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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	SMR000046229
Molecular formula	C14H17BrN2O2
IUPAC name	N-(5-bromo-1-butyl-2-oxo-3H-indol-3-yl)acetamide
Molecular weight	325.206
Hydrogen bond acceptor	2
Hydrogen bond donor	1
XlogP	2.3
Synonyms	CCG-121252 MolPort-002-626-825 cid_665257 N-(5-bromo-1-butyl-2-oxo-2,3-dihydro-1H-indol-3-yl)acetamide AKOS022011286 MLS-0016686.0001 N-(5-bromanyl-1-butyl-2-oxidanylidene-3H-indol-3-yl)ethanamide AC1LDDEK HMS2274C15 N-(5-bromo-1-butyl-2-oxo-3H-indol-3-yl)acetamide BDBM62063 MLS000083794 STK876248 1008069-41-7 CHEMBL1579263 N-(5-bromo-1-butyl-2-keto-indolin-3-yl)acetamide AKOS001710499 MCULE-3586567324 REGID_for_CID_665257 [ Show all ]
Inchi Key	CXCGQPLUFMSASL-UHFFFAOYSA-N
Inchi ID	InChI=1S/C14H17BrN2O2/c1-3-4-7-17-12-6-5-10(15)8-11(12)13(14(17)19)16-9(2)18/h5-6,8,13H,3-4,7H2,1-2H3,(H,16,18)
PubChem CID	665257
ChEMBL	CHEMBL1579263
IUPHAR	N/A
BindingDB	62063
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
52659	Melanin-concentrating hormone receptor 1	Q99705	MCHR1	Homo sapiens (Human)	422
52658	Neuropeptides B/W receptor type 1	P48145	NPBWR1	Homo sapiens (Human)	328
52657	Thyrotropin receptor	P16473	TSHR	Homo sapiens (Human)	764

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