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BDBM50162016 3-((R)-2-Amino-2-phenyl-ethyl)-1-(2,6-difluoro-benzyl)-6-methyl-5-(4-methylsulfanyl-phenyl)-1H-pyrimidine-2,4-dione::CHEMBL179460

SMILES: CSc1ccc(cc1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@H](N)c2ccccc2)c1=O

InChI Key: InChIKey=SFKSQGMDOMSIRP-DEOSSOPVSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50162016   
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
Gonadotropin releasing hormone 1 (GnRHR1)


(Homo sapiens (Human))
BDBM50162016
PNG
(3-((R)-2-Amino-2-phenyl-ethyl)-1-(2,6-difluoro-ben...)
Show SMILES CSc1ccc(cc1)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@H](N)c2ccccc2)c1=O
Show InChI InChI=1S/C27H25F2N3O2S/c1-17-25(19-11-13-20(35-2)14-12-19)26(33)32(16-24(30)18-7-4-3-5-8-18)27(34)31(17)15-21-22(28)9-6-10-23(21)29/h3-14,24H,15-16,30H2,1-2H3/t24-/m0/s1
PDB

KEGG

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DrugBank
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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
13n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc.

Curated by ChEMBL


Assay Description
Binding affinity for Human gonadotropin-releasing hormone receptor


J Med Chem 48: 1169-78 (2005)


Article DOI: 10.1021/jm049218c
BindingDB Entry DOI: 10.7270/Q2MK6CD8
More data for this
Ligand-Target Pair