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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	CHEMBL42267
Molecular formula	C20H29N3O4
IUPAC name	1-(dicyclopropylmethylideneamino)oxy-3-[4-(2-methyl-2-nitropropyl)anilino]propan-2-ol
Molecular weight	375.469
Hydrogen bond acceptor	6
Hydrogen bond donor	2
XlogP	3.2
Synonyms	Dicyclopropyl ketone O-[2-hydroxy-3-[[4-(2-methyl-2-nitropropyl)phenyl]amino]propyl]oxime Dicyclopropyl-methanone O-{2-hydroxy-3-[4-(2-methyl-2-nitro-propyl)-phenylamino]-propyl}-oxime BDBM50064220
Inchi Key	LAYFYVAWRJMLET-UHFFFAOYSA-N
Inchi ID	InChI=1S/C20H29N3O4/c1-20(2,23(25)26)11-14-3-9-17(10-4-14)21-12-18(24)13-27-22-19(15-5-6-15)16-7-8-16/h3-4,9-10,15-16,18,21,24H,5-8,11-13H2,1-2H3
PubChem CID	10549600
ChEMBL	CHEMBL42267
IUPHAR	N/A
BindingDB	50064220
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
182958	Beta-2 adrenergic receptor	P54833	ADRB2	Canis lupus familiaris (Dog)	415

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