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BDBM44708 MLS000118845::N-(4-ethylphenyl)-2-(2-keto-6-morpholinosulfonyl-1,3-benzoxazol-3-yl)acetamide::N-(4-ethylphenyl)-2-(6-morpholin-4-ylsulfonyl-2-oxidanylidene-1,3-benzoxazol-3-yl)ethanamide::N-(4-ethylphenyl)-2-(6-morpholin-4-ylsulfonyl-2-oxo-1,3-benzoxazol-3-yl)acetamide::N-(4-ethylphenyl)-2-[6-(4-morpholinylsulfonyl)-2-oxo-1,3-benzoxazol-3-yl]acetamide::SMR000095785::cid_5307802

SMILES: CCc1ccc(NC(=O)Cn2c3ccc(cc3oc2=O)S(=O)(=O)N2CCOCC2)cc1

InChI Key: InChIKey=LIFDRSXVCXHENI-UHFFFAOYSA-N

Data: 1 EC50

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 44708   
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 protein 1/Multidrug resistance associated protein 1


(Homo sapiens (Human))
BDBM44708
PNG
(MLS000118845 | N-(4-ethylphenyl)-2-(2-keto-6-morph...)
Show SMILES CCc1ccc(NC(=O)Cn2c3ccc(cc3oc2=O)S(=O)(=O)N2CCOCC2)cc1
Show InChI InChI=1S/C21H23N3O6S/c1-2-15-3-5-16(6-4-15)22-20(25)14-24-18-8-7-17(13-19(18)30-21(24)26)31(27,28)23-9-11-29-12-10-23/h3-8,13H,2,9-12,14H2,1H3,(H,22,25)
PDB

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UniProtKB/SwissProt

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PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/an/an/a 5.40E+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