Molecule

ID:12200

General Information
Structure
MolImage
Molecular Formula
C₄H₈Cl₂N₂
Molecular Mass
155.02572
Exact Mass
154.00645363
Charge
0
InChI
InChI=1S/C4H7ClN2.ClH/c5-3-4-6-1-2-7-4;/h1-3H2,(H,6,7);1H
InChIKey
GHCCHMFFNHOXEU-UHFFFAOYSA-N
Canonic Smiles
ClCC1=NCCN1.Cl
Isomeric Smiles
Cl.C1N=C(NC1)CCl
Calculated Properties
JChem
H Acceptors
2
H Donor
1
LogD (pH = 5.5)
-2.295228
LogD (pH = 7.4)
-0.87205696
Log P
-0.09335582
Molar Refractivity
29.1006
Polarizability
11.108542
Polar Surface Area
24.39
Rotatable Bonds
1
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
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Molecular Spectra
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Molecule Details
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References
Bioactivity
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