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BDBM74328 6-amino-1-cyclopropyl-5-[2-[(5-esyl-1,3-benzoxazol-2-yl)thio]acetyl]pyrimidine-2,4-quinone::6-amino-1-cyclopropyl-5-[2-[(5-ethylsulfonyl-1,3-benzoxazol-2-yl)sulfanyl]acetyl]pyrimidine-2,4-dione::6-amino-1-cyclopropyl-5-[2-[(5-ethylsulfonyl-1,3-benzoxazol-2-yl)thio]-1-oxoethyl]pyrimidine-2,4-dione::6-azanyl-1-cyclopropyl-5-[2-[(5-ethylsulfonyl-1,3-benzoxazol-2-yl)sulfanyl]ethanoyl]pyrimidine-2,4-dione::MLS002161347::SMR001243770::cid_16296270

InChI string: InChI=1S/C18H18N4O6S2/c1-2-30(26,27)10-5-6-13-11(7-10)20-18(28-13)29-8-12(23)14-15(19)22(9-3-4-9)17(25)21-16(14)24/h5-7,9H,2-4,8,19H2,1H3,(H,21,24,25)

SMILES: CCS(=O)(=O)c1ccc2oc(SCC(=O)c3c(N)n(C4CC4)c(=O)[nH]c3=O)nc2c1

InChI Key: InChIKey=WJKJUSMLTSOFIP-UHFFFAOYSA-N

Data: 1 EC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 74328   
Target
(Institution)
LigandTarget
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
LANA


(Human herpesvirus 8)
BDBM74328
PNG
(6-amino-1-cyclopropyl-5-[2-[(5-esyl-1,3-benzoxazol...)
Show SMILES CCS(=O)(=O)c1ccc2oc(SCC(=O)c3c(N)n(C4CC4)c(=O)[nH]c3=O)nc2c1
Show InChI InChI=1S/C18H18N4O6S2/c1-2-30(26,27)10-5-6-13-11(7-10)20-18(28-13)29-8-12(23)14-15(19)22(9-3-4-9)17(25)21-16(14)24/h5-7,9H,2-4,8,19H2,1H3,(H,21,24,25)
PDB

KEGG

UniProtKB/SwissProt

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PC cid
PC sid
UniChem
AffyNet 
PCBioAssay
n/an/an/an/a>7.50E+4n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Primary Collaborators: Kenneth Kaye,Brigham & Womens,Boston MA,kkaye@rics.bwh.harvard.edu,617-525-4256 Chantal Beauchemin,Brigham & Womens,Boston MA,...


PubChem Bioassay (2010)

More data for this
Ligand-Target Pair