Nc1nc(S)nc2c1nc(O)n2Cc1ccccc1
SMILES: Nc1nc(S)nc2c1nc(O)n2Cc1ccccc1

Molecular Processing

Molecular formula
C12H11N5OS
Molecular weight
273.32
Exact mass
273.0684
XLogP
1.45
TPSA
89.85
H-bond donors
3
H-bond acceptors
6
Rotatable bonds
2
Heavy atoms
19
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.083
Molar refractivity
74.2

Supplementary Information

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