Molecule

ID:129427

General Information
Structure
MolImage
Molecular Formula
C₇H₁₅O₁₀P
Molecular Mass
290.161761
Exact Mass
290.04028331
Charge
0
InChI
InChI=1S/C7H15O10P/c8-1-3(9)5(11)7(13)6(12)4(10)2-17-18(14,15)16/h4-8,10-13H,1-2H2,(H2,14,15,16)/t4-,5-,6-,7+/m1/s1
InChIKey
JDTUMPKOJBQPKX-GBNDHIKLSA-N
Canonic Smiles
OCC(=O)[C@H]([C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O)O
Isomeric Smiles
O=P(O)(OC[C@@H](O)[C@@H](O)[C@@H](O)[C@H](O)C(=O)CO)O
Calculated Properties
JChem
LogD (pH = 7.4)
-7.32
LogD (pH = 5.5)
-6.43
Log P
-4.02
Rotatable Bonds
8
H Donor
7
H Acceptors
9
Lipinski's Rule of Five
false
Acid pKa
1.49
Polar Surface Area
184.98
Polarizability
23.91
Molar Refractivity
54.40
LOG S
1.43
Data Source
Names and Identifiers
Registration numbers
Properties
No Data Available
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Related Proteins
Molecular Spectra
No Data Available
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Molecule Details
References
Bioactivity
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