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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	CHEMBL491726
Molecular formula	C26H32N4O5S
IUPAC name	4-[4-[2-[[(2R)-2-(4-aminopyridin-3-yl)-2-hydroxyethyl]amino]ethyl]phenyl]-N-methylsulfonyl-2-propan-2-yloxybenzamide
Molecular weight	512.625
Hydrogen bond acceptor	8
Hydrogen bond donor	4
XlogP	2.6
Synonyms	BDBM50249640 4''-(2-{[(2R)-2-(6-Aminopyridin-3-yl)-2-hydroxyethyl]amino}ethyl)-3-isopropoxy-N-(methylsulfonyl)biphenyl-4-carboxamide
Inchi Key	ZOEWKLNYTOCOCA-DEOSSOPVSA-N
Inchi ID	InChI=1S/C26H32N4O5S/c1-17(2)35-25-14-20(8-9-21(25)26(32)30-36(3,33)34)19-6-4-18(5-7-19)10-12-29-16-24(31)22-15-28-13-11-23(22)27/h4-9,11,13-15,17,24,29,31H,10,12,16H2,1-3H3,(H2,27,28)(H,30,32)/t24-/m0/s1
PubChem CID	44565908
ChEMBL	CHEMBL491726
IUPHAR	N/A
BindingDB	50249640
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand is heavier than 500 daltons.

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
433380	Beta-1 adrenergic receptor	P08588	ADRB1	Homo sapiens (Human)	477
433378	Beta-3 adrenergic receptor	P13945	ADRB3	Homo sapiens (Human)	408
433379	Beta-3 adrenergic receptor	O02662	ADRB3	Canis lupus familiaris (Dog)	405

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