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Ligand

NameCHEMBL2181251
Molecular formulaC20H15Cl2N3O2
IUPAC name[4-(2,5-dichlorophenoxy)pyrimidin-5-yl]-(3,4-dihydro-2H-quinolin-1-yl)methanone
Molecular weight400.259
Hydrogen bond acceptor4
Hydrogen bond donor0
XlogP4.7
SynonymsFGKIZYHSOOCLGM-UHFFFAOYSA-N
SCHEMBL2219134
[4-(2,5-Dichloro-phenoxy)-pyrimidin-5-yl]-(3,4-dihydro-2H-quinolin-1-yl)-methanone
BDBM50399945
Inchi KeyFGKIZYHSOOCLGM-UHFFFAOYSA-N
Inchi IDInChI=1S/C20H15Cl2N3O2/c21-14-7-8-16(22)18(10-14)27-19-15(11-23-12-24-19)20(26)25-9-3-5-13-4-1-2-6-17(13)25/h1-2,4,6-8,10-12H,3,5,9H2
PubChem CID53311618
ChEMBLCHEMBL2181251
IUPHARN/A
BindingDB50399945
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
77842G-protein coupled bile acid receptor 1Q8TDU6GPBAR1Homo sapiens (Human)330

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