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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	CHEMBL3325626
Molecular formula	C27H28N4O4
IUPAC name	2-[3-[[4-(4-butanoyl-5-methylpyrazol-1-yl)phenyl]carbamoyl]-4,5-dimethylindol-1-yl]acetic acid
Molecular weight	472.545
Hydrogen bond acceptor	5
Hydrogen bond donor	2
XlogP	4.1
Synonyms	BDBM50100266
Inchi Key	BBSQELVBWDFXFL-UHFFFAOYSA-N
Inchi ID	InChI=1S/C27H28N4O4/c1-5-6-24(32)21-13-28-31(18(21)4)20-10-8-19(9-11-20)29-27(35)22-14-30(15-25(33)34)23-12-7-16(2)17(3)26(22)23/h7-14H,5-6,15H2,1-4H3,(H,29,35)(H,33,34)
PubChem CID	118711065
ChEMBL	CHEMBL3325626
IUPHAR	N/A
BindingDB	50100266
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
442436	P2Y purinoceptor 12	Q9H244	P2RY12	Homo sapiens (Human)	342
442437	P2Y purinoceptor 12	Q9EPX4	P2ry12	Rattus norvegicus (Rat)	343

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