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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	MLS000679816
Molecular formula	C19H21N3O2S
IUPAC name	2,2-dimethyl-N-[[(4-phenylbenzoyl)amino]carbamothioyl]propanamide
Molecular weight	355.456
Hydrogen bond acceptor	3
Hydrogen bond donor	3
XlogP	4.5
Synonyms	ARONIS009518 KSC-8-153 STL064255 2,2-dimethyl-N-[[(4-phenylphenyl)carbonylamino]carbamothioyl]propanamide AC1M3EY4 HMS2764J05 N-{[2-(biphenyl-4-ylcarbonyl)hydrazinyl]carbonothioyl}-2,2-dimethylpropanamide 2,2-dimethyl-N-[[(4-phenylbenzoyl)amino]carbamothioyl]propanamide BB0286495 KUC105332N ZINC2884325 2,2-dimethyl-N-[[[oxo-(4-phenylphenyl)methyl]hydrazo]-sulfanylidenemethyl]propanamide CHEMBL1377849 MolPort-001-593-609 AKOS000498970 KS-0000413X SMR000296652 2,2-dimethyl-N-[[(4-phenylbenzoyl)amino]thiocarbamoyl]propionamide BDBM65328 MCULE-7389736999 cid_2236648 N-{[2-(4-biphenylylcarbonyl)hydrazino]carbonothioyl}-2,2-dimethylpropanamide [ Show all ]
Inchi Key	BQQVOJSHHJPMKP-UHFFFAOYSA-N
Inchi ID	InChI=1S/C19H21N3O2S/c1-19(2,3)17(24)20-18(25)22-21-16(23)15-11-9-14(10-12-15)13-7-5-4-6-8-13/h4-12H,1-3H3,(H,21,23)(H2,20,22,24,25)
PubChem CID	2236648
ChEMBL	CHEMBL1377849
IUPHAR	N/A
BindingDB	65328
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
30567	Apelin receptor	P35414	APLNR	Homo sapiens (Human)	380
30569	Glucagon-like peptide 1 receptor	P43220	GLP1R	Homo sapiens (Human)	463
30568	Type-1 angiotensin II receptor	P30556	AGTR1	Homo sapiens (Human)	359

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