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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	CHEMBL453047
Molecular formula	C27H31NO4
IUPAC name	4-[4-[2-[[(1R,2S)-1-hydroxy-1-phenylpropan-2-yl]amino]ethyl]phenyl]-2-propan-2-yloxybenzoic acid
Molecular weight	433.548
Hydrogen bond acceptor	5
Hydrogen bond donor	3
XlogP	2.7
Synonyms	BDBM50243342 SCHEMBL5703914 4-(2-{[(1S,2R)-2-Hydroxy-1-methyl-2-phenylethyl]amino}ethyl)-3-isopropoxy-4-biphenylcarboxylic acid
Inchi Key	WVYCDLWTGGHFDH-SIBVEZHUSA-N
Inchi ID	InChI=1S/C27H31NO4/c1-18(2)32-25-17-23(13-14-24(25)27(30)31)21-11-9-20(10-12-21)15-16-28-19(3)26(29)22-7-5-4-6-8-22/h4-14,17-19,26,28-29H,15-16H2,1-3H3,(H,30,31)/t19-,26-/m0/s1
PubChem CID	11476004
ChEMBL	CHEMBL453047
IUPHAR	N/A
BindingDB	50243342
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
383649	Beta-1 adrenergic receptor	P08588	ADRB1	Homo sapiens (Human)	477
383651	Beta-2 adrenergic receptor	P07550	ADRB2	Homo sapiens (Human)	413
383648	Beta-3 adrenergic receptor	O02662	ADRB3	Canis lupus familiaris (Dog)	405
383650	Beta-3 adrenergic receptor	P13945	ADRB3	Homo sapiens (Human)	408

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