Molecule

ID:19961

General Information
Structure
MolImage
Molecular Formula
C₈H₁₀FNO
Molecular Mass
155.1695032
Exact Mass
155.07464217
Charge
0
InChI
InChI=1S/C8H10FNO/c1-2-11-8-4-3-6(9)5-7(8)10/h3-5H,2,10H2,1H3
InChIKey
BVOCAMLPFHWHEV-UHFFFAOYSA-N
Canonic Smiles
CCOc1ccc(cc1N)F
Isomeric Smiles
c1(cc(ccc1OCC)F)N
Calculated Properties
JChem
H Acceptors
2
H Donor
1
LogD (pH = 5.5)
1.4840441
LogD (pH = 7.4)
1.4861318
Log P
1.4861585
Molar Refractivity
42.1866
Polarizability
15.507796
Polar Surface Area
35.25
Rotatable Bonds
2
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
No Data Available
Click here to submit data
Molecular Spectra
No Data Available
Click here to submit data
Molecule Details
暂无数据
点击上传数据
References
Bioactivity
Navigation