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Ligand

NameCHEMBL181864
Molecular formulaC23H21ClFN3O3S
IUPAC name1-[(3-chlorophenyl)methyl]-2-ethoxy-N-[(4-fluorophenyl)methyl]benzimidazole-5-sulfonamide
Molecular weight473.947
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP4.9
SynonymsBDBM50160503
1-(3-Chloro-benzyl)-2-ethoxy-1H-benzoimidazole-5-sulfonic acid 4-fluoro-benzylamide
Inchi KeyBAQYPRBDEOICOG-UHFFFAOYSA-N
Inchi IDInChI=1S/C23H21ClFN3O3S/c1-2-31-23-27-21-13-20(32(29,30)26-14-16-6-8-19(25)9-7-16)10-11-22(21)28(23)15-17-4-3-5-18(24)12-17/h3-13,26H,2,14-15H2,1H3
PubChem CID44391670
ChEMBLCHEMBL181864
IUPHARN/A
BindingDB50160503
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
19092Gonadotropin-releasing hormone receptorP30968GNRHRHomo sapiens (Human)328
19093Gonadotropin-releasing hormone receptorP30969GnrhrRattus norvegicus (Rat)327

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