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BDBM96499 MLS001158344::N'-[(1Z)-1-(1-cyclohexyl-2,4,6-triketo-hexahydropyrimidin-5-ylidene)propyl]-2-hydroxy-benzohydrazide::N'-[(1Z)-1-(1-cyclohexyl-2,4,6-trioxo-1,3-diazinan-5-ylidene)propyl]-2-hydroxybenzohydrazide::N'-[(1Z)-1-[1-cyclohexyl-2,4,6-tris(oxidanylidene)-1,3-diazinan-5-ylidene]propyl]-2-oxidanyl-benzohydrazide::SMR000652168::cid_5928270

SMILES: CCC(NNC(=O)c1ccccc1O)=C1C(=O)NC(=O)N(C2CCCCC2)C1=O

InChI Key: InChIKey=VOWPDTFPKUBQOJ-UHFFFAOYSA-N

Data: 1 IC50

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 = 96499   
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
Homo sapiens huntingtin (HTT), mRNA


(Homo sapiens (Human))
BDBM96499
PNG
(MLS001158344 | N'-[(1Z)-1-(1-cyclohexyl-2,4,6-trik...)
Show SMILES CCC(NNC(=O)c1ccccc1O)=C1C(=O)NC(=O)N(C2CCCCC2)C1=O |w:14.29|
Show InChI InChI=1S/C20H24N4O5/c1-2-14(22-23-17(26)13-10-6-7-11-15(13)25)16-18(27)21-20(29)24(19(16)28)12-8-4-3-5-9-12/h6-7,10-12,22,25H,2-5,8-9H2,1H3,(H,23,26)(H,21,27,29)
PDB

KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 452n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2013)


BindingDB Entry DOI: 10.7270/Q2N58K09
More data for this
Ligand-Target Pair