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BDBM45220 5-methyl-5,7-bis(4-methylphenyl)-2-(trifluoromethyl)-1H-[1,2,4]triazolo[1,5-a]pyrimidine::5-methyl-5,7-bis(p-tolyl)-2-(trifluoromethyl)-1H-[1,2,4]triazolo[1,5-a]pyrimidine::MLS000335076::SMR000249834::cid_6093854

SMILES: Cc1ccc(cc1)C1=CC(C)(Nc2nc(nn12)C(F)(F)F)c1ccc(C)cc1

InChI Key: InChIKey=ZRJKNTBHBCEVCK-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 = 45220   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Multidrug resistance protein 1/Multidrug resistance associated protein 1


(Homo sapiens (Human))
BDBM45220
PNG
(5-methyl-5,7-bis(4-methylphenyl)-2-(trifluoromethy...)
Show SMILES Cc1ccc(cc1)C1=CC(C)(Nc2nc(nn12)C(F)(F)F)c1ccc(C)cc1
Show InChI InChI=1S/C21H19F3N4/c1-13-4-8-15(9-5-13)17-12-20(3,16-10-6-14(2)7-11-16)26-19-25-18(21(22,23)24)27-28(17)19/h4-12H,1-3H3,(H,25,26,27)
PDB

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PC cid
PC sid
UniChem
PCBioAssay
n/an/an/an/a 5.10E+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