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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	AC1N8RBE
Molecular formula	C19H21N5O5S2
IUPAC name	N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2-([1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanyl)acetamide
Molecular weight	463.527
Hydrogen bond acceptor	9
Hydrogen bond donor	1
XlogP	1.7
Synonyms	AB00594699-04 MolPort-004-278-604 SMR000368742 MCULE-2306083061 N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2-([1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanyl)acetamide CHEMBL1511455 Z20241457 790251-36-4 MLS001002212 AKOS033738121 N-[2-methoxy-5-(morpholine-4-sulfonyl)phenyl]-2-{[1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanyl}acetamide HMS2667H22 ZINC13138637 [ Show all ]
Inchi Key	ADNUYNVLOWBEJO-UHFFFAOYSA-N
Inchi ID	InChI=1S/C19H21N5O5S2/c1-28-16-6-5-14(31(26,27)23-8-10-29-11-9-23)12-15(16)20-18(25)13-30-19-22-21-17-4-2-3-7-24(17)19/h2-7,12H,8-11,13H2,1H3,(H,20,25)
PubChem CID	4299978
ChEMBL	CHEMBL1511455
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
2903	Relaxin receptor 1	Q9HBX9	RXFP1	Homo sapiens (Human)	757
2904	Relaxin receptor 2	Q8WXD0	RXFP2	Homo sapiens (Human)	754
2905	Vasopressin V1b receptor	P47901	AVPR1B	Homo sapiens (Human)	424

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