zalcitabine   Click here for help

GtoPdb Ligand ID: 4828

Synonyms: dideoxycytidine (DDC) | Hivid® | Ro-242027000/Ro-24-2027-000
Approved drug
zalcitabine is an approved drug (FDA (1992))
Compound class: Synthetic organic
Comment: zalcitabine is a nucleoside analog reverse transcriptase inhibitor (NRTI) antiretroviral drug. Chemically it is an is an analogue of pyrimidine and is a derivative of endogenous deoxycytidine.
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 5
Hydrogen bond donors 2
Rotatable bonds 2
Topological polar surface area 90.37
Molecular weight 211.1
XLogP 0.22
No. Lipinski's rules broken 0
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Canonical SMILES Nc1ccn(c(=O)n1)C1CCC(O1)CO
Isomeric SMILES Nc1ccn(c(=O)n1)[C@H]1CC[C@H](O1)CO
InChI InChI=1S/C9H13N3O3/c10-7-3-4-12(9(14)11-7)8-2-1-6(5-13)15-8/h3-4,6,8,13H,1-2,5H2,(H2,10,11,14)/t6-,8+/m0/s1
Classification Click here for help
Compound class Synthetic organic
Approved drug? Yes (FDA (1992))
IUPAC Name Click here for help
International Nonproprietary Names Click here for help
INN number INN
6871 zalcitabine
Synonyms Click here for help
dideoxycytidine (DDC) | Hivid® | Ro-242027000/Ro-24-2027-000
Database Links Click here for help
CAS Registry No. 7481-89-2 (source: Scifinder)
DrugBank Ligand DB00943
DrugCentral Ligand 2856
GtoPdb PubChem SID 178101530
PubChem CID 24066
Search Google for chemical match using the InChIKey WREGKURFCTUGRC-POYBYMJQSA-N
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UniChem Compound Search for chemical match using the InChIKey WREGKURFCTUGRC-POYBYMJQSA-N
UniChem Connectivity Search for chemical match using the InChIKey WREGKURFCTUGRC-POYBYMJQSA-N
Wikipedia Zalcitabine