SMILES:
COC(=O)NC(C(=O)N1CCCC1c1ncc(-c2ccc(-c3ccc(-c4cnc(C5CC6(CCC6)ON5C(=O)C(NC(=O)OC)C(C)C)[nH]4)cc3)cc2)[nH]1)C(C)CMolecular Processing
Molecular formula
C42H52N8O7
Molecular weight
780.93
Exact mass
780.3959
XLogP
6.69
TPSA
183.87
H-bond donors
4
H-bond acceptors
9
Rotatable bonds
11
Heavy atoms
57
Rings
7
Aromatic rings
4
Saturated rings
3
Aliphatic rings
3
Stereo centers
4
Undefined stereo
4
Formal charge
0
Heteroatoms
15
Covalent units
1
Fraction Csp3
0.476
Molar refractivity
210.93
Supplementary Information
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