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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	MLS001236764
Molecular formula	C17H16FN3O3S2
IUPAC name	2-[(7-fluoro-1,1-dioxo-4H-1lambda6,2,4-benzothiadiazin-3-yl)sulfanyl]-N-(2-phenylethyl)acetamide
Molecular weight	393.451
Hydrogen bond acceptor	6
Hydrogen bond donor	2
XlogP	2.9
Synonyms	886956-45-2 F2700-0337 2-((7-fluoro-1,1-dioxido-4H-benzo[e][1,2,4]thiadiazin-3-yl)thio)-N-phenethylacetamide AKOS024671638 2-[(7-fluoro-1,1-dioxo-4H-1,2,4-benzothiadiazin-3-yl)thio]-N-(2-phenylethyl)acetamide CHEMBL1434899 ZINC4853684 HMS3016O20 2-[(7-fluoro-1,1-diketo-4H-1,2,4-benzothiadiazin-3-yl)thio]-N-phenethyl-acetamide BDBM96795 MolPort-003-154-188 2-[[7-fluoranyl-1,1-bis(oxidanylidene)-4H-1,2,4-benzothiadiazin-3-yl]sulfanyl]-N-(2-phenylethyl)ethanamide cid_7386906 AC1OKID8 MCULE-3088537948 2-[(7-fluoro-1,1-dioxo-4H-1,2,4-benzothiadiazin-3-yl)sulfanyl]-N-(2-phenylethyl)acetamide SMR000812599 [ Show all ]
Inchi Key	ADBVETNOWQEIHW-UHFFFAOYSA-N
Inchi ID	InChI=1S/C17H16FN3O3S2/c18-13-6-7-14-15(10-13)26(23,24)21-17(20-14)25-11-16(22)19-9-8-12-4-2-1-3-5-12/h1-7,10H,8-9,11H2,(H,19,22)(H,20,21)
PubChem CID	7386906
ChEMBL	CHEMBL1434899
IUPHAR	N/A
BindingDB	96795
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
2114	Trace amine-associated receptor 1	Q96RJ0	TAAR1	Homo sapiens (Human)	339

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