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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	2-{1-[(4-methoxyphenyl)carbamothioyl]-3-oxopiperazin-2-yl}-N-(4-methylphenyl)acetamide
Molecular formula	C21H24N4O3S
IUPAC name	2-[1-[(4-methoxyphenyl)carbamothioyl]-3-oxopiperazin-2-yl]-N-(4-methylphenyl)acetamide
Molecular weight	412.508
Hydrogen bond acceptor	4
Hydrogen bond donor	3
XlogP	2.0
Synonyms	1009547-09-4 AKOS016302211 MLS000581392 2-[1-[(4-methoxyphenyl)carbamothioyl]-3-oxopiperazin-2-yl]-N-(4-methylphenyl)acetamide CBKinase1_019737 SR-01000278588 AC1MG8D9 HMS2563G16 STK167401 2-(1-{[(4-methoxyphenyl)amino]carbonothioyl}-3-oxo-2-piperazinyl)-N-(4-methylphenyl)acetamide BRD-A57762047-001-01-7 MolPort-000-472-795 2-{1-[(4-methoxyanilino)carbothioyl]-3-oxo-2-piperazinyl}-N-(4-methylphenyl)acetamide SR-01000278588-1 AKOS002234722 MCULE-6165280057 ZINC01121659 2-(1-{[(4-methoxyphenyl)amino]thioxomethyl}-3-oxopiperazin-2-yl)-N-(4-methylph enyl)acetamide CBKinase1_007337 SMR000200012 CHEMBL1587963 ST50107435 [ Show all ]
Inchi Key	AAMWVURKZMHDHP-UHFFFAOYSA-N
Inchi ID	InChI=1S/C21H24N4O3S/c1-14-3-5-15(6-4-14)23-19(26)13-18-20(27)22-11-12-25(18)21(29)24-16-7-9-17(28-2)10-8-16/h3-10,18H,11-13H2,1-2H3,(H,22,27)(H,23,26)(H,24,29)
PubChem CID	2957105
ChEMBL	CHEMBL1587963
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
350	Glucagon-like peptide 1 receptor	P43220	GLP1R	Homo sapiens (Human)	463

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