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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	MLS000573994
Molecular formula	C21H16ClN3O3S
IUPAC name	N-[4-[[(E)-3-(4-chlorophenyl)prop-2-enoyl]carbamothioylamino]phenyl]furan-2-carboxamide
Molecular weight	425.887
Hydrogen bond acceptor	4
Hydrogen bond donor	3
XlogP	4.8
Synonyms	N-[4-[[(E)-3-(4-chlorophenyl)prop-2-enoyl]carbamothioylamino]phenyl]furan-2-carboxamide HMS2557B03 SMR000195581 AKOS003247758 N-[4-({[(2E)-3-(4-chlorophenyl)prop-2-enoyl]carbamothioyl}amino)phenyl]furan-2-carboxamide CHEMBL1432794 N-[4-[[[[(E)-3-(4-chlorophenyl)-1-oxoprop-2-enyl]amino]-sulfanylidenemethyl]amino]phenyl]-2-furancarboxamide STK129504 BDBM42053 N-[4-[[(E)-3-(4-chlorophenyl)acryloyl]thiocarbamoylamino]phenyl]-2-furamide cid_1345012 N-{4-[({[3-(4-chlorophenyl)acryloyl]amino}carbonothioyl)amino]phenyl}-2-furamide AC1LQ8SX MolPort-002-210-685 ZINC1181280 [ Show all ]
Inchi Key	AQWYIXYGJTWAGV-LFYBBSHMSA-N
Inchi ID	InChI=1S/C21H16ClN3O3S/c22-15-6-3-14(4-7-15)5-12-19(26)25-21(29)24-17-10-8-16(9-11-17)23-20(27)18-2-1-13-28-18/h1-13H,(H,23,27)(H2,24,25,26,29)/b12-5+
PubChem CID	1345012
ChEMBL	CHEMBL1432794
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
12163	Galanin receptor type 2	O43603	GALR2	Homo sapiens (Human)	387
12164	Glucagon-like peptide 1 receptor	P43220	GLP1R	Homo sapiens (Human)	463

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