COc1ccc(Sc2nccn2C)c([N+](=O)[O-])c1
SMILES: COc1ccc(Sc2nccn2C)c([N+](=O)[O-])c1

Molecular Processing

Molecular formula
C11H11N3O3S
Molecular weight
265.29
Exact mass
265.0521
XLogP
2.49
TPSA
70.19
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
18
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.182
Molar refractivity
66.98

Supplementary Information

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