Molecule

ID:69896

General Information
Structure
Molecular Formula
C₅H₁₀O₅
Molecular Mass
150.1299
Exact Mass
150.05282342
Charge
0
InChI
InChI=1S/C5H10O5/c6-1-3(8)5(10)4(9)2-7/h1,3-5,7-10H,2H2/t3-,4+,5-/m0/s1
InChIKey
PYMYPHUHKUWMLA-LMVFSUKVSA-N
Canonic Smiles
OC[C@H]([C@H]([C@H](C=O)O)O)O
Isomeric Smiles
O=C[C@H](O)[C@H](O)[C@H](O)CO
Calculated Properties
JChem
Acid pKa
12.332793
H Acceptors
5
H Donor
4
LogD (pH = 5.5)
-2.9380257
LogD (pH = 7.4)
-2.9380307
Log P
-2.9380257
Molar Refractivity
31.3831
Polarizability
12.73608
Polar Surface Area
97.99
Rotatable Bonds
4
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