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Ligand

NameCHEMBL3639647
Molecular formulaC28H25ClF3N3O4
IUPAC name4-[8-[[5-chloro-4-methyl-2-[6-(trifluoromethyl)pyridin-3-yl]phenyl]methyl]-2-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl]benzoic acid
Molecular weight559.97
Hydrogen bond acceptor9
Hydrogen bond donor1
XlogP3.1
SynonymsBDBM123262
SCHEMBL14957225
US8742110, 4-26
Inchi KeyBZCPGJIAGXBLMC-UHFFFAOYSA-N
Inchi IDInChI=1S/C28H25ClF3N3O4/c1-17-12-22(19-4-7-24(33-14-19)28(30,31)32)20(13-23(17)29)15-34-10-8-27(9-11-34)16-35(26(38)39-27)21-5-2-18(3-6-21)25(36)37/h2-7,12-14H,8-11,15-16H2,1H3,(H,36,37)
PubChem CID86766064
ChEMBLCHEMBL3639647
IUPHARN/A
BindingDB123262
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 1
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GLASS IDNameUniProtGeneSpeciesLength
36324Somatostatin receptor type 5P35346SSTR5Homo sapiens (Human)364

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