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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	CHEMBL252319
Molecular formula	C13H21NO2
IUPAC name	(2S)-1-(3-methylphenoxy)-3-(propan-2-ylamino)propan-2-ol
Molecular weight	223.316
Hydrogen bond acceptor	3
Hydrogen bond donor	2
XlogP	1.9
Synonyms	(S)-1-(isopropylamino)-3-(m-tolyloxy)propan-2-ol ((2S)-toliprolol) ZINC2033145 BDBM50241366 SCHEMBL79268 (S)-Toliprolol (S)-1-(isopropylamino)-3-(m-tolyloxy)propan-2-ol UNII-DCP58J201D component NXQMNKUGGYNLBY-LBPRGKRZSA-N [ Show all ]
Inchi Key	NXQMNKUGGYNLBY-LBPRGKRZSA-N
Inchi ID	InChI=1S/C13H21NO2/c1-10(2)14-8-12(15)9-16-13-6-4-5-11(3)7-13/h4-7,10,12,14-15H,8-9H2,1-3H3/t12-/m0/s1
PubChem CID	12179890
ChEMBL	CHEMBL252319
IUPHAR	N/A
BindingDB	50241366
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
234587	Beta-1 adrenergic receptor	P08588	ADRB1	Homo sapiens (Human)	477
234588	Beta-2 adrenergic receptor	Q28044	ADRB2	Bos taurus (Bovine)	418
234589	Beta-2 adrenergic receptor	P07550	ADRB2	Homo sapiens (Human)	413
234590	Beta-2 adrenergic receptor	Q8K4Z4	Adrb2	Cavia porcellus (Guinea pig)	418

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