N#Cc1cc(F)cc(-c2ccc3c(c2)C2(CCCCC2)C(=NO)N3)c1
SMILES: N#Cc1cc(F)cc(-c2ccc3c(c2)C2(CCCCC2)C(=NO)N3)c1

Molecular Processing

Molecular formula
C20H18FN3O
Molecular weight
335.38
Exact mass
335.1434
XLogP
4.78
TPSA
68.41
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
25
Rings
4
Aromatic rings
2
Saturated rings
1
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.3
Molar refractivity
94.16

Supplementary Information

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