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Ligand

NameCHEMBL3793892
Molecular formulaC20H22ClNO5S
IUPAC name2-[(2R,4aR,5S,6R,7aS)-5-[(4-chloro-3-methylphenoxy)methyl]-6-hydroxy-2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyran-2-yl]-1,3-thiazole-4-carboxylic acid
Molecular weight423.908
Hydrogen bond acceptor7
Hydrogen bond donor2
XlogP3.8
SynonymsSCHEMBL17059652
BDBM50156539
Inchi KeyGZTLLBIEEIZFFD-BSPHMWTBSA-N
Inchi IDInChI=1S/C20H22ClNO5S/c1-10-6-11(2-4-14(10)21)26-8-13-12-3-5-17(27-18(12)7-16(13)23)19-22-15(9-28-19)20(24)25/h2,4,6,9,12-13,16-18,23H,3,5,7-8H2,1H3,(H,24,25)/t12-,13-,16-,17-,18+/m1/s1
PubChem CID118352160
ChEMBLCHEMBL3793892
IUPHARN/A
BindingDB50156539
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: 6
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
524697Prostacyclin receptorP43119PTGIRHomo sapiens (Human)386
524694Prostaglandin E2 receptor EP1 subtypeP34995PTGER1Homo sapiens (Human)402
524695Prostaglandin E2 receptor EP2 subtypeP43116PTGER2Homo sapiens (Human)358
524699Prostaglandin E2 receptor EP3 subtypeP43115PTGER3Homo sapiens (Human)390
524696Prostaglandin E2 receptor EP4 subtypeP35408PTGER4Homo sapiens (Human)488
524698Prostaglandin F2-alpha receptorP43088PTGFRHomo sapiens (Human)359

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