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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	CHEMBL3921763
Molecular formula	C26H29F3N6O2
IUPAC name	ethyl 2-[(2R)-4-(6-benzyl-4,5-dimethylpyridazin-3-yl)-2-methylpiperazin-1-yl]-4-(trifluoromethyl)pyrimidine-5-carboxylate
Molecular weight	514.553
Hydrogen bond acceptor	11
Hydrogen bond donor	0
XlogP	4.8
Synonyms	SCHEMBL13491045
Inchi Key	BIAMMLFBGSGNNO-MRXNPFEDSA-N
Inchi ID	InChI=1S/C26H29F3N6O2/c1-5-37-24(36)20-14-30-25(31-22(20)26(27,28)29)35-12-11-34(15-16(35)2)23-18(4)17(3)21(32-33-23)13-19-9-7-6-8-10-19/h6-10,14,16H,5,11-13,15H2,1-4H3/t16-/m1/s1
PubChem CID	59191545
ChEMBL	CHEMBL3921763
IUPHAR	N/A
BindingDB	N/A
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand has more than 10 hydrogen bond acceptor. This ligand is heavier than 500 daltons.

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
536606	Smoothened homolog	Q99835	SMO	Homo sapiens (Human)	787
536607	Smoothened homolog	P56726	Smo	Mus musculus (Mouse)	793

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