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BDBM44611 4-[4-(4-chlorobenzyl)piperazino]-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-keto-butyramide::4-[4-[(4-chlorophenyl)methyl]-1-piperazinyl]-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-oxobutanamide::4-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-oxidanylidene-butanamide::4-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-oxobutanamide::MLS000082900::SMR000045631::cid_664649

SMILES: CCc1nnc(NC(=O)CCC(=O)N2CCN(Cc3ccc(Cl)cc3)CC2)s1

InChI Key: InChIKey=JTULFWJOBAZRMM-UHFFFAOYSA-N

Data: 1 EC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 44611   
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
Multidrug resistance-associated protein 1


(Homo sapiens (Human))		BDBM44611
PNG
(4-[4-(4-chlorobenzyl)piperazino]-N-(5-ethyl-1,3,4-...)
Show SMILES CCc1nnc(NC(=O)CCC(=O)N2CCN(Cc3ccc(Cl)cc3)CC2)s1
Show InChI InChI=1S/C19H24ClN5O2S/c1-2-17-22-23-19(28-17)21-16(26)7-8-18(27)25-11-9-24(10-12-25)13-14-3-5-15(20)6-4-14/h3-6H,2,7-13H2,1H3,(H,21,23,26)
PDB

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PC sid
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Similars
PCBioAssay
n/an/an/an/a 4.09E+3n/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/Q25719FH
More data for this
Ligand-Target Pair