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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	SCHEMBL289923
Molecular formula	C29H30F2N2O2
IUPAC name	1-benzyl-N-[(3,4-difluorophenyl)methyl]-2-propan-2-yl-6-propoxyindole-3-carboxamide
Molecular weight	476.568
Hydrogen bond acceptor	4
Hydrogen bond donor	1
XlogP	6.6
Synonyms	1-Benzyl-N-(3,4-difluorobenzyl)-2-isopropyl-6-propoxy-1H-indole-3-carboxamide US8563594, 169 BDBM101038 US8524917, 11 AFDUGVKJXKJJMO-UHFFFAOYSA-N CHEMBL3651714 [ Show all ]
Inchi Key	AFDUGVKJXKJJMO-UHFFFAOYSA-N
Inchi ID	InChI=1S/C29H30F2N2O2/c1-4-14-35-22-11-12-23-26(16-22)33(18-20-8-6-5-7-9-20)28(19(2)3)27(23)29(34)32-17-21-10-13-24(30)25(31)15-21/h5-13,15-16,19H,4,14,17-18H2,1-3H3,(H,32,34)
PubChem CID	25059488
ChEMBL	CHEMBL3651714
IUPHAR	N/A
BindingDB	101038
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand has a partition coefficient log P greater than 5.

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
4069	Sphingosine 1-phosphate receptor 3	Q99500	S1PR3	Homo sapiens (Human)	378

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