SMILES:
C=C(C)C(C(=O)OCc1ccc(OC)cc1)N1C(=O)C(NC(=O)COc2ccccc2)C1SS(=O)(=O)c1ccccc1Molecular Processing
Molecular formula
C30H30N2O8S2
Molecular weight
610.71
Exact mass
610.1444
XLogP
3.54
TPSA
128.31
H-bond donors
1
H-bond acceptors
9
Rotatable bonds
13
Heavy atoms
42
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
3
Undefined stereo
3
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.233
Molar refractivity
157.11
Supplementary Information
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