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Ligand

NameSCHEMBL14321291
Molecular formulaC21H22ClNO4S
IUPAC name4-chloro-N-[2-[3-[(2-hydroxy-3-methyl-4-oxocyclopent-2-en-1-yl)methyl]phenyl]ethyl]benzenesulfonamide
Molecular weight419.92
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogP3.6
SynonymsN/A
Inchi KeyQUMBJRZRFUYUMM-UHFFFAOYSA-N
Inchi IDInChI=1S/C21H22ClNO4S/c1-14-20(24)13-17(21(14)25)12-16-4-2-3-15(11-16)9-10-23-28(26,27)19-7-5-18(22)6-8-19/h2-8,11,17,23,25H,9-10,12-13H2,1H3
PubChem CID54669848
ChEMBLCHEMBL1829806
IUPHARN/A
BindingDBN/A
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
287140Thromboxane A2 receptorP21731TBXA2RHomo sapiens (Human)343
287141Thromboxane A2 receptorP30987Tbxa2rMus musculus (Mouse)341

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