COC(=O)c1sc(-c2ccccc2)cc1NC1CCC2(CC1)OCCO2
SMILES: COC(=O)c1sc(-c2ccccc2)cc1NC1CCC2(CC1)OCCO2

Molecular Processing

Molecular formula
C20H23NO4S
Molecular weight
373.47
Exact mass
373.1348
XLogP
4.3
TPSA
56.79
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
4
Heavy atoms
26
Rings
4
Aromatic rings
2
Saturated rings
2
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.45
Molar refractivity
101.61

Supplementary Information

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