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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL73394
CHEMBL73394
Compound Name
ChEMBL Synonyms
Max Phase 0
Trade Names
Molecular Formula C27H26P2

Additional synonyms for CHEMBL73394 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES C(CP(c1ccccc1)c2ccccc2)CP(c3ccccc3)c4ccccc4
Standard InChI InChI=1S/C27H26P2/c1-5-14-24(15-6-1)28(25-16-7-2-8-17-25)22- ...
Download InChI
Standard InChI Key LVEYOSJUKRVCCF-UHFFFAOYSA-N

Sources

  • Scientific Literature

Alternate Forms of Compound in ChEMBL


CHEMBL73394

Compound Bioactivity Summary

Compound Assay Summary

Compound Target Summary

Calculated Compound Parent Properties

Mol. Weight Mol. Weight Monoisotopic ALogP #Rotatable Bonds Polar Surface Area Molecular Species
412.4 412.151 8.14 8 27.18 -


HBA HBD #Ro5 Violations HBA (Lipinski) HBD (Lipinski) #Ro5 Violations (Lipinski)
2 0 1 0 0 1


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
- - 6.98 6.98 4 29 0.27

Structural Alerts

There are 3 structural alerts for CHEMBL73394. To view alerts please click here.

Compound Cross References

ChemSpider ChemSpider:LVEYOSJUKRVCCF-UHFFFAOYSA-N
Wikipedia 1,3-Bis(diphenylphosphino)propane

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL73394



ACToR 6737-42-4
eMolecules 482348
EPA CompTox Dashboard DTXSID0064464
FDA SRS 44R56E2C68
IBM Patent System 68F96F1D3D41779CF7841E0E4700A0FB
MolPort MolPort-003-663-632
Nikkaji J208.099K
PubChem 81219
PubChem: Thomson Pharma 14806468
SureChEMBL SCHEMBL35092
ZINC ZINC000001539577

UniChem REST Service Call:
https://www.ebi.ac.uk/unichem/rest/verbose_inchikey/LVEYOSJUKRVCCF-UHFFFAOYSA-N spacer
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