Molecule

ID:104694

General Information
Structure
MolImage
Molecular Formula
C₂₄H₂₀AsCl
Molecular Mass
418.7902
Exact Mass
418.04694932
Charge
0
InChI
InChI=1S/C24H20As.ClH/c1-5-13-21(14-6-1)25(22-15-7-2-8-16-22,23-17-9-3-10-18-23)24-19-11-4-12-20-24;/h1-20H;1H/q+1;/p-1
InChIKey
NRZGVGVFPHPXEO-UHFFFAOYSA-M
Canonic Smiles
c1ccc(cc1)[As+](c1ccccc1)(c1ccccc1)c1ccccc1.[Cl-]
Isomeric Smiles
[Cl-].c1ccc(cc1)[As+](c1ccccc1)(c1ccccc1)c1ccccc1
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
7.1588
LogD (pH = 7.4)
7.1588
Log P
7.1588
Molar Refractivity
101.8972
Polarizability
43.18009
Polar Surface Area
0.0
Rotatable Bonds
4
Lipinski's Rule of Five
false
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
No Data Available
Click here to submit data
Molecular Spectra
No Data Available
Click here to submit data
Molecule Details
References
Bioactivity
Navigation