SMILES:
Cc1cc(C#Cc2cn(/C=C/F)c(C)n2)ccn1Molecular Processing
Molecular formula
C14H12FN3
Molecular weight
241.27
Exact mass
241.1015
XLogP
2.69
TPSA
30.71
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
18
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.143
Molar refractivity
68.36
Supplementary Information
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