SMILES:
COC(=O)NC(C(=O)N1CCCC1c1ncc(-c2ccc3c(c2)C(F)(F)c2cc(-c4ccc5nc(C6C7CCC(C7)N6C(=O)C(NC(=O)OC)C(C)C)[nH]c5c4)ccc2-3)[nH]1)C(C)CMolecular Processing
Molecular formula
C47H52F2N8O6
Molecular weight
862.98
Exact mass
862.3978
XLogP
8.22
TPSA
174.64
H-bond donors
4
H-bond acceptors
8
Rotatable bonds
10
Heavy atoms
63
Rings
9
Aromatic rings
5
Saturated rings
3
Aliphatic rings
4
Stereo centers
6
Undefined stereo
6
Formal charge
0
Heteroatoms
16
Covalent units
1
Fraction Csp3
0.447
Molar refractivity
230.28
Supplementary Information
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