BDBM50226178 CHEMBL345636

SMILES: CCCCOc1ccc(CC(N)=O)cc1

InChI Key: InChIKey=RSMPEQBSFXBQMJ-UHFFFAOYSA-N

Data: 1 KI

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 = 50226178   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Alcohol dehydrogenase S chain (Equus caballus)	BDBM50226178 (CHEMBL345636) Show SMILES CCCCOc1ccc(CC(N)=O)cc1 Show InChI InChI=1S/C12H17NO2/c1-2-3-8-15-11-6-4-10(5-7-11)9-12(13)14/h4-7H,2-3,8-9H2,1H3,(H2,13,14)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem	PubMed	7.08E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory activity against horse liver alcohol dehydrogenase (ADH)				J Med Chem 29: 615-20 (1986) BindingDB Entry DOI: 10.7270/Q22R3TV3
					More data for this Ligand-Target Pair