Molecule

ID:11347

General Information
Structure
MolImage
Molecular Formula
C₁₄H₂₄N₄O
Molecular Mass
264.36656
Exact Mass
264.19501141
Charge
0
InChI
InChI=1S/C14H24N4O/c1-18(2)11-5-9-15-8-4-10-17-14(19)13-6-3-7-16-12-13/h3,6-7,12,15H,4-5,8-11H2,1-2H3,(H,17,19)
InChIKey
KPPFAKOQSQNCLH-UHFFFAOYSA-N
Canonic Smiles
CN(CCCNCCCNC(=O)c1cccnc1)C
Isomeric Smiles
C(=O)(c1cnccc1)NCCCNCCCN(C)C
Calculated Properties
JChem
Acid pKa
13.847164
H Acceptors
4
H Donor
2
LogD (pH = 5.5)
-6.140481
LogD (pH = 7.4)
-3.9805605
Log P
-0.39594966
Molar Refractivity
78.3505
Polarizability
30.048018
Polar Surface Area
57.26
Rotatable Bonds
9
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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