O=C(OCc1ccccc1)C1C(Sc2ccccc2)CC2CC(=O)N21
SMILES: O=C(OCc1ccccc1)C1C(Sc2ccccc2)CC2CC(=O)N21

Molecular Processing

Molecular formula
C20H19NO3S
Molecular weight
353.44
Exact mass
353.1086
XLogP
3.26
TPSA
46.61
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
25
Rings
4
Aromatic rings
2
Saturated rings
2
Aliphatic rings
2
Stereo centers
3
Undefined stereo
3
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.3
Molar refractivity
95.98

Supplementary Information

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