Molecule

ID:123959

General Information

Structure

MolImage

Molecular Formula

CH₇N₅

Molecular Mass

89.09978

Exact Mass

89.07014525

Charge

0

InChI

InChI=1S/CH7N5/c2-1(5-3)6-4/h3-4H2,(H3,2,5,6)

InChIKey

JGGFDEJXWLAQKR-UHFFFAOYSA-N

Canonic Smiles

NNC(=N)NN

Isomeric Smiles

C(=N)(NN)NN

Calculated Properties

JChem

H Acceptors

5

H Donor

5

LogD (pH = 5.5)

-4.145295

LogD (pH = 7.4)

-4.1073804

Log P

-1.7001238

Molar Refractivity

55.8126

Polarizability

8.480645

Polar Surface Area

99.95

Rotatable Bonds

0

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

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References

Bioactivity