Molecule

ID:15832

General Information
Structure
MolImage
Molecular Formula
C₁₅H₂₅N₃O
Molecular Mass
263.3785
Exact Mass
263.19976244
Charge
0
InChI
InChI=1S/C15H25N3O/c1-19-11-10-18-8-4-15(5-9-18)13-17-12-14-2-6-16-7-3-14/h2-3,6-7,15,17H,4-5,8-13H2,1H3
InChIKey
NNWYSXBEWWCPDJ-UHFFFAOYSA-N
Canonic Smiles
COCCN1CCC(CC1)CNCc1ccncc1
Isomeric Smiles
C1(CCN(CC1)CCOC)CNCc1ccncc1
Calculated Properties
JChem
H Acceptors
4
H Donor
1
LogD (pH = 5.5)
-5.7379966
LogD (pH = 7.4)
-3.3689442
Log P
0.7543536
Molar Refractivity
78.4617
Polarizability
30.866392
Polar Surface Area
37.39
Rotatable Bonds
7
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
暂无数据
点击上传数据
References
Bioactivity
Navigation