Molecule

ID:130004

General Information
Structure
MolImage
Molecular Formula
C₃H₉N
Molecular Mass
59.11026
Exact Mass
59.07349929
Charge
0
InChI
InChI=1S/C3H9N/c1-4(2)3/h1-3H3
InChIKey
GETQZCLCWQTVFV-UHFFFAOYSA-N
Canonic Smiles
CN(C)C
Isomeric Smiles
CN(C)C
Calculated Properties
JChem
LogD (pH = 7.4)
-1.97
LogD (pH = 5.5)
-3.21
Log P
0.19
Rotatable Bonds
0
H Donor
0
H Acceptors
1
Lipinski's Rule of Five
true
Acid pKa
9.57
Polar Surface Area
3.24
Polarizability
7.64
Molar Refractivity
19.99
LOG S
0.90
Data Source
Loading...
Names and Identifiers
Loading...
Registration numbers
Loading...
Properties
Loading...
Related Proteins
Loading...
Molecular Spectra
No Data Available
Click here to submit data
Molecule Details
Loading...
References
Loading...
Bioactivity
Loading...