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BDBM38340 MLS000082296::N-(3-cyano-1-isobutyl-5-keto-10-methyl-dipyrido[3,4-c:1',2'-f]pyrimidin-2-ylidene)-piperonylamide::N-[3-cyano-10-methyl-1-(2-methylpropyl)-5-oxidanylidene-dipyrido[3,4-c:1',2'-f]pyrimidin-2-ylidene]-1,3-benzodioxole-5-carboxamide::N-[3-cyano-10-methyl-1-(2-methylpropyl)-5-oxo-2-dipyrido[3,4-c:1',2'-f]pyrimidinylidene]-1,3-benzodioxole-5-carboxamide::N-[3-cyano-10-methyl-1-(2-methylpropyl)-5-oxodipyrido[3,4-c:1',2'-f]pyrimidin-2-ylidene]-1,3-benzodioxole-5-carboxamide::SMR000046977::cid_665853

SMILES: CC(C)Cn1c2nc3c(C)cccn3c(=O)c2cc(C#N)\c1=N/C(=O)c1ccc2OCOc2c1

InChI Key: InChIKey=SGUBECVQQMGKRC-XAYXJRQQSA-N

Data: 1 IC50

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   Substructure
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 38340   
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
diphosphomevalonate decarboxylase


(Streptococcus pneumoniae D39)
BDBM38340
PNG
(MLS000082296 | N-(3-cyano-1-isobutyl-5-keto-10-met...)
Show SMILES CC(C)Cn1c2nc3c(C)cccn3c(=O)c2cc(C#N)\c1=N/C(=O)c1ccc2OCOc2c1
Show InChI InChI=1S/C25H21N5O4/c1-14(2)12-30-22(28-24(31)16-6-7-19-20(10-16)34-13-33-19)17(11-26)9-18-23(30)27-21-15(3)5-4-8-29(21)25(18)32/h4-10,14H,12-13H2,1-3H3/b28-22+
KEGG

UniProtKB/TrEMBL

GoogleScholar
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 1.18E+5n/an/an/an/an/an/a



SRMLSC

Curated by PubChem BioAssay


Assay Description
Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q2N014XN
More data for this
Ligand-Target Pair