SMILES:
O=C(SCCC(=O)N1c2ccccc2CCC1C(=O)O)c1ccccc1Molecular Processing
Molecular formula
C20H19NO4S
Molecular weight
369.44
Exact mass
369.1035
XLogP
3.38
TPSA
74.68
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
26
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
101.52
Supplementary Information
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