CSc1nc2ccc(S(=O)(=O)NC(C(=O)O)C(C)C)cc2s1
SMILES: CSc1nc2ccc(S(=O)(=O)NC(C(=O)O)C(C)C)cc2s1

Molecular Processing

Molecular formula
C13H16N2O4S3
Molecular weight
360.48
Exact mass
360.0272
XLogP
2.41
TPSA
96.36
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
6
Heavy atoms
22
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.385
Molar refractivity
87.98

Supplementary Information

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