CCOC(=O)CSc1cccc(N)c1
SMILES: CCOC(=O)CSc1cccc(N)c1

Molecular Processing

Molecular formula
C10H13NO2S
Molecular weight
211.29
Exact mass
211.0667
XLogP
1.92
TPSA
52.32
H-bond donors
1
H-bond acceptors
4
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
0.3
Molar refractivity
58.21

Supplementary Information

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