Molecule

ID:70534

General Information
Structure
MolImage
Molecular Formula
C₈H₂₀Cl₂N₆
Molecular Mass
271.1906
Exact Mass
270.11265003
Charge
0
InChI
InChI=1S/C8H18N6.2ClH/c1-7(2,5(9)10)13-14-8(3,4)6(11)12;;/h1-4H3,(H3,9,10)(H3,11,12);2*1H/b14-13+;;
InChIKey
LXEKPEMOWBOYRF-QDBORUFSSA-N
Canonic Smiles
NC(=N)C(/N=N/C(C(=N)N)(C)C)(C)C.Cl.Cl
Isomeric Smiles
N(=N\C(C(=N)N)(C)C)/C(C(=N)N)(C)C.Cl.Cl
Calculated Properties
JChem
H Acceptors
6
H Donor
4
LogD (pH = 5.5)
-5.13614
LogD (pH = 7.4)
-4.4146075
Log P
-0.31975856
Molar Refractivity
76.2096
Polarizability
20.9088
Polar Surface Area
124.46
Rotatable Bonds
4
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
No Data Available
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Molecular Spectra
No Data Available
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Molecule Details
References
Bioactivity
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