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BDBM22693 8-[(dimethylsulfamoyl)(methyl)amino]-N-[(4-fluorophenyl)methyl]-3-hydroxy-4-oxo-4H,6H,7H,8H-pyrrolo[1,2-a]pyrimidine-2-carboxamide::Bicyclic pyrimidinone, 22a

SMILES: CN(C)S(=O)(=O)N(C)C1CCn2c1nc(C(=O)NCc1ccc(F)cc1)c(O)c2=O

InChI Key: InChIKey=JSXPFHIXBFABPT-UHFFFAOYSA-N

Data: 1 IC50

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 22693   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Gag-Pol polyprotein


(Human immunodeficiency virus type 1 group M subtyp...)
BDBM22693
PNG
(8-[(dimethylsulfamoyl)(methyl)amino]-N-[(4-fluorop...)
Show SMILES CN(C)S(=O)(=O)N(C)C1CCn2c1nc(C(=O)NCc1ccc(F)cc1)c(O)c2=O
Show InChI InChI=1S/C18H22FN5O5S/c1-22(2)30(28,29)23(3)13-8-9-24-16(13)21-14(15(25)18(24)27)17(26)20-10-11-4-6-12(19)7-5-11/h4-7,13,25H,8-10H2,1-3H3,(H,20,26)
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 45n/an/an/an/an/an/a



IRBM-MRL



Assay Description
The microtiter plate assay for stand transfer was performed with an immobilized donor substrate and a target substrate biotinylated at the 3-prime en...


J Med Chem 51: 861-74 (2008)


Article DOI: 10.1021/jm701164t
BindingDB Entry DOI: 10.7270/Q2765CNT
More data for this
Ligand-Target Pair