SMILES:
N#Cc1ncn2c1C1CCN1C(=O)c1c-2cccc1C(F)(F)FMolecular Processing
Molecular formula
C15H9F3N4O
Molecular weight
318.26
Exact mass
318.0728
XLogP
2.66
TPSA
61.92
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
0
Heavy atoms
23
Rings
4
Aromatic rings
2
Saturated rings
1
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.267
Molar refractivity
71.68
Supplementary Information
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