SMILES:
COC(=O)N(c1ccc(-c2ccsc2)cc1)[C@@H](C(=O)O)[C@H](C)OMolecular Processing
Molecular formula
C16H17NO5S
Molecular weight
335.38
Exact mass
335.0827
XLogP
2.82
TPSA
87.07
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
23
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
87.74
Supplementary Information
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