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Ligand

NameCHEMBL2087413
Molecular formulaC23H29ClN4O5S
IUPAC name2-[2-[(2-chloro-4-methoxyphenyl)sulfonyl-methylamino]ethoxy]-N-[[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]methyl]-N-methylacetamide
Molecular weight509.018
Hydrogen bond acceptor7
Hydrogen bond donor1
XlogP1.5
SynonymsBDBM50420598
SCHEMBL4032166
Inchi KeyOACALLNGRPICFL-UHFFFAOYSA-N
Inchi IDInChI=1S/C23H29ClN4O5S/c1-27(15-17-4-6-18(7-5-17)23-25-10-11-26-23)22(29)16-33-13-12-28(2)34(30,31)21-9-8-19(32-3)14-20(21)24/h4-9,14H,10-13,15-16H2,1-3H3,(H,25,26)
PubChem CID57342849
ChEMBLCHEMBL2087413
IUPHARN/A
BindingDB50420598
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
236238B1 bradykinin receptorQ61125Bdkrb1Mus musculus (Mouse)334
236239B1 bradykinin receptorP46663BDKRB1Homo sapiens (Human)353

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