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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	CHEMBL339151
Molecular formula	C26H36N2O4S
IUPAC name	N-[[(1S,2R,4R)-2-hydroxy-7,7-dimethyl-1-(spiro[indene-1,4'-piperidine]-1'-ylsulfonylmethyl)-2-bicyclo[2.2.1]heptanyl]methyl]acetamide
Molecular weight	472.644
Hydrogen bond acceptor	5
Hydrogen bond donor	2
XlogP	3.2
Synonyms	BDBM50043099 1N-[2-hydroxy-7,7-dimethyl-1-spiro[1H-indene-1,4''-(hexahydropyridine)]-1-ylsulfonylmethyl-(1S,2R,4R)-bicyclo[2.2.1]hept-2-ylmethyl]acetamide
Inchi Key	CDXCUUGKLYZBPY-NYMACZPPSA-N
Inchi ID	InChI=1S/C26H36N2O4S/c1-19(29)27-17-26(30)16-21-9-11-25(26,23(21,2)3)18-33(31,32)28-14-12-24(13-15-28)10-8-20-6-4-5-7-22(20)24/h4-8,10,21,30H,9,11-18H2,1-3H3,(H,27,29)/t21-,25+,26+/m1/s1
PubChem CID	44352497
ChEMBL	CHEMBL339151
IUPHAR	N/A
BindingDB	50043099
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
39653	Oxytocin receptor	P70536	Oxtr	Rattus norvegicus (Rat)	388
39652	Vasopressin V2 receptor	Q00788	Avpr2	Rattus norvegicus (Rat)	371

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