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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	CHEMBL372820
Molecular formula	C27H33N3O3
IUPAC name	(1R)-2-[(2-methyl-1-naphthalen-2-ylpropan-2-yl)amino]-1-[(2R)-1-[(3-nitrophenyl)methyl]pyrrolidin-2-yl]ethanol
Molecular weight	447.579
Hydrogen bond acceptor	5
Hydrogen bond donor	2
XlogP	4.9
Synonyms	BDBM50175380 (R)-1-((R)-1-(3-nitrobenzyl)pyrrolidin-2-yl)-2-(2-methyl-1-(naphthalen-2-yl)propan-2-ylamino)ethanol
Inchi Key	BUYMPOCSZLJXOY-CLJLJLNGSA-N
Inchi ID	InChI=1S/C27H33N3O3/c1-27(2,17-20-12-13-22-8-3-4-9-23(22)15-20)28-18-26(31)25-11-6-14-29(25)19-21-7-5-10-24(16-21)30(32)33/h3-5,7-10,12-13,15-16,25-26,28,31H,6,11,14,17-19H2,1-2H3/t25-,26-/m1/s1
PubChem CID	44405894
ChEMBL	CHEMBL372820
IUPHAR	N/A
BindingDB	50175380
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
33454	Extracellular calcium-sensing receptor	P41180	CASR	Homo sapiens (Human)	1078

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