SMILES:
COC(=O)NC(C(=O)N1OC2(CCC2)CC1c1ncc(-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
C44H54N8O8
Molecular weight
822.96
Exact mass
822.4065
XLogP
7.15
TPSA
193.1
H-bond donors
4
H-bond acceptors
10
Rotatable bonds
11
Heavy atoms
60
Rings
8
Aromatic rings
4
Saturated rings
4
Aliphatic rings
4
Stereo centers
4
Undefined stereo
4
Formal charge
0
Heteroatoms
16
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
219.12
Supplementary Information
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