SMILES:
CC(C)CSc1ncccc1C(=O)OMolecular Processing
Molecular formula
C10H13NO2S
Molecular weight
211.29
Exact mass
211.0667
XLogP
2.53
TPSA
50.19
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
14
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.4
Molar refractivity
56.76
Supplementary Information
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