SMILES:
O=C(O)c1ccc(Nc2ncc(F)c(Nc3ccc(C(=O)O)c(O)c3)n2)cc1OMolecular Processing
Molecular formula
C18H13FN4O6
Molecular weight
400.32
Exact mass
400.0819
XLogP
2.91
TPSA
164.9
H-bond donors
6
H-bond acceptors
8
Rotatable bonds
6
Heavy atoms
29
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0
Molar refractivity
98.69
Supplementary Information
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