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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	AC1LT9RX
Molecular formula	C18H17N3O6S
IUPAC name	2-[(5E)-5-[(3,4-dimethoxyphenyl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]-N-(5-methyl-1,2-oxazol-3-yl)acetamide
Molecular weight	403.409
Hydrogen bond acceptor	8
Hydrogen bond donor	1
XlogP	2.4
Synonyms	BIM-0005699.P001 SMSF0006804 2-[(5E)-5-[(3,4-dimethoxyphenyl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]-N-(5-methyl-1,2-oxazol-3-yl)acetamide CHEMBL1393166 MolPort-000-658-702 CB07945 ZINC13483102 2-[5-(3,4-Dimethoxy-benzylidene)-2,4-dioxo-thiazolidin-3-yl]-N-(5-methyl-isoxazo HMS590F03 AKOS001613583 SMR000186760 2-[5-(3,4-dimethoxybenzylidene)-2,4-dioxo-1,3-thiazolidin-3-yl]-N-(5-methyl-3-isoxazolyl)acetamide MLS000579173 [ Show all ]
Inchi Key	CWFHKAXLHFBLGL-RIYZIHGNSA-N
Inchi ID	InChI=1S/C18H17N3O6S/c1-10-6-15(20-27-10)19-16(22)9-21-17(23)14(28-18(21)24)8-11-4-5-12(25-2)13(7-11)26-3/h4-8H,9H2,1-3H3,(H,19,20,22)/b14-8+
PubChem CID	1554642
ChEMBL	CHEMBL1393166
IUPHAR	N/A
BindingDB	N/A
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
52053	Neuropeptide S receptor	Q6W5P4	NPSR1	Homo sapiens (Human)	371
52052	Relaxin receptor 1	Q9HBX9	RXFP1	Homo sapiens (Human)	757
52055	Relaxin receptor 2	Q8WXD0	RXFP2	Homo sapiens (Human)	754
52054	Vasopressin V1b receptor	P47901	AVPR1B	Homo sapiens (Human)	424

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