Molecule

ID:87058

General Information
Structure
MolImage
Molecular Formula
Cl₆N₃P₃
Molecular Mass
347.659383
Exact Mass
344.74362299
Charge
0
InChI
InChI=1S/Cl6N3P3/c1-10(2)7-11(3,4)9-12(5,6)8-10
InChIKey
UBIJTWDKTYCPMQ-UHFFFAOYSA-N
Canonic Smiles
ClP1(=NP(=NP(=N1)(Cl)Cl)(Cl)Cl)Cl
Isomeric Smiles
P1(=NP(=NP(=N1)(Cl)Cl)(Cl)Cl)(Cl)Cl
Calculated Properties
JChem
H Acceptors
3
H Donor
0
LogD (pH = 5.5)
2.1707022
LogD (pH = 7.4)
2.170703
Log P
2.170703
Molar Refractivity
67.506
Polarizability
23.950027
Polar Surface Area
37.08
Rotatable Bonds
0
Lipinski's Rule of Five
true
Data Source
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Names and Identifiers
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Registration numbers
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Properties
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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
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Bioactivity
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