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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	CHEMBL492401
Molecular formula	C27H35Cl2N3O5S
IUPAC name	4-[4-[2-[[(2R)-2-(4-aminophenyl)-2-hydroxyethyl]amino]ethyl]phenyl]-N-methylsulfonyl-2-propan-2-yloxybenzamide;dihydrochloride
Molecular weight	584.553
Hydrogen bond acceptor	7
Hydrogen bond donor	6
XlogP	None
Synonyms	SCHEMBL4585694
Inchi Key	PQIYAYICSPPBOY-WLOLSGMKSA-N
Inchi ID	InChI=1S/C27H33N3O5S.2ClH/c1-18(2)35-26-16-22(10-13-24(26)27(32)30-36(3,33)34)20-6-4-19(5-7-20)14-15-29-17-25(31)21-8-11-23(28)12-9-21;;/h4-13,16,18,25,29,31H,14-15,17,28H2,1-3H3,(H,30,32);2*1H/t25-;;/m0../s1
PubChem CID	42640121
ChEMBL	CHEMBL492401
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 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
266190	Beta-1 adrenergic receptor	P08588	ADRB1	Homo sapiens (Human)	477
266191	Beta-3 adrenergic receptor	O02662	ADRB3	Canis lupus familiaris (Dog)	405
266192	Beta-3 adrenergic receptor	P13945	ADRB3	Homo sapiens (Human)	408

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