COc1ccc2c(c1)N(CC(=O)C(C)(C)C)C(=O)C(NC(=O)Nc1cccc(C(=O)O)c1)CN2c1ccccc1
SMILES: COc1ccc2c(c1)N(CC(=O)C(C)(C)C)C(=O)C(NC(=O)Nc1cccc(C(=O)O)c1)CN2c1ccccc1

Molecular Processing

Molecular formula
C30H32N4O6
Molecular weight
544.61
Exact mass
544.2322
XLogP
4.68
TPSA
128.28
H-bond donors
3
H-bond acceptors
6
Rotatable bonds
7
Heavy atoms
40
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.267
Molar refractivity
152.6

Supplementary Information

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