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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL1427
CHEMBL1427
Compound Name HYPOXANTHINE
ChEMBL Synonyms Hypoxanthine | SID26749634
Max Phase 0
Trade Names
Molecular Formula C5H4N4O

Additional synonyms for CHEMBL1427 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES O=C1NC=Nc2nc[nH]c12
Standard InChI InChI=1S/C5H4N4O/c10-5-3-4(7-1-6-3)8-2-9-5/h1-2H,(H2,6,7,8,9 ...
Download InChI
Standard InChI Key FDGQSTZJBFJUBT-UHFFFAOYSA-N

Clinical Trials for Compound

Number of clinical trials registered at clinicaltrials.gov

Alternate Forms of Compound in ChEMBL


CHEMBL1427

Compound Bioactivity Summary

Compound Assay Summary

Compound Target Summary

Calculated Compound Parent Properties

Mol. Weight Mol. Weight Monoisotopic ALogP #Ro5 Violations #Rotatable Bonds Ro3 Med Chem Friendly Molecular Species
136.1 136.0385 -0.53 0 0 No Yes NEUTRAL


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms Num Alerts QED Weighted
8.9 2.2 -1.11 -1.11 1 10 0 0.5

Compound Cross References

ChemSpider ChemSpider:FDGQSTZJBFJUBT-UHFFFAOYSA-N
PubChem SID: 26749634
Wikipedia Hypoxanthine

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL1427



PDBe HPA
KEGG Ligand C00262
ChEBI 17368
ZINC ZINC18153302
eMolecules 538926 975947 5851666 711446 522216
IBM Patent System 15AFB0FDC28C4A5225B01C8C1D97D20E
Patent EP0552178B1 US5529920 EP0269947A1 EP0739900A2 US5914396 EP0626387A1 EP0236935A2 EP0977033A3 EP0481791A3 US5962221 EP0668361A1 US6074818 EP0743574B1 EP0617107A1 US5738993 WO1995035300A1 EP0612994A3 EP0428109A3 EP0306845A2 EP0519463A1 WO1996019478A1 EP0840741A1 EP0689430A1 EP0412995A1 US5817799 EP0594578B1 WO1997003210A1 WO1996006620A2 US6140491 EP0256932B1 US5208221 US5177198 US5643893 EP0799834A1 WO1998030900A2 US6156501 US5696263 US5122469 EP0957926A1 EP0542790B1 EP0307186B1 US4999428 EP1061085A2 EP0365556B1 EP0717748A1 WO2000027201A1 WO1997030064A1 US5128458 US4845215 EP0383922B1 WO1995008994A1 WO1999000114A2 EP0334250A2 EP0906329A2 EP0646596A1 EP0673783B1 WO1998046785A1 EP0524997A1 EP0920490A2 US4677071 US4657866 WO1998004681A2 WO1993008296A1 US4816401 US5750343 US4931431 US5631259 WO1997018325A1 US5969116 US5474931 US4757094 WO2000058329A1 WO1992022637A1 EP0533825A1 US5438130 US4341868 US4687733 US5292725 EP0567577A1 US6036969 EP0653438A3 EP0137657A2 EP0673783A3 WO1994021822A1 US5466793 WO1998030563A1 WO2000008042A1 US5817812 EP0866865A1 US5063157 WO1996013498A2 WO1988002258A1 WO1993007157A1 US6060463 EP0702556A1 EP0999218A1 EP0256932A2 EP0888545A1 US4880783 US6153582
FDA SRS 2TN51YD919
SureChem SureCN446722
Human Metabolome Database HMDB00157
Selleck hypoxanthine
PubChem: Thomson Pharma 16142119 15016626 16769078 14747719 99311624
PubChem 790
Mcule MCULE-8326019285
NMRShiftDB 20096821 20181822 10016330

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