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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	MLS001124504
Molecular formula	C20H21N5O3S
IUPAC name	N-[(3-methoxyphenyl)methyl]-4-(8-methyl-7-oxo-5-thia-1,8,10,11-tetrazatricyclo[7.3.0.02,6]dodeca-2(6),3,9,11-tetraen-12-yl)butanamide
Molecular weight	411.48
Hydrogen bond acceptor	6
Hydrogen bond donor	1
XlogP	1.9
Synonyms	AKOS001914664 SMR000628766 HMS2958K24 AB00686268-01 MolPort-003-071-425 STL135076 MCULE-8586995189 AB00686268-07 N-(3-methoxybenzyl)-4-(4-methyl-5-oxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)butanamide CHEMBL1419486 ZINC4315770 [ Show all ]
Inchi Key	ANONTZHMMVITKZ-UHFFFAOYSA-N
Inchi ID	InChI=1S/C20H21N5O3S/c1-24-19(27)18-15(9-10-29-18)25-16(22-23-20(24)25)7-4-8-17(26)21-12-13-5-3-6-14(11-13)28-2/h3,5-6,9-11H,4,7-8,12H2,1-2H3,(H,21,26)
PubChem CID	7184635
ChEMBL	CHEMBL1419486
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
9734	Relaxin receptor 1	Q9HBX9	RXFP1	Homo sapiens (Human)	757

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