Reaction Details | |||
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Target | Protein Nef | ||
Ligand | BDBM288051 | ||
Substrate/Competitor | n/a | ||
Meas. Tech. | Measurement of Antiviral (HIV-1) Activity | ||
Temperature | 298.15±n/a K | ||
EC50 | 25.0±n/a nM | ||
Comments | extracted | ||
Citation | Miyazaki, S; Isoshima, H; Oshita, K; Kawashita, S; Nagahashi, N; Terashita, M Substituted spiropyrido[1,2-a]pyrazine derivative and medicinal use thereof as HIV integrase inhibitor US Patent US10087178 Publication Date 10/2/2018 | ||
More Info.: | Get all data from this article, Assay Method | ||
Protein Nef | |||
Name: | Protein Nef | ||
Synonyms: | 3ORF | F-protein | HIV-1 Nef | NEF_HV1BR | Negative factor | Protein Nef | nef | ||
Type: | C-terminal core protein | ||
Mol. Mass.: | 23340.47 | ||
Organism: | Human immunodeficiency virus type 1 (isolate BRU/LAI group M subtype B) | ||
Description: | P03406 | ||
Residue: | 206 | ||
Sequence: |
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BDBM288051 | |||
n/a | |||
Name | BDBM288051 | ||
Synonyms: | N-(2,4-difluorobenzyl)- trans-3,9'-dihydroxy-2'- methyl-1',8'-dioxo- 1',2',3',8'- tetrahydrospiro[cyclobutane- 1,4'-pyrido[1,2-a]pyrazine]- 7'-carboxamide hydrobromide | US10087178, Example S11 | ||
Type | Small organic molecule | ||
Emp. Form. | C20H19F2N3O5 | ||
Mol. Mass. | 419.3788 | ||
SMILES | CN1C[C@@]2(C[C@H](O)C2)n2cc(C(=O)NCc3ccc(F)cc3F)c(=O)c(O)c2C1=O |r,wU:3.3,5.5,(8,2.63,;6.67,1.86,;6.67,.32,;5.33,-.45,;4.25,-1.54,;5.33,-2.63,;5.33,-4.17,;6.42,-1.54,;4,.32,;2.67,-.45,;1.33,.32,;,-.45,;,-1.99,;-1.33,.32,;-2.67,-.45,;-4,.32,;-4,1.86,;-5.33,2.63,;-6.67,1.86,;-8,2.63,;-6.67,.32,;-5.33,-.45,;-5.33,-1.99,;1.33,1.86,;,2.63,;2.67,2.63,;2.67,4.17,;4,1.86,;5.33,2.63,;5.33,4.17,)| | ||
Structure |