Molecule

ID:78685

General Information
Structure
MolImage
Molecular Formula
C₁₇H₁₀Cl₄O
Molecular Mass
372.0727
Exact Mass
369.94857566
Charge
0
InChI
InChI=1S/C17H10Cl4O/c18-14-7-3-11(9-16(14)20)1-5-13(22)6-2-12-4-8-15(19)17(21)10-12/h1-10H
InChIKey
PEIXSRCYWCYQCA-UHFFFAOYSA-N
Canonic Smiles
O=C(/C=C/c1ccc(c(c1)Cl)Cl)/C=C/c1ccc(c(c1)Cl)Cl
Isomeric Smiles
O=C(/C=C/c1cc(c(cc1)Cl)Cl)/C=C/c1cc(c(cc1)Cl)Cl
Calculated Properties
JChem
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
7.2413225
LogD (pH = 7.4)
7.2413225
Log P
7.2413225
Molar Refractivity
96.2464
Polarizability
36.41473
Polar Surface Area
17.07
Rotatable Bonds
4
Lipinski's Rule of Five
false
Data Source
Names and Identifiers
Registration numbers
Properties
No Data Available
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Related Proteins
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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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