Cc1cc(F)c2[nH]c(=O)n(C3CCN(C4CCOCC4)CC3)c2c1.O=C(O)CC(O)(CC(=O)O)C(=O)O
SMILES: Cc1cc(F)c2[nH]c(=O)n(C3CCN(C4CCOCC4)CC3)c2c1.O=C(O)CC(O)(CC(=O)O)C(=O)O

Molecular Processing

Molecular formula
C24H32FN3O9
Molecular weight
525.53
Exact mass
525.2123
XLogP
1.34
TPSA
182.39
H-bond donors
5
H-bond acceptors
7
Rotatable bonds
7
Heavy atoms
37
Rings
4
Aromatic rings
2
Saturated rings
2
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
13
Covalent units
2
Fraction Csp3
0.583
Molar refractivity
128.03

Supplementary Information

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