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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	CHEMBL2112663
Molecular formula	C28H43N3O6S2
IUPAC name	2-amino-N-[[(1S,2S,4R)-2-hydroxy-7,7-dimethyl-1-(spiro[1,2-dihydroindene-3,4'-piperidine]-1'-ylsulfonylmethyl)-2-bicyclo[2.2.1]heptanyl]methyl]-3-methylsulfonylpropanamide
Molecular weight	581.787
Hydrogen bond acceptor	8
Hydrogen bond donor	3
XlogP	1.7
Synonyms	BDBM50407010
Inchi Key	FEVGJJNJVGFMJE-QBVGELNHSA-N
Inchi ID	InChI=1S/C28H43N3O6S2/c1-25(2)21-9-11-27(25,28(33,16-21)18-30-24(32)23(29)17-38(3,34)35)19-39(36,37)31-14-12-26(13-15-31)10-8-20-6-4-5-7-22(20)26/h4-7,21,23,33H,8-19,29H2,1-3H3,(H,30,32)/t21-,23?,27+,28-/m1/s1
PubChem CID	71449094
ChEMBL	CHEMBL2112663
IUPHAR	N/A
BindingDB	50407010
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
76679	Oxytocin receptor	P70536	Oxtr	Rattus norvegicus (Rat)	388
76680	Vasopressin V2 receptor	Q00788	Avpr2	Rattus norvegicus (Rat)	371

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