BDBM41555 5-tert-butyl-N-[1-[2-(trifluoromethyl)benzyl]pyrazol-4-yl]-4,5,6,7-tetrahydroindoxazene-3-carboxamide::5-tert-butyl-N-[1-[[2-(trifluoromethyl)phenyl]methyl]-4-pyrazolyl]-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxamide::5-tert-butyl-N-[1-[[2-(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxamide::AB00538135::cid_16740891

SMILES: CC(C)(C)C1CCc2onc(C(=O)Nc3cnn(Cc4ccccc4C(F)(F)F)c3)c2C1

InChI Key: InChIKey=PQJDHMKQCZXNIR-UHFFFAOYSA-N

Data: 1 IC50

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 = 41555   

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
Chain A, Crystal Structure Of A Pantothenate Synthetase, Apo Enzyme In C2 Space Group (Mycobacterium tuberculosis (strain ATCC 25618 / H3...)	BDBM41555 (5-tert-butyl-N-[1-[2-(trifluoromethyl)benzyl]pyraz...) Show SMILES CC(C)(C)C1CCc2onc(C(=O)Nc3cnn(Cc4ccccc4C(F)(F)F)c3)c2C1 Show InChI InChI=1S/C23H25F3N4O2/c1-22(2,3)15-8-9-19-17(10-15)20(29-32-19)21(31)28-16-11-27-30(13-16)12-14-6-4-5-7-18(14)23(24,25)26/h4-7,11,13,15H,8-10,12H2,1-3H3,(H,28,31)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	0.274	n/a	n/a	n/a	n/a	n/a	n/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/Q2FX77T8
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