N1CCC2(CC1)COCC(=O)N2CC1CC1

Cn1cc(cn1)-c1nc(cnc1C#N)N1CCC(C)(CC1)N1CCOCC1

Cn1cc(cn1)-c1nc(cnc1C#N)N1CCC(C)(CC1)N1CCCCC1

CO[C@H]1C[C@H](C1)C(=O)N1CCN(C[C@H]1C)c1cnc(C#N)c(n1)-c1cnn(C)c1 |r,wU:4.6,2.1,wD:13.15,(9.57,.45,;8.23,-.32,;6.9,.45,;5.41,.05,;5.01,1.54,;6.5,1.94,;3.68,2.31,;3.68,3.85,;2.35,1.54,;1.01,2.31,;-.32,1.54,;-.32,,;1.01,-.77,;2.35,,;3.68,-.77,;-1.66,-.77,;-1.66,-2.31,;-2.99,-3.08,;-4.32,-2.31,;-5.66,-3.08,;-6.99,-3.85,;-4.32,-.77,;-2.99,,;-5.66,,;-5.66,1.54,;-7.12,2.02,;-8.03,.77,;-9.57,.77,;-7.12,-.48,)|

C[C@@H]1CN(CCN1C(=O)C1CC(F)(F)C1)c1cnc(C#N)c(n1)-c1cnn(C)c1 |r|

C[C@@H]1CN(CCN1C(=O)[C@@H]1C[C@@H]1F)c1cnc(C#N)c(n1)-c1cnn(C)c1 |r|

CCC(=O)N1CCN(C[C@H]1C)c1cnc(C#N)c(n1)-c1cnn(C)c1 |r|

C[C@@H]1CN(CCN1C(=O)C1(C)CC1)c1cnc(C#N)c(n1)-c1cnn(C)c1 |r|

C[C@@H]1CN(CCN1C(=O)N1CCCC1)c1cnc(C#N)c(n1)-c1cnn(C)c1 |r|

C[C@@H]1CN(CCN1C(=O)N1CC2(COC2)C1)c1cnc(C#N)c(n1)-c1cnn(C)c1 |r|

C[C@@H]1CN(CCN1C(=O)NCC1CC1)c1cnc(C#N)c(n1)-c1cnn(C)c1 |r|

CO[C@H]1CCN(C1)C(=O)N1CCN(C[C@H]1C)c1cnc(C#N)c(n1)-c1cnn(C)c1 |r|

COC1CN(C1)C(=O)N1CCN(C[C@H]1C)c1cnc(C#N)c(n1)-c1cnn(C)c1 |r|

C[C@@H]1CN(CCN1C(=O)N1CCC1)c1cnc(C#N)c(n1)-c1cnn(C)c1 |r|

COC(=O)N1CCN(C[C@H]1C)c1cnc(C#N)c(n1)-c1cnn(C)c1 |r|

C[C@@H]1C[C@H]1C(=O)N1CCN(C[C@H]1C)c1cnc(C#N)c(n1)-c1cn[nH]c1 |r|