Cc1ccc(C2N[C@@H](C(=O)O)C(C)(C)S2)cc1
Name: 5,5-dimethyl-2-(4-methylphenyl)-thiazolidine-4(S)-carboxylic acid
SMILES: Cc1ccc(C2N[C@@H](C(=O)O)C(C)(C)S2)cc1

Molecular Processing

Molecular formula
C13H17NO2S
Molecular weight
251.35
Exact mass
251.098
XLogP
2.56
TPSA
49.33
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
17
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.462
Molar refractivity
70.15

Supplementary Information

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