Molecule

ID:3337

General Information

Structure

Molecular Formula

ClFe₂O

Molecular Mass

163.1424

Exact Mass

162.8336423

Charge

0

InChI

InChI=1S/ClH.2Fe.O/h1H;;;/q;;+1;/p-1

InChIKey

KBTPJIQAZMMQJH-UHFFFAOYSA-M

Canonic Smiles

Cl[Fe]O[Fe]

Isomeric Smiles

Cl[Fe]O[Fe]

Calculated Properties

JChem

H Acceptors

1

H Donor

0

LogD (pH = 5.5)

1.7057

LogD (pH = 7.4)

1.7057

Log P

1.7057

Molar Refractivity

7.4865

Polarizability

9.623604

Polar Surface Area

9.23

Rotatable Bonds

1

Lipinski's Rule of Five

true

Data Source

Names and Identifiers

Registration numbers

Properties

No Data Available

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Related Proteins

No Data Available

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Molecular Spectra

No Data Available

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Molecule Details

References

Bioactivity