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Ligand

NameCHEMBL146845
Molecular formulaC24H31N3O3S
IUPAC nameN-(3,4-dimethyl-1,2-oxazol-5-yl)-2-[4-(2-methylpropyl)-2-(propylamino)phenyl]benzenesulfonamide
Molecular weight441.59
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP6.1
SynonymsN-(3,4-Dimethylisoxazole-5-yl)-2'-(propylamino)-4'-(2-methylpropyl)-1,1'-biphenyl-2-sulfonamide
AQJXXSDUHOILFS-UHFFFAOYSA-N
4''-Isobutyl-2''-propylamino-biphenyl-2-sulfonic acid (3,4-dimethyl-isoxazol-5-yl)-amide
SCHEMBL6769898
BDBM50068677
[ Show all ]
Inchi KeyAQJXXSDUHOILFS-UHFFFAOYSA-N
Inchi IDInChI=1S/C24H31N3O3S/c1-6-13-25-22-15-19(14-16(2)3)11-12-20(22)21-9-7-8-10-23(21)31(28,29)27-24-17(4)18(5)26-30-24/h7-12,15-16,25,27H,6,13-14H2,1-5H3
PubChem CID10599293
ChEMBLCHEMBL146845
IUPHARN/A
BindingDB50068677
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
11839Endothelin receptor type BP21451EdnrbRattus norvegicus (Rat)442
11838Endothelin-1 receptorP25101EDNRAHomo sapiens (Human)427
11840Endothelin-1 receptorP26684EdnraRattus norvegicus (Rat)426

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