SMILES:
CCCN(CCC)C(=O)c1cc(C(=O)N[C@@H](Cc2cc(F)cc(F)c2)[C@H](O)CNCc2cccc(CC)c2)cc(-c2noc(C)n2)c1.ClMolecular Processing
Molecular formula
C36H44ClF2N5O4
Molecular weight
684.23
Exact mass
683.305
XLogP
6.06
TPSA
120.59
H-bond donors
3
H-bond acceptors
7
Rotatable bonds
16
Heavy atoms
48
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
12
Covalent units
2
Fraction Csp3
0.389
Molar refractivity
183.05
Supplementary Information
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