COc1ccc(CCCC(=O)N[C@@H](CN2CCOCC2)[C@@H](O)c2ccccc2)cc1
SMILES: COc1ccc(CCCC(=O)N[C@@H](CN2CCOCC2)[C@@H](O)c2ccccc2)cc1

Molecular Processing

Molecular formula
C24H32N2O4
Molecular weight
412.53
Exact mass
412.2362
XLogP
2.57
TPSA
71.03
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
10
Heavy atoms
30
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.458
Molar refractivity
116.52

Supplementary Information

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