CC(CC(O)C(Cc1ccccc1)NC(=O)c1cc(O)cc(N2CCCC2=O)c1)C(=O)NCCC(C)(C)C
SMILES: CC(CC(O)C(Cc1ccccc1)NC(=O)c1cc(O)cc(N2CCCC2=O)c1)C(=O)NCCC(C)(C)C

Molecular Processing

Molecular formula
C30H41N3O5
Molecular weight
523.67
Exact mass
523.3046
XLogP
3.8
TPSA
118.97
H-bond donors
4
H-bond acceptors
5
Rotatable bonds
11
Heavy atoms
38
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
3
Undefined stereo
3
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
147.96

Supplementary Information

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