Cc1ccc(C(=O)N(CC(CCCNC(=O)OCc2ccccc2)NC(=O)OC(C)(C)C)C(c2nc3cc(Cl)ccc3c(=O)n2Cc2ccccc2)C(C)C)cc1
SMILES: Cc1ccc(C(=O)N(CC(CCCNC(=O)OCc2ccccc2)NC(=O)OC(C)(C)C)C(c2nc3cc(Cl)ccc3c(=O)n2Cc2ccccc2)C(C)C)cc1

Molecular Processing

Molecular formula
C45H52ClN5O6
Molecular weight
794.39
Exact mass
793.3606
XLogP
8.85
TPSA
131.86
H-bond donors
2
H-bond acceptors
7
Rotatable bonds
15
Heavy atoms
57
Rings
5
Aromatic rings
5
Saturated rings
0
Aliphatic rings
0
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.356
Molar refractivity
223.37

Supplementary Information

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