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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	CHEMBL556852
Molecular formula	C30H37N3O5S
IUPAC name	4-[4-[2-[[(2R)-2-(4-aminophenyl)-2-hydroxyethyl]amino]ethyl]phenyl]-2-cyclohexyloxy-N-methylsulfonylbenzamide
Molecular weight	551.702
Hydrogen bond acceptor	7
Hydrogen bond donor	4
XlogP	4.2
Synonyms	4''-(2-{[(2R)-2-(4-Aminophenyl)-2-hydroxyethyl]amino}ethyl)-3-(cyclohexyloxy)-N-(methylsulfonyl)biphenyl-4-carboxamide Dihydrochloride CHEMBL452134 BDBM50249638
Inchi Key	VTKMLZIGOBSURB-NDEPHWFRSA-N
Inchi ID	InChI=1S/C30H37N3O5S/c1-39(36,37)33-30(35)27-16-13-24(19-29(27)38-26-5-3-2-4-6-26)22-9-7-21(8-10-22)17-18-32-20-28(34)23-11-14-25(31)15-12-23/h7-16,19,26,28,32,34H,2-6,17-18,20,31H2,1H3,(H,33,35)/t28-/m0/s1
PubChem CID	42639656
ChEMBL	CHEMBL556852
IUPHAR	N/A
BindingDB	50249638
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
363852	Beta-1 adrenergic receptor	P08588	ADRB1	Homo sapiens (Human)	477
363851	Beta-3 adrenergic receptor	P13945	ADRB3	Homo sapiens (Human)	408
363853	Beta-3 adrenergic receptor	O02662	ADRB3	Canis lupus familiaris (Dog)	405

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