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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	MLS000570530
Molecular formula	C18H15BrN2O4
IUPAC name	(Z)-3-(3-bromo-5-ethoxy-4-hydroxyphenyl)-2-cyano-N-(4-hydroxyphenyl)prop-2-enamide
Molecular weight	403.232
Hydrogen bond acceptor	5
Hydrogen bond donor	3
XlogP	4.0
Synonyms	AC1LOV5J SMR000186956 (Z)-3-(3-bromanyl-5-ethoxy-4-oxidanyl-phenyl)-2-cyano-N-(4-hydroxyphenyl)prop-2-enamide CHEMBL1460225 ST032659 (Z)-3-(3-bromo-5-ethoxy-4-hydroxyphenyl)-2-cyano-N-(4-hydroxyphenyl)prop-2-enamide BDBM39789 SR-01000218400 (Z)-3-(3-bromo-5-ethoxy-4-hydroxy-phenyl)-2-cyano-N-(4-hydroxyphenyl)acrylamide cid_1271399 ZINC13482118 3-(3-bromo-5-ethoxy-4-hydroxyphenyl)-2-cyano-N-(4-hydroxyphenyl)acrylamide MolPort-002-165-328 (2Z)-3-(3-bromo-5-ethoxy-4-hydroxyphenyl)-2-cyano-N-(4-hydroxyphenyl)prop-2-en amide SR-01000218400-1 (Z)-3-(3-bromo-5-ethoxy-4-hydroxyphenyl)-2-cyano-N-(4-hydroxyphenyl)-2-propenamide HMS2187H07 [ Show all ]
Inchi Key	HMRRSRJGYODNQI-GHXNOFRVSA-N
Inchi ID	InChI=1S/C18H15BrN2O4/c1-2-25-16-9-11(8-15(19)17(16)23)7-12(10-20)18(24)21-13-3-5-14(22)6-4-13/h3-9,22-23H,2H2,1H3,(H,21,24)/b12-7-
PubChem CID	1271399
ChEMBL	CHEMBL1460225
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
118878	Thyrotropin-releasing hormone receptor	P34981	TRHR	Homo sapiens (Human)	398

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