SMILES:
CC(C)c1nc(-c2ccncc2)c(-c2ccc(F)cc2)n1C=CCOMolecular Processing
Molecular formula
C20H20FN3O
Molecular weight
337.4
Exact mass
337.159
XLogP
4.34
TPSA
50.94
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
5
Heavy atoms
25
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.2
Molar refractivity
97.36
Supplementary Information
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