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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	CHEMBL32586
Molecular formula	C21H27ClN2O4
IUPAC name	2-[3-chloro-4-[2-[[(1R,2S)-1-hydroxy-1-(4-hydroxyphenyl)propan-2-yl]amino]ethyl]anilino]-2-methylpropanoic acid
Molecular weight	406.907
Hydrogen bond acceptor	6
Hydrogen bond donor	5
XlogP	1.2
Synonyms	2-[[4-[2-[[(1S,2R)-2-(4-Hydroxyphenyl)-2-hydroxy-1-methylethyl]amino]ethyl]3-chlorophenyl]amino]isobutyric acid BDBM50409471 SCHEMBL6741982
Inchi Key	KBJBJJJLLNNCPS-DJJJIMSYSA-N
Inchi ID	InChI=1S/C21H27ClN2O4/c1-13(19(26)15-5-8-17(25)9-6-15)23-11-10-14-4-7-16(12-18(14)22)24-21(2,3)20(27)28/h4-9,12-13,19,23-26H,10-11H2,1-3H3,(H,27,28)/t13-,19-/m0/s1
PubChem CID	10835216
ChEMBL	CHEMBL32586
IUPHAR	N/A
BindingDB	50409471
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
165113	Beta-1 adrenergic receptor	P18090	Adrb1	Rattus norvegicus (Rat)	466
165114	Beta-2 adrenergic receptor	P10608	Adrb2	Rattus norvegicus (Rat)	418
165112	Beta-3 adrenergic receptor	P26255	Adrb3	Rattus norvegicus (Rat)	400

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