COC(=O)NC(C(=O)N1CCCC1CNC(=O)c1ccc(-c2ccc(-c3cnc(C4CCCN4C(=O)C(NC(=O)OC)C(C)C)[nH]3)cc2)cc1)C(C)C
SMILES: COC(=O)NC(C(=O)N1CCCC1CNC(=O)c1ccc(-c2ccc(-c3cnc(C4CCCN4C(=O)C(NC(=O)OC)C(C)C)[nH]3)cc2)cc1)C(C)C

Molecular Processing

Molecular formula
C39H51N7O7
Molecular weight
729.88
Exact mass
729.385
XLogP
4.89
TPSA
175.06
H-bond donors
4
H-bond acceptors
8
Rotatable bonds
12
Heavy atoms
53
Rings
5
Aromatic rings
3
Saturated rings
2
Aliphatic rings
2
Stereo centers
4
Undefined stereo
4
Formal charge
0
Heteroatoms
14
Covalent units
1
Fraction Csp3
0.487
Molar refractivity
198.55

Supplementary Information

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