Molecule

ID:24188

General Information
Structure
MolImage
Molecular Formula
C₁₁H₁₅FN₂
Molecular Mass
194.2486032
Exact Mass
194.12192671
Charge
0
InChI
InChI=1S/C11H15FN2/c12-11-4-2-1-3-10(11)9-14-7-5-13-6-8-14/h1-4,13H,5-9H2
InChIKey
IGVNZJBYRPULAI-UHFFFAOYSA-N
Canonic Smiles
Fc1ccccc1CN1CCNCC1
Isomeric Smiles
c1(CN2CCNCC2)c(cccc1)F
Calculated Properties
JChem
H Acceptors
2
H Donor
1
LogD (pH = 5.5)
-1.6119115
LogD (pH = 7.4)
-0.29329848
Log P
1.5214162
Molar Refractivity
55.5725
Polarizability
21.50402
Polar Surface Area
15.27
Rotatable Bonds
2
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
No Data Available
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Molecular Spectra
No Data Available
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Molecule Details
References
Bioactivity
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