Molecule

ID:74963

General Information
Structure
MolImage
Molecular Formula
C₁₄H₁₉O₅P
Molecular Mass
298.271421
Exact Mass
298.09701034
Charge
0
InChI
InChI=1S/C14H19O5P/c1-4-18-20(15,19-5-2)10-11-9-17-14-8-12(16-3)6-7-13(11)14/h6-9H,4-5,10H2,1-3H3
InChIKey
MPYYRPNNCWYIBQ-UHFFFAOYSA-N
Canonic Smiles
CCOP(=O)(Cc1coc2c1ccc(c2)OC)OCC
Isomeric Smiles
o1c2c(ccc(c2)OC)c(c1)CP(=O)(OCC)OCC
Calculated Properties
JChem
H Acceptors
2
H Donor
0
LogD (pH = 5.5)
2.4188747
LogD (pH = 7.4)
2.4188747
Log P
2.4188747
Molar Refractivity
75.6805
Polarizability
31.101992
Polar Surface Area
57.9
Rotatable Bonds
7
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
No Data Available
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Related Proteins
No Data Available
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Molecular Spectra
No Data Available
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Molecule Details
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References
Bioactivity
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