SMILES:
C=CCn1c(=O)c(C#N)c(-c2cccc(F)c2)c2cc(OC)ccc21Molecular Processing
Molecular formula
C20H15FN2O2
Molecular weight
334.35
Exact mass
334.1118
XLogP
3.87
TPSA
55.02
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
4
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
0.1
Molar refractivity
95.07
Supplementary Information
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