이름: compound
SMILES:
COC(=O)CCC(=O)c1ccc(SC(=O)N(C)C)cc1Molecular Processing
Molecular formula
C14H17NO4S
Molecular weight
295.36
Exact mass
295.0878
XLogP
2.6
TPSA
63.68
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
20
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.357
Molar refractivity
76.96
Supplementary Information
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