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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	CHEMBL3318845
Molecular formula	C23H25ClFNO3
IUPAC name	[4-(4-chlorophenyl)-1-[4-(4-fluorophenyl)-4-oxobutyl]piperidin-4-yl] acetate
Molecular weight	417.905
Hydrogen bond acceptor	5
Hydrogen bond donor	0
XlogP	3.8
Synonyms	BDBM50053390 DQMKFVKNNDMGTA-UHFFFAOYSA-N 4-(4-Acetoxy-4-(4-chlorophenyl)-1-piperidinyl)-1-(4-fluorophenyl)-1-butanone SCHEMBL8986083
Inchi Key	DQMKFVKNNDMGTA-UHFFFAOYSA-N
Inchi ID	InChI=1S/C23H25ClFNO3/c1-17(27)29-23(19-6-8-20(24)9-7-19)12-15-26(16-13-23)14-2-3-22(28)18-4-10-21(25)11-5-18/h4-11H,2-3,12-16H2,1H3
PubChem CID	23364995
ChEMBL	CHEMBL3318845
IUPHAR	N/A
BindingDB	50053390
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
444305	D(1A) dopamine receptor	P50130	DRD1	Sus scrofa (Pig)	446
444302	D(2) dopamine receptor	P14416	DRD2	Homo sapiens (Human)	443
444304	D(3) dopamine receptor	P35462	DRD3	Homo sapiens (Human)	400
444303	D(4) dopamine receptor	P21917	DRD4	Homo sapiens (Human)	467

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