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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	CHEMBL32391
Molecular formula	C19H22Cl2N2O4
IUPAC name	2-[2,6-dichloro-4-[2-[[(1R,2S)-1-hydroxy-1-(4-hydroxyphenyl)propan-2-yl]amino]ethyl]anilino]acetic acid
Molecular weight	413.295
Hydrogen bond acceptor	6
Hydrogen bond donor	5
XlogP	1.2
Synonyms	BDBM50409472 KDJXRWPCYRQOAD-WLRWDXFRSA-N [[4-[2-[[(1S,2R)-2-(4-Hydroxyphenyl)-2-hydroxy-1-methylethyl]amino]ethyl]-2,6-dichlorophenyl]amino]acetic acid N-[2,6-dichloro-4-[2-[[(1S, 2R)-2-hydroxy-2-(4-hydroxyphenyl)-1-methylethyl]amino]ethyl]phenyl]-aminoacetic acid SCHEMBL7107114
Inchi Key	KDJXRWPCYRQOAD-WLRWDXFRSA-N
Inchi ID	InChI=1S/C19H22Cl2N2O4/c1-11(19(27)13-2-4-14(24)5-3-13)22-7-6-12-8-15(20)18(16(21)9-12)23-10-17(25)26/h2-5,8-9,11,19,22-24,27H,6-7,10H2,1H3,(H,25,26)/t11-,19-/m0/s1
PubChem CID	9844606
ChEMBL	CHEMBL32391
IUPHAR	N/A
BindingDB	50409472
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
166470	Beta-1 adrenergic receptor	P18090	Adrb1	Rattus norvegicus (Rat)	466
166471	Beta-2 adrenergic receptor	P10608	Adrb2	Rattus norvegicus (Rat)	418
166469	Beta-3 adrenergic receptor	P26255	Adrb3	Rattus norvegicus (Rat)	400

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