SMILES:
CSCCC(NC(=O)C(N)Cc1ccccc1)C(=O)OCc1ccccc1Molecular Processing
Molecular formula
C21H26N2O3S
Molecular weight
386.52
Exact mass
386.1664
XLogP
2.54
TPSA
81.42
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
10
Heavy atoms
27
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
109.29
Supplementary Information
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