COC1NC(=O)c2ncc(C#N)cc2C1F
名称: 5-fluoro-6-methoxy-8-oxo-5,6,7,8-tetrahydro-1,7-naphthyridine-3-carbonitrile
SMILES: COC1NC(=O)c2ncc(C#N)cc2C1F

Molecular Processing

Molecular formula
C10H8FN3O2
Molecular weight
221.19
Exact mass
221.0601
XLogP
0.68
TPSA
75.01
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
1
Heavy atoms
16
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.3
Molar refractivity
51.06

Supplementary Information

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