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Ligand

NameCHEMBL3986483
Molecular formulaC18H21ClF3NO4
IUPAC name2-[9-[2-chloro-5-(trifluoromethoxy)phenyl]-1-oxa-9-azaspiro[5.5]undecan-3-yl]acetic acid
Molecular weight407.814
Hydrogen bond acceptor8
Hydrogen bond donor1
XlogP4.3
Synonyms2-(9-(2-chloro-5-(trifluoromethoxy)phenyl)-1-oxa-9-azaspiro[5.5]undecan-3-yl)acetic acid
BDBM50208151
DIZADOFRCFKNSD-UHFFFAOYSA-N
SCHEMBL16466452
Inchi KeyDIZADOFRCFKNSD-UHFFFAOYSA-N
Inchi IDInChI=1S/C18H21ClF3NO4/c19-14-2-1-13(27-18(20,21)22)10-15(14)23-7-5-17(6-8-23)4-3-12(11-26-17)9-16(24)25/h1-2,10,12H,3-9,11H2,(H,24,25)
PubChem CID73776997
ChEMBLCHEMBL3986483
IUPHARN/A
BindingDB50208151
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
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GLASS IDNameUniProtGeneSpeciesLength
537470Free fatty acid receptor 4Q5NUL3FFAR4Homo sapiens (Human)377

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