CC[C@@H](Nc1cnc(C#N)c(Nc2ccc3c(c2)CCC(=O)N3)n1)C(N)=O
Name: (R)-2-(5-cyano-6-(2-oxo-1,2,3,4-tetrahydroquinolin-6-ylamino)pyrazin-2-ylamino)butanamide
SMILES: CC[C@@H](Nc1cnc(C#N)c(Nc2ccc3c(c2)CCC(=O)N3)n1)C(N)=O

Molecular Processing

Molecular formula
C18H19N7O2
Molecular weight
365.4
Exact mass
365.16
XLogP
1.65
TPSA
145.82
H-bond donors
4
H-bond acceptors
7
Rotatable bonds
6
Heavy atoms
27
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.278
Molar refractivity
100.32

Supplementary Information

Details werden geladen…

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