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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	CHEMBL568567
Molecular formula	C19H23F3N6O4S
IUPAC name	3-[[6-ethyl-4-[4-(3,3,3-trifluoropropanoyl)piperazin-1-yl]thieno[2,3-d]pyrimidin-2-yl]carbamoylamino]propanoic acid
Molecular weight	488.486
Hydrogen bond acceptor	11
Hydrogen bond donor	3
XlogP	2.0
Synonyms	SCHEMBL4922588 BDBM50302442 3-(3-(6-ethyl-4-(4-(3,3,3-trifluoropropanoyl)piperazin-1-yl)thieno[2,3-d]pyrimidin-2-yl)ureido)propanoic acid BNUMOPVPBJTHOS-UHFFFAOYSA-N N-[({6-Ethyl-4-[4-(3,3,3-trifluoropropanoyl)piperazin-1-yl]thieno[2,3-d]pyrimidin-2-yl}amino)carbonyl]-beta-alanine
Inchi Key	BNUMOPVPBJTHOS-UHFFFAOYSA-N
Inchi ID	InChI=1S/C19H23F3N6O4S/c1-2-11-9-12-15(28-7-5-27(6-8-28)13(29)10-19(20,21)22)24-17(25-16(12)33-11)26-18(32)23-4-3-14(30)31/h9H,2-8,10H2,1H3,(H,30,31)(H2,23,24,25,26,32)
PubChem CID	11950328
ChEMBL	CHEMBL568567
IUPHAR	N/A
BindingDB	50302442
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand has more than 10 hydrogen bond acceptor.

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
28457	P2Y purinoceptor 12	Q9H244	P2RY12	Homo sapiens (Human)	342

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