SMILES:
O=C1CCn2nc(-c3ccc(F)cc3)c(-c3ccncc3)c2N1Molecular Processing
Molecular formula
C17H13FN4O
Molecular weight
308.32
Exact mass
308.1073
XLogP
3.09
TPSA
59.81
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
23
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.118
Molar refractivity
84.1
Supplementary Information
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