EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:63613 - nevirapine

Default Structure
ChEBI IDCHEBI:63613
ChEBI Namenevirapine
Stars
DefinitionA dipyridodiazepine that is 5,11-dihydro-6H-dipyrido[3,2-b:2',3'-e][1,4]diazepine which is substituted by methyl, oxo, and cyclopropyl groups at positions 4, 6, and 11, respectively. A non-nucleoside reverse transcriptase inhibitor with activity against HIV-1, it is used in combination with other antiretrovirals for the treatment of HIV infection.
Secondary ChEBI IDCHEBI:7546
Last Modified11 November 2019
DownloadsMolfile
FormulaC15H14N4O
Net Charge0
Average Mass266.304
Monoisotopic Mass266.11676
SMILESCc1ccnc2c1NC(=O)c1cccnc1N2C1CC1
InChIInChI=1S/C15H14N4O/c1-9-6-8-17-14-12(9)18-15(20)11-3-2-7-16-13(11)19(14)10-4-5-10/h2-3,6-8,10H,4-5H2,1H3,(H,18,20)
InChIKeyNQDJXKOVJZTUJA-UHFFFAOYSA-N
Wikipedia
Roles Classification
Biological Roles:
antiviral agent  A substance that destroys or inhibits replication of viruses.
antitubercular agent  A substance that kills or slows the growth of Mycobacterium tuberculosis and is used in the treatment of tuberculosis.
HIV-1 reverse transcriptase inhibitor  An entity which inhibits the activity of HIV-1 reverse transcriptase.
anti-HIV agent  An antiviral agent that destroys or inhibits the replication of the human immunodeficiency virus.
antiviral drug  A substance used in the prophylaxis or therapy of virus diseases.
Applications:
antitubercular agent  A substance that kills or slows the growth of Mycobacterium tuberculosis and is used in the treatment of tuberculosis.
antiviral drug  A substance used in the prophylaxis or therapy of virus diseases.
antiinfective agent  A substance used in the prophylaxis or therapy of infectious diseases.
ChEBI Ontology
Outgoing Relation(s)
nevirapine (CHEBI:63613) has role anti-HIV agent (CHEBI:64946)
nevirapine (CHEBI:63613) has role antiinfective agent (CHEBI:35441)
nevirapine (CHEBI:63613) has role antitubercular agent (CHEBI:33231)
nevirapine (CHEBI:63613) has role antiviral agent (CHEBI:22587)
nevirapine (CHEBI:63613) has role antiviral drug (CHEBI:36044)
nevirapine (CHEBI:63613) has role HIV-1 reverse transcriptase inhibitor (CHEBI:53756)
nevirapine (CHEBI:63613) is a cyclopropanes (CHEBI:51454)
nevirapine (CHEBI:63613) is a dipyridodiazepine (CHEBI:63667)
Incoming Relation(s)
12-hydroxynevirapine (CHEBI:145206) has functional parent nevirapine (CHEBI:63613)
IUPAC Name 
11-cyclopropyl-4-methyl-5,11-dihydro-6H-dipyrido[3,2-b:2',3'-e][1,4]diazepin-6-one
INNs  Source
nevirapinaWHO MedNet
nevirapineChemIDplus
Synonyms  Source
11-cyclopropyl-5,11-dihydro-4-methyl-6H-dipyrido(3,2-b:2',3'-e)(1,4)diazepin-6-oneChemIDplus
BIRG 0587ChEMBL
BIRG-0587ChEMBL
BIRG0587ChEMBL
NEVDrugBank
NevirapineKEGG COMPOUND
Brand Names  Source
ViramuneKEGG DRUG
Viramune xrChEMBL
Manual XrefsDatabases
C07263KEGG COMPOUND
D00435KEGG DRUG
DB00238DrugBank
LSM-5336LINCS
NevirapineWikipedia
NVPPDBeChem
Registry NumbersSources
Reaxys:4757598Reaxys
CAS:129618-40-2KEGG COMPOUND
CAS:129618-40-2ChemIDplus
Citations