null

SMILES: COc1cccc(c1Cl)-c1c2SCC(c3ccccc3F)n2c(=O)n(C[C@H](N)c2ccccc2)c1=O

InChI Key: InChIKey=CAFJXNPXZRSSIV-BGERDNNASA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50261245   

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
Gonadotropin-releasing hormone receptor (Homo sapiens (Human))	BDBM50261245 (6-((R)-2-amino-2-phenylethyl)-8-(2-chloro-3-methox...) Show SMILES COc1cccc(c1Cl)-c1c2SCC(c3ccccc3F)n2c(=O)n(C[C@H](N)c2ccccc2)c1=O |r,wD:26.29,(32.15,-7.13,;30.82,-7.9,;30.82,-9.44,;32.16,-10.21,;32.16,-11.75,;30.82,-12.52,;29.49,-11.74,;29.49,-10.21,;28.15,-9.44,;28.16,-12.51,;28.16,-14.05,;29.3,-15.08,;28.68,-16.48,;27.15,-16.32,;26.12,-17.46,;24.61,-17.14,;23.58,-18.29,;24.06,-19.75,;25.58,-20.07,;26.6,-18.92,;28.11,-19.24,;26.83,-14.82,;25.49,-14.05,;24.16,-14.82,;25.5,-12.51,;24.16,-11.74,;22.83,-12.52,;22.83,-14.06,;21.5,-11.75,;20.16,-12.52,;18.83,-11.75,;18.83,-10.2,;20.16,-9.43,;21.49,-10.2,;26.82,-11.73,;26.82,-10.19,)| Show InChI InChI=1S/C27H23ClFN3O3S/c1-35-22-13-7-11-18(24(22)28)23-25(33)31(14-20(30)16-8-3-2-4-9-16)27(34)32-21(15-36-26(23)32)17-10-5-6-12-19(17)29/h2-13,20-21H,14-15,30H2,1H3/t20-,21?/m0/s1	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	4.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Neurocrine Biosciences, Inc Curated by ChEMBL					Assay Description Binding affinity at human GnRH receptor				J Med Chem 51: 3331-48 (2008) Article DOI: 10.1021/jm701249f BindingDB Entry DOI: 10.7270/Q2KD1XQ0
					More data for this Ligand-Target Pair