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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	MLS000556448
Molecular formula	C21H19N3O3S2
IUPAC name	methyl 7-acetyl-8-methyl-4,9-diphenyl-1,6-dithia-3,4,9-triazaspiro[4.4]nona-2,7-diene-2-carboxylate
Molecular weight	425.521
Hydrogen bond acceptor	8
Hydrogen bond donor	0
XlogP	5.5
Synonyms	524033-23-6 BDBM89906 methyl 7-acetyl-8-methyl-4,9-diphenyl-1,6-dithia-3,4,9-triazaspiro[4.4]nona-2,7-diene-2-carboxylate 7-acetyl-8-methyl-3-methoxycarbonyl-1,9-diphenyl-4,6-dithia-1,2,9-triazaspiro[4.4]nona-2,7-diene cid_3316814 MLS002582233 AKOS001698192 methyl 3-acetyl-2-methyl-1,6-diphenyl-4,9-dithia-1,6,7-triazaspiro[4.4]nona-2,7-diene-8-carboxylate STK865597 7-Acetyl-8-methyl-1,9-diphenyl-4,6-dithia-1,2,9-triaza-spiro[4.4]nona-2,7-diene-3-carboxylic acid methyl ester methyl 7-ethanoyl-8-methyl-4,9-diphenyl-1,6-dithia-3,4,9-triazaspiro[4.4]nona-2,7-diene-2-carboxylate 7-acetyl-8-methyl-4,9-diphenyl-1,6-dithia-3,4,9-triazaspiro[4.4]nona-2,7-diene-2-carboxylic acid methyl ester HMS2374O19 MolPort-000-745-444 AKOS022007849 methyl 7-acetyl-8-methyl-1,9-diphenyl-4,6-dithia-1,2,9-triazaspiro[4.4]nona-2,7-diene-3-carboxylate 7-Acetyl-8-methyl-1,9-diphenyl-4,6-dithia-1,2,9-triaza-spiro[4.4]nona-2,7-diene-3-carboxylic acid methyl ester CHEMBL1442604 AC1MO9K9 MCULE-3509623278 SMR000147765 [ Show all ]
Inchi Key	AGRJDWBLNSSGEW-UHFFFAOYSA-N
Inchi ID	InChI=1S/C21H19N3O3S2/c1-14-18(15(2)25)28-21(23(14)16-10-6-4-7-11-16)24(17-12-8-5-9-13-17)22-19(29-21)20(26)27-3/h4-13H,1-3H3
PubChem CID	3316814
ChEMBL	CHEMBL1442604
IUPHAR	N/A
BindingDB	N/A
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
5143	Glucagon-like peptide 1 receptor	P43220	GLP1R	Homo sapiens (Human)	463
5142	Neuropeptide S receptor	Q6W5P4	NPSR1	Homo sapiens (Human)	371

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