BDBM50298092 CHEMBL560286::N-((2S,3S)-3-(3-bromophenyl)-4-(4-chlorophenyl)butan-2-yl)-6-(piperidin-1-yl)-2-(trifluoromethyl)pyrimidin-4-amine

SMILES: C[C@H](Nc1cc(nc(n1)C(F)(F)F)N1CCCCC1)[C@@H](Cc1ccc(Cl)cc1)c1cccc(Br)c1

InChI Key: InChIKey=SWHHIIKNUWGCAU-HTAPYJJXSA-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 = 50298092   

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
Cannabinoid receptor 1 (Rattus norvegicus (rat))	BDBM50298092 (CHEMBL560286 | N-((2S,3S)-3-(3-bromophenyl)-4-(4-c...) Show SMILES C[C@H](Nc1cc(nc(n1)C(F)(F)F)N1CCCCC1)[C@@H](Cc1ccc(Cl)cc1)c1cccc(Br)c1 |r| Show InChI InChI=1S/C26H27BrClF3N4/c1-17(22(19-6-5-7-20(27)15-19)14-18-8-10-21(28)11-9-18)32-23-16-24(35-12-3-2-4-13-35)34-25(33-23)26(29,30)31/h5-11,15-17,22H,2-4,12-14H2,1H3,(H,32,33,34)/t17-,22+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	196	n/a	n/a	n/a	n/a	n/a	n/a
Green Cross Corporation Curated by ChEMBL					Assay Description Displacement of [3H]CP55940 from cannabinoid CB1 receptor in Sprague-Dawley rat cerebellar membrane by liquid scintillation spectrometry				Bioorg Med Chem Lett 19: 4692-7 (2009) Article DOI: 10.1016/j.bmcl.2009.06.069 BindingDB Entry DOI: 10.7270/Q2PK0G65
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