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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL602
CHEMBL602
Compound Name CYSTEAMINE
ChEMBL Synonyms Cystagon | CI-9148 | L-1573 | MEA | Cystaran | Cysteamine Bitartrate | Cysteamine HCl | Mercaptamine | Cysteamine
Max Phase 4 (Approved)
Trade Names Cystagon | Cystaran
Molecular Formula C2H7NS

Additional synonyms for CHEMBL602 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES NCCS
Standard InChI InChI=1S/C2H7NS/c3-1-2-4/h4H,1-3H2
Standard InChI Key UFULAYFCSOUIOV-UHFFFAOYSA-N

Mechanism of Action

Mechanism of Action ChEMBL Target References
Cystine hydrolytic enzyme Cystine DailyMed DailyMed

Molecule Features

CHEMBL602 compound icon
Drug Type:Synthetic Small Molecule Rule of Five:Y First In Class:N Chirality:Achiral Molecule Prodrug:N Oral:Y Parenteral:N Topical:Y Black Box:N Availability Type:Prescription-only

Clinical Data

Number of clinical trials registered at clinicaltrials.gov
Number of reviews at The Cochrane Collaboration
Number of entries at British National Formulary

Structural Alerts

There are 6 structural alerts for CHEMBL602. To view alerts please click here.

Alternate Forms of Compound in ChEMBL


CHEMBL602

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
77.2 77.0299 -0.22 1 64.81 BASE


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


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
8.32 10.34 .22 -1.3 0 4 0.43

Compound Cross References

ATC A - ALIMENTARY TRACT AND METABOLISM
A16 - OTHER ALIMENTARY TRACT AND METABOLISM PRODUCTS
A16A - OTHER ALIMENTARY TRACT AND METABOLISM PRODUCTS
A16AA - Amino acids and derivatives
A16AA04 - mercaptamine

S - SENSORY ORGANS
S01 - OPHTHALMOLOGICALS
S01X - OTHER OPHTHALMOLOGICALS
S01XA - Other ophthalmologicals
S01XA21 - mercaptamine

ChemSpider ChemSpider:UFULAYFCSOUIOV-UHFFFAOYSA-N
DailyMed cysteamine bitartrate cysteamine hydrochloride
PubChem SID: 11111480 SID: 144206643 SID: 90341118
Wikipedia Cysteamine

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL602



ACToR 60-23-1 3037-04-5 139720-70-0
BindinDB 7968
ChEBI 17141
DrugBank DB00847
eMolecules 495805
FDA SRS 5UX2SD1KE2
Guide to Pharmacology 7440
Human Metabolome Database HMDB02991 HMDB60150
KEGG Ligand C01678
Mcule MCULE-1838427828
Nikkaji J62.801H
PDBe DHL
PubChem 6058
PubChem: Thomson Pharma 15218635
SureChEMBL SCHEMBL16369

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