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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	CHEMBL1084656
Molecular formula	C26H40N2O9S
IUPAC name	acetic acid;3-[2-[6-[[(2R)-2-hydroxy-2-[4-hydroxy-3-(hydroxymethyl)phenyl]ethyl]amino]hexoxy]ethoxymethyl]benzenesulfonamide
Molecular weight	556.671
Hydrogen bond acceptor	11
Hydrogen bond donor	6
XlogP	None
Synonyms	SCHEMBL926096
Inchi Key	BDDTUXBLJQXXHC-JIDHJSLPSA-N
Inchi ID	InChI=1S/C24H36N2O7S.C2H4O2/c25-34(30,31)22-7-5-6-19(14-22)18-33-13-12-32-11-4-2-1-3-10-26-16-24(29)20-8-9-23(28)21(15-20)17-27;1-2(3)4/h5-9,14-15,24,26-29H,1-4,10-13,16-18H2,(H2,25,30,31);1H3,(H,3,4)/t24-;/m0./s1
PubChem CID	46833101
ChEMBL	CHEMBL1084656
IUPHAR	N/A
BindingDB	N/A
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand has more than 5 hydrogen bond donor. This ligand has more than 10 hydrogen bond acceptor. This ligand is heavier than 500 daltons. Partition coefficient log P of this ligand is not available.

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
20830	Beta-1 adrenergic receptor	P08588	ADRB1	Homo sapiens (Human)	477
20832	Beta-2 adrenergic receptor	P07550	ADRB2	Homo sapiens (Human)	413
20831	Beta-3 adrenergic receptor	P13945	ADRB3	Homo sapiens (Human)	408

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