Molecule

ID:126981

General Information
Structure
MolImage
Molecular Formula
C₈H₁₂Cl₂Pt
Molecular Mass
374.16488
Exact Mass
372.99639674
Charge
0
InChI
InChI=1S/C8H12.2ClH.Pt/c1-2-4-6-8-7-5-3-1;;;/h1-2,7-8H,3-6H2;2*1H;/q;;;+2/p-2
InChIKey
VVAOPCKKNIUEEU-UHFFFAOYSA-L
Canonic Smiles
C1CC=CCCC=C1.Cl[Pt]Cl
Isomeric Smiles
Cl[Pt]Cl.C1=CCCC=CCC1
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
2.832706
LogD (pH = 7.4)
2.832706
Log P
2.832706
Molar Refractivity
39.0412
Polarizability
14.319889
Polar Surface Area
0.0
Rotatable Bonds
0
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
No Data Available
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Molecular Spectra
No Data Available
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Molecule Details
References
Bioactivity
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