Name: R-82913
Rating: 5 (10 reviews)

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sdf 文件

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HIT ID:HIT212713421
Cas No:126347-69-1
常用名:R-82913
别名:R82913. 9-Cmbib, R 82913, 9-Cl-Tibo
IUPAC:(11S)-6-chloro-11-methyl-10-(3-methylbut-2-en-1-yl)-1,3,10-triazatricyclo[6.4.1.0^{4,13}]trideca-4,6,8(13)-triene-2-thione
IUPAC:(11S)-6-chloro-11-methyl-10-(3-methylbut-2-en-1-yl)-1,3,10-triazatricyclo[6.4.1.0^{4,13}]trideca-4,6,8(13)-triene-2-thione
InChI key:RCSLUNOLLUVOOG-NSHDSACASA-N

分子式:C16H20ClN3S
分子量:321.87
氢键供体数 (HBD):1
氢键受体数 (HBA):1
LogP:4.0630703
SMILES:C[C@H]1Cn2c3c(CN1CC=C(C)C)cc(Cl)cc3[nH]c2=S |wU:1.0,(6.61,2.95,;5.07,2.99,;4.37,1.63,;2.86,1.32,;1.68,2.32,;1.72,3.86,;2.95,4.78,;4.44,4.4,;5.43,5.58,;4.91,7.03,;5.9,8.2,;5.38,9.65,;7.42,7.93,;.27,4.58,;-1.04,3.77,;-2.4,4.49,;-.99,2.23,;.37,1.5,;.74,.01,;2.28,-.1,;3.09,-1.41,)|
SMILES:C[C@H]1Cn2c3c(CN1CC=C(C)C)cc(Cl)cc3[nH]c2=S |wU:1.0,(6.61,2.95,;5.07,2.99,;4.37,1.63,;2.86,1.32,;1.68,2.32,;1.72,3.86,;2.95,4.78,;4.44,4.4,;5.43,5.58,;4.91,7.03,;5.9,8.2,;5.38,9.65,;7.42,7.93,;.27,4.58,;-1.04,3.77,;-2.4,4.49,;-.99,2.23,;.37,1.5,;.74,.01,;2.28,-.1,;3.09,-1.41,)|

R-82913 is a RNA-directed DNA polymerase inhibitor. R 82913 reduce 5-HT2 receptor-mediated DOI-head-shakes in mice. R82913 inhibited the replication of thirteen different strains of HIV-1 in CEM cells with a median IC50 of 0.15 microM. R82913 was 20-fold more potent than AZT-TP in the inhibition of HIV-1 reverse transcriptase in an assay. R82913 has no effect on the replication of HIV-2 in CEM cells and does not inhibit the reverse transcriptase from this virus.

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