Molecule

ID:24304

General Information
Structure
MolImage
Molecular Formula
C₁₄H₂₄N₄O
Molecular Mass
264.36656
Exact Mass
264.19501141
Charge
0
InChI
InChI=1S/C14H24N4O/c1-3-18(4-2)13-7-5-12(6-8-13)11-16-10-9-14(19)17-15/h5-8,16H,3-4,9-11,15H2,1-2H3,(H,17,19)
InChIKey
PVRFIPCDMGGGKE-UHFFFAOYSA-N
Canonic Smiles
CCN(c1ccc(cc1)CNCCC(=O)NN)CC
Isomeric Smiles
C(=O)(CCNCc1ccc(N(CC)CC)cc1)NN
Calculated Properties
JChem
Acid pKa
13.012441
H Acceptors
4
H Donor
3
LogD (pH = 5.5)
-2.3720956
LogD (pH = 7.4)
-0.80712664
Log P
0.9648321
Molar Refractivity
80.3221
Polarizability
30.359657
Polar Surface Area
70.39
Rotatable Bonds
8
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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