CCn1cnc2c(-c3ccc(F)cc3)cnnc21
Name: 7-ethyl-4-(4-fluorophenyl)-7H-imidazo[4,5-c]pyridazine
SMILES: CCn1cnc2c(-c3ccc(F)cc3)cnnc21

Molecular Processing

Molecular formula
C13H11FN4
Molecular weight
242.26
Exact mass
242.0968
XLogP
2.65
TPSA
43.6
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
18
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
0.154
Molar refractivity
66.39

Supplementary Information

Details werden geladen…

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