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Ligand

NameCHEMBL3718508
Molecular formulaC22H29NO3S
IUPAC name(1S,2S)-N-[(1R)-2-hydroxy-1-[4-(2-methylpentoxy)phenyl]ethyl]-2-thiophen-2-ylcyclopropane-1-carboxamide
Molecular weight387.538
Hydrogen bond acceptor4
Hydrogen bond donor2
XlogP4.1
SynonymsFDGXWFLFJLMESD-FBOXXWIASA-N
SCHEMBL12195457
(1S,2S)-2-Thiophen-2-yl-cyclopropanecarboxylic acid {(R)-2-hydroxy-1-[4-(2-methyl-pentyloxy)-phenyl]-ethyl}-amide
Inchi KeyFDGXWFLFJLMESD-FBOXXWIASA-N
Inchi IDInChI=1S/C22H29NO3S/c1-3-5-15(2)14-26-17-9-7-16(8-10-17)20(13-24)23-22(25)19-12-18(19)21-6-4-11-27-21/h4,6-11,15,18-20,24H,3,5,12-14H2,1-2H3,(H,23,25)/t15?,18-,19-,20-/m0/s1
PubChem CID58459796
ChEMBLCHEMBL3718508
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: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
523757Probable G-protein coupled receptor 88Q9GZN0GPR88Homo sapiens (Human)384

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