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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	CHEMBL3422015
Molecular formula	C23H23N5O2S
IUPAC name	[(8R)-8-methyl-3-(2-propan-2-yl-1,3-oxazol-4-yl)-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl]-(4-thiophen-2-ylphenyl)methanone
Molecular weight	433.53
Hydrogen bond acceptor	6
Hydrogen bond donor	0
XlogP	3.1
Synonyms	BDBM50081196 SCHEMBL16048085
Inchi Key	GYGRAOHPQAELJF-OAHLLOKOSA-N
Inchi ID	InChI=1S/C23H23N5O2S/c1-14(2)22-24-18(13-30-22)21-26-25-20-15(3)27(10-11-28(20)21)23(29)17-8-6-16(7-9-17)19-5-4-12-31-19/h4-9,12-15H,10-11H2,1-3H3/t15-/m1/s1
PubChem CID	90417914
ChEMBL	CHEMBL3422015
IUPHAR	N/A
BindingDB	50081196
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
445976	Kappa-type opioid receptor	P41145	OPRK1	Homo sapiens (Human)	380
445973	Neuromedin-K receptor	P29371	TACR3	Homo sapiens (Human)	465
445974	Neuromedin-K receptor	P16177	Tacr3	Rattus norvegicus (Rat)	452
445975	Substance-K receptor	P21452	TACR2	Homo sapiens (Human)	398
445972	Substance-P receptor	P25103	TACR1	Homo sapiens (Human)	407

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