Molecule

ID:10387

General Information
Structure
MolImage
Molecular Formula
C₂₆H₃₆NP
Molecular Mass
393.544501
Exact Mass
393.25853679
Charge
0
InChI
InChI=1S/C26H36NP/c1-27(2)25-19-11-9-17-23(25)24-18-10-12-20-26(24)28(21-13-5-3-6-14-21)22-15-7-4-8-16-22/h9-12,17-22H,3-8,13-16H2,1-2H3
InChIKey
ZEMZPXWZVTUONV-UHFFFAOYSA-N
Canonic Smiles
CN(c1ccccc1c1ccccc1P(C1CCCCC1)C1CCCCC1)C
Isomeric Smiles
c1(c2c(cccc2)N(C)C)c(cccc1)P(C1CCCCC1)C1CCCCC1
Calculated Properties
JChem
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
6.4006815
LogD (pH = 7.4)
6.784601
Log P
7.0772
Molar Refractivity
123.5625
Polarizability
49.604805
Polar Surface Area
3.24
Rotatable Bonds
5
Lipinski's Rule of Five
false
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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