Cc1c(Cc2ccc(OC(C)C)cc2)c(OC2OC(CO)C(O)C(O)C2O)nn1CC1CC1
SMILES: Cc1c(Cc2ccc(OC(C)C)cc2)c(OC2OC(CO)C(O)C(O)C2O)nn1CC1CC1

Molecular Processing

Molecular formula
C24H34N2O7
Molecular weight
462.54
Exact mass
462.2366
XLogP
1.16
TPSA
126.43
H-bond donors
4
H-bond acceptors
8
Rotatable bonds
9
Heavy atoms
33
Rings
4
Aromatic rings
2
Saturated rings
2
Aliphatic rings
2
Stereo centers
5
Undefined stereo
5
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.625
Molar refractivity
119.1

Supplementary Information

Details werden geladen…

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