COC(=O)NC(C(=O)NCCCC[C@@H](COC(=O)[C@@H](N)C(C)C)N(CC(C)C)S(=O)(=O)c1ccc(N)cc1)C(c1ccccc1)c1ccccc1
SMILES: COC(=O)NC(C(=O)NCCCC[C@@H](COC(=O)[C@@H](N)C(C)C)N(CC(C)C)S(=O)(=O)c1ccc(N)cc1)C(c1ccccc1)c1ccccc1

Molecular Processing

Molecular formula
C38H53N5O7S
Molecular weight
723.94
Exact mass
723.3666
XLogP
4.65
TPSA
183.15
H-bond donors
4
H-bond acceptors
9
Rotatable bonds
19
Heavy atoms
51
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
3
Undefined stereo
1
Formal charge
0
Heteroatoms
13
Covalent units
1
Fraction Csp3
0.447
Molar refractivity
198.06

Supplementary Information

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