Molecule

ID:90207

General Information
Structure
MolImage
Molecular Formula
C₁₀H₁₂Cr₂N₂O₇
Molecular Mass
376.20368
Exact Mass
375.94546573
Charge
0
InChI
InChI=1S/2C5H5N.2Cr.7O/c2*1-2-4-6-5-3-1;;;;;;;;;/h2*1-5H;;;;;;;;;/q;;;;;;;;;2*-1/p+2
InChIKey
LMYWWPCAXXPJFF-UHFFFAOYSA-P
Canonic Smiles
c1ccc[nH+]c1.c1ccc[nH+]c1.[O-][Cr](=O)(=O)O[Cr](=O)(=O)[O-]
Isomeric Smiles
O([Cr](=O)(=O)[O-])[Cr](=O)(=O)[O-].[nH+]1ccccc1.[nH+]1ccccc1
Calculated Properties
JChem
LogD (pH = 7.4)
-8.23
LogD (pH = 5.5)
-8.23
Log P
-3.71
Rotatable Bonds
2
H Donor
0
H Acceptors
6
Lipinski's Rule of Five
true
Acid pKa
-2.30
Polar Surface Area
123.63
Polarizability
11.07
Molar Refractivity
10.01
LOG S
0.04
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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