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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL119870
CHEMBL119870
Compound Name PHENAZINE
ChEMBL Synonyms Phenazine
Max Phase 0
Trade Names
Molecular Formula C12H8N2

Additional synonyms for CHEMBL119870 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES c1ccc2nc3ccccc3nc2c1
Standard InChI InChI=1S/C12H8N2/c1-2-6-10-9(5-1)13-11-7-3-4-8-12(11)14-10/h ...
Download InChI
Standard InChI Key PCNDJXKNXGMECE-UHFFFAOYSA-N

Sources

  • PubChem BioAssays
  • Scientific Literature

Alternate Forms of Compound in ChEMBL


CHEMBL119870

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
180.2 180.0687 3.06 0 25.78 NEUTRAL


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


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
- 1.6 2.84 2.84 3 14 0.5

Structural Alerts

There are 3 structural alerts for CHEMBL119870. To view alerts please click here.

Compound Cross References

ChemSpider ChemSpider:PCNDJXKNXGMECE-UHFFFAOYSA-N
PubChem SID: 17510352
Wikipedia Phenazine

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL119870



ACToR 92-82-0
BindingDB 50131720
Brenda 81738
ChEBI 36674
eMolecules 530451
EPA CompTox Dashboard DTXSID2059069
FDA SRS 2JHR6K463W
IBM Patent System BB016F2A54A14E5DBAA8B02CC1781303
Mcule MCULE-6191883056
MolPort MolPort-001-759-989
Nikkaji J10.604F
NMRShiftDB 10019208
PubChem 4757
PubChem: Thomson Pharma 15322076
Rhea 36674
SureChEMBL SCHEMBL9049
ZINC ZINC000008683005

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