CC(CO)(C(=O)O)c1ccc(C(O)CCCN2CCC(C(O)(c3ccccc3)c3ccccc3)CC2)cc1
SMILES: CC(CO)(C(=O)O)c1ccc(C(O)CCCN2CCC(C(O)(c3ccccc3)c3ccccc3)CC2)cc1

Molecular Processing

Molecular formula
C32H39NO5
Molecular weight
517.67
Exact mass
517.2828
XLogP
4.48
TPSA
101.23
H-bond donors
4
H-bond acceptors
5
Rotatable bonds
11
Heavy atoms
38
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.406
Molar refractivity
147.76

Supplementary Information

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