Cn1c(S)nc(-c2ccncc2)cc1=O
SMILES: Cn1c(S)nc(-c2ccncc2)cc1=O

Molecular Processing

Molecular formula
C10H9N3OS
Molecular weight
219.27
Exact mass
219.0466
XLogP
1.13
TPSA
47.78
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
1
Heavy atoms
15
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.1
Molar refractivity
59.96

Supplementary Information

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