Molecule

ID:108170

General Information
Structure
MolImage
Molecular Formula
C₂₇H₂₆P₂
Molecular Mass
412.442862
Exact Mass
412.15097409
Charge
0
InChI
InChI=1S/C27H26P2/c1-23(29(26-18-10-4-11-19-26)27-20-12-5-13-21-27)22-28(24-14-6-2-7-15-24)25-16-8-3-9-17-25/h2-21,23H,22H2,1H3/t23-/m1/s1
InChIKey
WGOBPPNNYVSJTE-HSZRJFAPSA-N
Canonic Smiles
C[C@@H](P(c1ccccc1)c1ccccc1)CP(c1ccccc1)c1ccccc1
Isomeric Smiles
C[C@H](CP(c1ccccc1)c1ccccc1)P(c1ccccc1)c1ccccc1
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
7.1907
LogD (pH = 7.4)
7.1907
Log P
7.1907
Molar Refractivity
126.2238
Polarizability
50.21126
Polar Surface Area
0.0
Rotatable Bonds
7
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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