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GLASS

You can:

Check the ligand table for details.
Go to the GPCR list to see GPCRs with which this ligand interacts.
Go to the individual GPCR page for PubMed ID information by text mining.
Download a TSV version of all interaction data.
Go back to previous page.

Ligand

Name	CHEMBL210578
Molecular formula	C23H25ClFNO2
IUPAC name	4-[3-(4-chlorophenyl)-3-hydroxy-8-azabicyclo[3.2.1]octan-8-yl]-1-(4-fluorophenyl)butan-1-one
Molecular weight	401.906
Hydrogen bond acceptor	4
Hydrogen bond donor	1
XlogP	4.4
Synonyms	4-(3-(4-chlorophenyl)-3-hydroxy-8-aza-bicyclo[3.2.1]octan-8-yl)-1-(4-fluorophenyl)butan-1-one 4-[3-(4-Chloro-phenyl)-3-hydroxy-8-aza-bicyclo[3.2.1]oct-8-yl]-1-(4-fluoro-phenyl)-butan-1-one BDBM50185473 SCHEMBL9050578 4-[3-(4-Chlorophenyl)-3-hydroxy-8-azabicyclo[3.2.1]oct-8-yl]-1-(4-fluorophenyl)butan-1-one
Inchi Key	CXQUOFVDYCOSEZ-UHFFFAOYSA-N
Inchi ID	InChI=1S/C23H25ClFNO2/c24-18-7-5-17(6-8-18)23(28)14-20-11-12-21(15-23)26(20)13-1-2-22(27)16-3-9-19(25)10-4-16/h3-10,20-21,28H,1-2,11-15H2
PubChem CID	13091268
ChEMBL	CHEMBL210578
IUPHAR	N/A
BindingDB	50185473
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Known GPCRs

You can:

Click GLASS IDs to check the association information.
Click protein names to check details of the GPCRs.
Download a TSV version of all interaction information.

GLASS ID	Name	UniProt	Gene	Species	Length
53041	5-hydroxytryptamine receptor 1A	P08908	HTR1A	Homo sapiens (Human)	422
53039	5-hydroxytryptamine receptor 2A	P28223	HTR2A	Homo sapiens (Human)	471
53046	5-hydroxytryptamine receptor 2C	P28335	HTR2C	Homo sapiens (Human)	458
443823	5-hydroxytryptamine receptor 2C	P08909	Htr2c	Rattus norvegicus (Rat)	460
53047	Alpha-1A adrenergic receptor	P35348	ADRA1A	Homo sapiens (Human)	466
53036	Alpha-1B adrenergic receptor	P35368	ADRA1B	Homo sapiens (Human)	520
53044	Alpha-2A adrenergic receptor	P08913	ADRA2A	Homo sapiens (Human)	450
53043	Alpha-2B adrenergic receptor	P18089	ADRA2B	Homo sapiens (Human)	450
53040	Alpha-2C adrenergic receptor	P18825	ADRA2C	Homo sapiens (Human)	462
53042	D(2) dopamine receptor	P14416	DRD2	Homo sapiens (Human)	443
53038	D(3) dopamine receptor	P35462	DRD3	Homo sapiens (Human)	400
53037	D(4) dopamine receptor	P21917	DRD4	Homo sapiens (Human)	467
443822	D(4) dopamine receptor	P30729	Drd4	Rattus norvegicus (Rat)	387
53045	Histamine H1 receptor	P35367	HRH1	Homo sapiens (Human)	487

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