SMILES:
Cc1ccc(-c2cc(C(=O)O)cc(-n3nnnc3C(F)(F)F)c2)cc1Molecular Processing
Molecular formula
C16H11F3N4O2
Molecular weight
348.28
Exact mass
348.0834
XLogP
3.35
TPSA
80.9
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
25
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.125
Molar refractivity
81.29
Supplementary Information
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