Molecule

ID:3302

General Information
Structure
MolImage
Molecular Formula
C₂H₆NO₅P
Molecular Mass
155.046501
Exact Mass
154.99835893
Charge
0
InChI
InChI=1S/C2H6NO5P/c4-2(3-5)1-9(6,7)8/h5H,1H2,(H,3,4)(H2,6,7,8)
InChIKey
LDKRAXXVBWHMRH-UHFFFAOYSA-N
Canonic Smiles
ONC(=O)CP(=O)(O)O
Isomeric Smiles
ONC(=O)CP(=O)(O)O
Calculated Properties
JChem
LogD (pH = 7.4)
-4.91
LogD (pH = 5.5)
-4.82
Log P
-2.52
Rotatable Bonds
2
H Donor
4
H Acceptors
5
Lipinski's Rule of Five
true
Acid pKa
1.66
Polar Surface Area
106.86
Polarizability
10.95
Molar Refractivity
27.22
LOG S
2.24
Data Source
Names and Identifiers
Registration numbers
Properties
No Data Available
Click here to submit data
Related Proteins
Molecular Spectra
No Data Available
Click here to submit data
Molecule Details
References
Bioactivity
Navigation