SMILES:
COCCOCOc1cc(NCc2ccc(F)cc2)ccc1C#NMolecular Processing
Molecular formula
C18H19FN2O3
Molecular weight
330.36
Exact mass
330.138
XLogP
3.31
TPSA
63.51
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
9
Heavy atoms
24
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.278
Molar refractivity
88.21
Supplementary Information
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