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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL95606
CHEMBL95606
Compound Name CYTIDINE
ChEMBL Synonyms Cytidine | MMV638723
Max Phase 0
Trade Names
Molecular Formula C9H13N3O5

Additional synonyms for CHEMBL95606 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES NC1=NC(=O)N(C=C1)[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O
Standard InChI InChI=1S/C9H13N3O5/c10-5-1-2-12(9(16)11-5)8-7(15)6(14)4(3-13 ...
Download InChI
Standard InChI Key UHDGCWIWMRVCDJ-XVFCMESISA-N

Sources

  • MMV Malaria Box
  • PubChem BioAssays
  • Scientific Literature
  • St Jude Leishmania Screening

Alternate Forms of Compound in ChEMBL


CHEMBL95606

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
243.2 243.0855 -2.4 2 128.61 NEUTRAL


HBA HBD #Ro5 Violations HBA (Lipinski) HBD (Lipinski) #Ro5 Violations (Lipinski)
7 4 0 8 5 0


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
13.48 4.26 -1.81 -1.81 0 17 0.43

Structural Alerts

There are no structural alerts for CHEMBL95606

Compound Cross References

ChemSpider ChemSpider:UHDGCWIWMRVCDJ-XVFCMESISA-N
PubChem SID: 26754267 SID: 93576752
Wikipedia Cytidine

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL95606



ACToR 4395-95-3
Brenda 372
ChEBI 17562
DrugBank DB02097
eMolecules 496210
FDA SRS 5CSZ8459RP
Guide to Pharmacology 4728
Human Metabolome Database HMDB0000089
IBM Patent System 935336C9185F95A4872105C0426A8F34
KEGG Ligand C00475
Mcule MCULE-3044641322
Metabolights MTBLC17562
MolPort MolPort-000-716-085
Nikkaji J4.837B
PDBe CTN
PubChem 6175
PubChem: Drugs of the Future 49684259
PubChem: Thomson Pharma 15342347
Recon cytd
Rhea 17562
Selleck cytidine
SureChEMBL SCHEMBL7179
ZINC ZINC000002583632

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