Molecule

ID:64430

General Information
Structure
MolImage
Molecular Formula
C₄H₂Cl₂N₂
Molecular Mass
148.97808
Exact Mass
147.95950343
Charge
0
InChI
InChI=1S/C4H2Cl2N2/c5-3-1-2-4(6)8-7-3/h1-2H
InChIKey
GUSWJGOYDXFJSI-UHFFFAOYSA-N
Canonic Smiles
Clc1ccc(nn1)Cl
Isomeric Smiles
n1nc(Cl)ccc1Cl
Calculated Properties
JChem
H Acceptors
2
H Donor
0
LogD (pH = 5.5)
1.4242471
LogD (pH = 7.4)
1.4242471
Log P
1.4242471
Molar Refractivity
35.4966
Polarizability
12.56423
Polar Surface Area
25.78
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