General Information of Drug (ID: DMELUQV)

Drug Name
GS-8374
Synonyms HIV protease inhibitor (diethylphosphonate motif), Gilead
Indication
Disease Entry ICD 11 Status REF
Human immunodeficiency virus infection 1C62 Investigative [1]
Structure
3D MOL 2D MOL
Chemical Identifiers
Formula
C33H49N2O12PS
Canonical SMILES
CCOP(=O)(COC1=CC=C(C=C1)CC(C(CN(CC(C)C)S(=O)(=O)C2=CC=C(C=C2)OC)O)NC(=O)OC3COC4C3CCO4)OCC
InChI
1S/C33H49N2O12PS/c1-6-45-48(38,46-7-2)22-44-26-10-8-24(9-11-26)18-29(34-33(37)47-31-21-43-32-28(31)16-17-42-32)30(36)20-35(19-23(3)4)49(39,40)27-14-12-25(41-5)13-15-27/h8-15,23,28-32,36H,6-7,16-22H2,1-5H3,(H,34,37)/t28-,29-,30+,31-,32+/m0/s1
InChIKey
FCLYPCIMVVLLRN-FXSYQQGGSA-N
Cross-matching ID
PubChem CID
12004117
TTD ID
D00SKS

References

1 The ChEMBL database in 2017. Nucleic Acids Res. 2017 Jan 4;45(D1):D945-D954.