Therapeutic Targets Database
BIDD Pharmainformatics Databases
 
   
   

 

TTD Drug ID: DCL000765

Drug Information
NameDapivirine
SynonymsTMC120-R147681; 4-[4-(2,4,6-TRIMETHYL-PHENYLAMINO)-PYRIMIDIN-2-YLAMINO]-BENZONITRILE; CHEMBL70663; TMC-120; TMC120; Dapivirine; 4-((4-((2,4,6-Trimethylphenyl)amino)pyrimidin-2-yl)amino)benzonitrile; CID214347; CHEBI:46180; SBB062853; ZINC00007761; UNII-TCN4MG2VXS; 4-[[4-(2,4,6-trimethylanilino)pyrimidin-2-yl]amino]benzonitrile; TMC-120/R-147681; R-147681; AC1Q4RF3; R147681; AC1L4WO4; MolPort-000-003-506; 4-({4-[(2,4,6-Trimethylphenyl)amino]pyrimidin-2-yl}amino)benzenecarbonitrile; DB08639; R 147681; AR-1I3460; dapivirinum; TMC 120; GEL-002
CompanyInternational Partnership for Microbicides, Inc.
IndicationHIV infections
[ICD9: 042   ICD10: B20]
Phase I/II    [1]
Structure

Click to save drug structure in 3D MOL format

Click to save drug structure in 2D MOL format
InChI1S/C20H19N5/c1-13-10-14(2)19(15(3)11-13)24-18-8-9-22-20(25-18)23-
17-6-4-16(12-21)5-7-17/h4-11H,1-3H3,(H2,22,23,24,25)
InChIKeyILAYIAGXTHKHNT-UHFFFAOYSA-N
Canonical SMILESCC1=CC(=C(C(=C1)C)NC2=NC(=NC=C2)NC3=CC=C(C=C3)C#N)C    
CAS NumberCAS 244767-67-7
FormulaC20H19N5
PubChem Compound IDCID 214347.
PubChem Substance IDSID 642581.
ClinicalTrials.govNCT00799058;
TargetReverse transcriptaseInhibitor[1]
Ref 1Emerging antiviral drugs. Expert Opin Emerg Drugs. 2008 Sep;13(3):393-416. To Reference



 

Welcome to sign our Guestbook.

If you find any error in data or bug in web service, please kindly report it to Dr. Zhu.


Dr. Chen Yuzong
Deputy Director of Center for Computational Science and Engineering
Professor in Department of Pharmacy
National University of Singapore, Singapore


All rights reserved.

   
 
 
Computer-aided Drug Design
about BIDD |  databases |  software |  teaching |  research |  links

 

Department of Computational Science | National University of Singapore | Blk S17, 3 Science Drive 2, Singapore 117543