Molecule

ID:82998

General Information
Structure
MolImage
Molecular Formula
C₂₄H₁₉ClNP
Molecular Mass
387.841121
Exact Mass
387.09436392
Charge
0
InChI
InChI=1S/C24H19ClNP/c25-20-16-18-21(19-17-20)26-27(22-10-4-1-5-11-22,23-12-6-2-7-13-23)24-14-8-3-9-15-24/h1-19H
InChIKey
FQCORUUEGHMUJZ-UHFFFAOYSA-N
Canonic Smiles
Clc1ccc(cc1)N=P(c1ccccc1)(c1ccccc1)c1ccccc1
Isomeric Smiles
P(=Nc1ccc(cc1)Cl)(c1ccccc1)(c1ccccc1)c1ccccc1
Calculated Properties
JChem
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
7.7987566
LogD (pH = 7.4)
7.798898
Log P
7.7989
Molar Refractivity
116.6162
Polarizability
44.88951
Polar Surface Area
12.36
Rotatable Bonds
4
Lipinski's Rule of Five
false
Data Source
Names and Identifiers
Registration numbers
Properties
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Related Proteins
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Molecular Spectra
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Molecule Details
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References
Bioactivity
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