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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	MLS001174708
Molecular formula	C12H9Br2NOS
IUPAC name	2-(4-bromoanilino)-1-(5-bromothiophen-2-yl)ethanone
Molecular weight	375.078
Hydrogen bond acceptor	3
Hydrogen bond donor	1
XlogP	5.0
Synonyms	2-(4-bromoanilino)-1-(5-bromo-2-thiophenyl)ethanone Z56881135 HMS2905N11 1-(5-bromanylthiophen-2-yl)-2-[(4-bromophenyl)amino]ethanone AKOS034463585 MolPort-004-013-399 2-(4-bromoanilino)-1-(5-bromothiophen-2-yl)ethanone CHEMBL1582697 ZINC5656689 726154-69-4 MCULE-1352947160 2-(4-bromoanilino)-1-(5-bromo-2-thienyl)ethanone BDBM67346 SMR000596301 2-[(4-bromophenyl)amino]-1-(5-bromothiophen-2-yl)ethan-1-one cid_3648468 AC1MUXFC [ Show all ]
Inchi Key	BZTSWLAROITJSP-UHFFFAOYSA-N
Inchi ID	InChI=1S/C12H9Br2NOS/c13-8-1-3-9(4-2-8)15-7-10(16)11-5-6-12(14)17-11/h1-6,15H,7H2
PubChem CID	3648468
ChEMBL	CHEMBL1582697
IUPHAR	N/A
BindingDB	67346
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
36774	Apelin receptor	P35414	APLNR	Homo sapiens (Human)	380
36775	Type-1 angiotensin II receptor	P30556	AGTR1	Homo sapiens (Human)	359

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