Molecule

ID:135283

General Information
Structure
MolImage
Molecular Formula
C₂H₇NO
Molecular Mass
62.0764889
Exact Mass
62.04979874
Charge
0
InChI
InChI=1S/C2H7NO/c3-1-2-4/h4H,1-3H2/i3+1
InChIKey
HZAXFHJVJLSVMW-LBPDFUHNSA-N
Canonic Smiles
[15NH2]CCO
Isomeric Smiles
C(CO)[15NH2]
Calculated Properties
JChem
Acid pKa
15.610099
H Acceptors
2
H Donor
2
LogD (pH = 5.5)
-4.3092356
LogD (pH = 7.4)
-3.4192636
Log P
-1.3155609
Molar Refractivity
16.2111
Polarizability
6.5665693
Polar Surface Area
46.25
Rotatable Bonds
1
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
References
Bioactivity
Navigation