COc1ccc(C[C@H](NC(=O)[C@H](C)NC(=O)CN2CCC(O)CC2)C(=O)OCc2ccccc2)cc1
SMILES: COc1ccc(C[C@H](NC(=O)[C@H](C)NC(=O)CN2CCC(O)CC2)C(=O)OCc2ccccc2)cc1

Molecular Processing

Molecular formula
C27H35N3O6
Molecular weight
497.59
Exact mass
497.2526
XLogP
1.43
TPSA
117.2
H-bond donors
3
H-bond acceptors
7
Rotatable bonds
11
Heavy atoms
36
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.444
Molar refractivity
134.15

Supplementary Information

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