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Ligand

NameSCHEMBL173062
Molecular formulaC26H22F3N3O
IUPAC name1-(2,3,5,10,11,11a-hexahydro-1H-indolizino[7,6-b]indol-8-yl)-4-[4-(trifluoromethyl)phenyl]pyridin-2-one
Molecular weight449.477
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP4.6
SynonymsCHEMBL3675308
BDBM109821
US8618299, 39
Inchi KeyANFXZTQTWZJBEG-UHFFFAOYSA-N
Inchi IDInChI=1S/C26H22F3N3O/c27-26(28,29)18-5-3-16(4-6-18)17-9-11-32(25(33)12-17)20-7-8-21-22-15-31-10-1-2-19(31)13-24(22)30-23(21)14-20/h3-9,11-12,14,19,30H,1-2,10,13,15H2
PubChem CID49868780
ChEMBLCHEMBL3675308
IUPHARN/A
BindingDB109821
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
9523Melanin-concentrating hormone receptor 1Q99705MCHR1Homo sapiens (Human)422

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