BDBM56759 MLS001012121::N'-(3-keto-5,5-dimethyl-cyclohexen-1-yl)nicotinohydrazide::N'-(5,5-dimethyl-3-oxidanylidene-cyclohexen-1-yl)pyridine-3-carbohydrazide::N'-(5,5-dimethyl-3-oxo-1-cyclohexenyl)-3-pyridinecarbohydrazide::N'-(5,5-dimethyl-3-oxocyclohexen-1-yl)pyridine-3-carbohydrazide::Nicotinic acid N'-(5,5-dimethyl-3-oxo-cyclohex-1-enyl)-hydrazide::SMR000425283::cid_749342

SMILES CC1(C)CC(=O)C=C(C1)NNC(=O)c1cccnc1

InChI Key InChIKey=BBXPAYOSKFUHKB-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 56759   

TargetKallikrein-5(Human)
Pcmd

Curated by PubChem BioAssay
LigandPNGBDBM56759(MLS001012121 | N'-(5,5-dimethyl-3-oxo-1-cyclohexen...)
Affinity DataIC50: 5.00E+4nMAssay Description:Molecular Library Screening Center Network (MLSCN) Penn Center for Molecular Discovery (PCMD) Assay Provider: Scott L. Diamond, University of Pennsy...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/8/2011
Entry Details
PCBioAssay