Cc1nc2c(N)ccc(C#N)c2o1
SMILES: Cc1nc2c(N)ccc(C#N)c2o1

Molecular Processing

Molecular formula
C9H7N3O
Molecular weight
173.17
Exact mass
173.0589
XLogP
1.59
TPSA
75.84
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
0
Heavy atoms
13
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.111
Molar refractivity
47.87

Supplementary Information

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