SMILES:
Cc1nc2c(OCC3CCCCC3)cccn2c1C(=O)N[C@@H](CC(=O)O)c1ccccc1FMolecular Processing
Molecular formula
C25H28FN3O4
Molecular weight
453.51
Exact mass
453.2064
XLogP
4.69
TPSA
92.93
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
8
Heavy atoms
33
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.4
Molar refractivity
120.86
Supplementary Information
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