Molecule

ID:111583

General Information
Structure
MolImage
Molecular Formula
B₂O₆Zn₃
Molecular Mass
313.7584
Exact Mass
309.77552452
Charge
0
InChI
InChI=1S/2BO3.3Zn/c2*2-1(3)4;;;/q2*-3;3*+2
InChIKey
BIKXLKXABVUSMH-UHFFFAOYSA-N
Canonic Smiles
[O-]B([O-])[O-].[O-]B([O-])[O-].[Zn+2].[Zn+2].[Zn+2]
Isomeric Smiles
[Zn+2].[Zn+2].[Zn+2].[O-]B([O-])[O-].[O-]B([O-])[O-]
Calculated Properties
JChem
Acid pKa
8.698678
H Acceptors
3
H Donor
0
LogD (pH = 5.5)
-0.5088733
LogD (pH = 7.4)
-0.52978307
Log P
-0.5086
Molar Refractivity
4.3287
Polarizability
3.917734
Polar Surface Area
69.18
Rotatable Bonds
0
Lipinski's Rule of Five
true
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