COC(=O)[C@@H](Cc1cc(C)c(NC(=O)OC(C)(C)C)cc1CCl)NC(=O)OCc1ccccc1
SMILES: COC(=O)[C@@H](Cc1cc(C)c(NC(=O)OC(C)(C)C)cc1CCl)NC(=O)OCc1ccccc1

Molecular Processing

Molecular formula
C25H31ClN2O6
Molecular weight
490.98
Exact mass
490.1871
XLogP
5.09
TPSA
102.96
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
8
Heavy atoms
34
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.4
Molar refractivity
129.86

Supplementary Information

Details werden geladen…

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