COC(=O)c1ccc(CN2C(=O)C3(COc4cc5c(cc43)OCO5)c3ccccc32)cc1
SMILES: COC(=O)c1ccc(CN2C(=O)C3(COc4cc5c(cc43)OCO5)c3ccccc32)cc1

Molecular Processing

Molecular formula
C25H19NO6
Molecular weight
429.43
Exact mass
429.1212
XLogP
3.43
TPSA
74.3
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
3
Heavy atoms
32
Rings
6
Aromatic rings
3
Saturated rings
0
Aliphatic rings
3
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.2
Molar refractivity
114.25

Supplementary Information

Details werden geladen…

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