Molecule

ID:105132

General Information
Structure
MolImage
Molecular Formula
C₆H₁₀O₅
Molecular Mass
162.1406
Exact Mass
162.05282342
Charge
0
InChI
InChI=1S/C6H10O5/c7-1-2(8)4(10)6-5(11-6)3(1)9/h1-10H
InChIKey
ZHMWOVGZCINIHW-UHFFFAOYSA-N
Canonic Smiles
OC1C(O)C(O)C2C(C1O)O2
Isomeric Smiles
OC1C(O)C(O)C2OC2C1O
Calculated Properties
JChem
LogD (pH = 7.4)
-2.62
LogD (pH = 5.5)
-2.62
Log P
-2.62
Rotatable Bonds
0
H Donor
4
H Acceptors
5
Lipinski's Rule of Five
true
Acid pKa
12.46
Polar Surface Area
93.45
Polarizability
14.35
Molar Refractivity
32.26
LOG S
-0.19
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
No Data Available
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Molecular Spectra
No Data Available
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Molecule Details
References
Bioactivity
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