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Ligand

NameBB-823
Molecular formulaC22H30N4O3S
IUPAC nameN-[(2S)-1-ethoxy-4-methylpentan-2-yl]-4-[(2-methylimidazo[4,5-c]pyridin-1-yl)methyl]benzenesulfonamide
Molecular weight430.567
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP3.3
SynonymsN-((S)-1-Ethoxymethyl-3-methyl-butyl)-4-(2-methyl-imidazo[4,5-c]pyridin-1-ylmethyl)-benzenesulfonamide
CHEMBL157078
139133-28-1
SCHEMBL7851331
BDBM50280478
[ Show all ]
Inchi KeyBCRDOIMCNBBVGM-IBGZPJMESA-N
Inchi IDInChI=1S/C22H30N4O3S/c1-5-29-15-19(12-16(2)3)25-30(27,28)20-8-6-18(7-9-20)14-26-17(4)24-21-13-23-11-10-22(21)26/h6-11,13,16,19,25H,5,12,14-15H2,1-4H3/t19-/m0/s1
PubChem CID9954410
ChEMBLCHEMBL157078
IUPHARN/A
BindingDB50280478
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: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
20427Platelet-activating factor receptorP25105PTAFRHomo sapiens (Human)342

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