SMILES:
COc1ccc2c(c1)c(-c1cccc(F)c1)c(C#N)c(=O)n2CC(O)COMolecular Processing
Molecular formula
C20H17FN2O4
Molecular weight
368.36
Exact mass
368.1172
XLogP
2.04
TPSA
95.48
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
27
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.2
Molar refractivity
97.96
Supplementary Information
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