Molecular Identity
Nevirapine
2-cyclopropyl-7-methyl-2,4,9,15-tetrazatricyclo[9.4.0.03,8]pentadeca-1(11),3,5,7,12,14-hexaen-10-one
PubChem CID: 4463
Nevirapine is a 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. It has a role as an antiviral drug and a HIV-1 reverse transcriptase inhibitor. It is a member of cyclopropanes and a dipyridodiazepine.
2D Structure
Properties
C15H14N4O
Molecular Formula
266.30
Molecular Weight
g/mol
266.1168
Exact Mass
Da
2
XLogP
Drug-like (Lipinski: < 5)
58.1
TPSA
Good oral absorption (< 140 A²)
1
H-Bond Donors
4
H-Bond Acceptors
397
Complexity
SMILES
Canonical SMILES
SMILES: CC1=C2C(=NC=C1)N(C3=C(C=CC=N3)C(=O)N2)C4CC4Isomeric SMILES
SMILES: CC1=C2C(=NC=C1)N(C3=C(C=CC=N3)C(=O)N2)C4CC4Synonyms(20)
nevirapine129618-40-2ViramuneBI-RG-587Nevirapine anhydrousViramune XRBIRG 0587Nevirapine, anhydrousNevirapine tevaBIRG587BIRG-058711-Cyclopropyl-5,11-dihydro-4-methyl-6H-dipyrido(3,2-b:2',3'-e)(1,4)diazepin-6-oneNevirapina11-CYCLOPROPYL-5,11-DIHYDRO-4-METHYL-6H-DIPYRIDO[3,2-B:2',3'-E][1,4]DIAZEPIN-6-ONEDTXSID7031797
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to Nevirapine
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