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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	CHEMBL538977
Molecular formula	C23H26N4O3
IUPAC name	3-(3-nitrophenyl)-5-[4-(4-phenylpiperazin-1-yl)butyl]-1,2-oxazole
Molecular weight	406.486
Hydrogen bond acceptor	6
Hydrogen bond donor	0
XlogP	4.5
Synonyms	CHEMBL1189537 1-{4-[3-(3-Nitro-phenyl)-isoxazol-5-yl]-butyl}-4-phenyl-piperazine; hydrochloride BDBM50112798 SCHEMBL6768248 3-(3-Nitrophenyl)-5-[4-(4-phenylpiperazino)butyl]isoxazole
Inchi Key	AFTMDSQMJPSVNL-UHFFFAOYSA-N
Inchi ID	InChI=1S/C23H26N4O3/c28-27(29)21-10-6-7-19(17-21)23-18-22(30-24-23)11-4-5-12-25-13-15-26(16-14-25)20-8-2-1-3-9-20/h1-3,6-10,17-18H,4-5,11-16H2
PubChem CID	22727351
ChEMBL	N/A
IUPHAR	N/A
BindingDB	50112798
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
4476	D(2) dopamine receptor	P14416	DRD2	Homo sapiens (Human)	443
4477	D(3) dopamine receptor	P35462	DRD3	Homo sapiens (Human)	400
4478	D(4) dopamine receptor	P21917	DRD4	Homo sapiens (Human)	467

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