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Details

Stereochemistry ABSOLUTE
Molecular Formula C14H17FN2O3
Molecular Weight 280.2948
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of OPAVIRALINE

SMILES

CC[C@@H]1N(C(=O)OC(C)C)C2=C(NC1=O)C=CC(F)=C2

InChI

InChIKey=KELNNWMENBUHNS-NSHDSACASA-N
InChI=1S/C14H17FN2O3/c1-4-11-13(18)16-10-6-5-9(15)7-12(10)17(11)14(19)20-8(2)3/h5-8,11H,4H2,1-3H3,(H,16,18)/t11-/m0/s1

HIDE SMILES / InChI

Molecular Formula C14H17FN2O3
Molecular Weight 280.2948
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Opaviraline (also known as GW 420867), a nonnucleoside reverse transcriptase inhibitor that was studied for the treatment of HIV infections. The drug participated in clinical trials phase II in Germany, in South Africa, and in the United Kingdom, however, these studies were discontinued.

Approval Year

PubMed

PubMed

TitleDatePubMed
Discovery of TSAO derivatives with an unusual HIV-1 activity/resistance profile.
2006 Aug
Substance Class Chemical
Created
by admin
on Fri Dec 15 16:30:38 GMT 2023
Edited
by admin
on Fri Dec 15 16:30:38 GMT 2023
Record UNII
Q3A8EU2NMU
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
OPAVIRALINE
INN  
INN  
Official Name English
HBY-1293
Code English
GW-420867
Code English
opaviraline [INN]
Common Name English
ISOPROPYL (S)-2-ETHYL-7-FLUORO-3,4-DIHYDRO-3-OXO-1(2H)-QUINOXALINECARBOXYLATE
Systematic Name English
GW-420867X
Code English
Classification Tree Code System Code
NCI_THESAURUS C97453
Created by admin on Fri Dec 15 16:30:38 GMT 2023 , Edited by admin on Fri Dec 15 16:30:38 GMT 2023
Code System Code Type Description
DRUG BANK
DB07884
Created by admin on Fri Dec 15 16:30:38 GMT 2023 , Edited by admin on Fri Dec 15 16:30:38 GMT 2023
PRIMARY
FDA UNII
Q3A8EU2NMU
Created by admin on Fri Dec 15 16:30:38 GMT 2023 , Edited by admin on Fri Dec 15 16:30:38 GMT 2023
PRIMARY
NCI_THESAURUS
C90786
Created by admin on Fri Dec 15 16:30:38 GMT 2023 , Edited by admin on Fri Dec 15 16:30:38 GMT 2023
PRIMARY
PUBCHEM
154048
Created by admin on Fri Dec 15 16:30:38 GMT 2023 , Edited by admin on Fri Dec 15 16:30:38 GMT 2023
PRIMARY
SMS_ID
300000034254
Created by admin on Fri Dec 15 16:30:38 GMT 2023 , Edited by admin on Fri Dec 15 16:30:38 GMT 2023
PRIMARY
ChEMBL
CHEMBL301370
Created by admin on Fri Dec 15 16:30:38 GMT 2023 , Edited by admin on Fri Dec 15 16:30:38 GMT 2023
PRIMARY
CAS
178040-94-3
Created by admin on Fri Dec 15 16:30:38 GMT 2023 , Edited by admin on Fri Dec 15 16:30:38 GMT 2023
PRIMARY
EPA CompTox
DTXSID60170415
Created by admin on Fri Dec 15 16:30:38 GMT 2023 , Edited by admin on Fri Dec 15 16:30:38 GMT 2023
PRIMARY
INN
8020
Created by admin on Fri Dec 15 16:30:38 GMT 2023 , Edited by admin on Fri Dec 15 16:30:38 GMT 2023
PRIMARY
Related Record Type Details
TARGET ORGANISM->INHIBITOR
TARGET -> INHIBITOR
Related Record Type Details
ACTIVE MOIETY