Molecule

ID:134508

General Information
Structure
MolImage
Molecular Formula
C₁₈H₂₈P₂
Molecular Mass
306.362442
Exact Mass
306.16662416
Charge
0
InChI
InChI=1S/C18H28P2/c1-13-9-10-14(2)19(13)17-7-5-6-8-18(17)20-15(3)11-12-16(20)4/h5-8,13-16H,9-12H2,1-4H3/t13-,14-,15-,16-/m0/s1
InChIKey
AJNZWRKTWQLAJK-VGWMRTNUSA-N
Canonic Smiles
C[C@H]1CC[C@@H](P1c1ccccc1P1[C@@H](C)CC[C@@H]1C)C
Isomeric Smiles
C[C@H]1CC[C@@H](P1c1ccccc1P1[C@H](CC[C@@H]1C)C)C
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
3.9944432
LogD (pH = 7.4)
4.1683583
Log P
4.1734
Molar Refractivity
90.6378
Polarizability
36.440712
Polar Surface Area
0.0
Rotatable Bonds
2
Lipinski's Rule of Five
true
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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