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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	CHEMBL2304014
Molecular formula	C31H39N7O7
IUPAC name	2-[(3R,6S,9R,12S,15S)-6-[(2-cyano-1H-indol-3-yl)methyl]-2,5,8,11,14-pentaoxo-9,12-di(propan-2-yl)-1,4,7,10,13-pentazabicyclo[13.3.0]octadecan-3-yl]acetic acid
Molecular weight	621.695
Hydrogen bond acceptor	8
Hydrogen bond donor	6
XlogP	1.9
Synonyms	BDBM50422140
Inchi Key	BFPMHXBUFKGOAP-CLOLZIAHSA-N
Inchi ID	InChI=1S/C31H39N7O7/c1-15(2)25-29(43)34-20(12-18-17-8-5-6-9-19(17)33-22(18)14-32)27(41)35-21(13-24(39)40)31(45)38-11-7-10-23(38)28(42)36-26(16(3)4)30(44)37-25/h5-6,8-9,15-16,20-21,23,25-26,33H,7,10-13H2,1-4H3,(H,34,43)(H,35,41)(H,36,42)(H,37,44)(H,39,40)/t20-,21+,23-,25+,26-/m0/s1
PubChem CID	71719081
ChEMBL	CHEMBL2304014
IUPHAR	N/A
BindingDB	50422140
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.

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
22516	Endothelin receptor type B	P35463	EDNRB	Sus scrofa (Pig)	443
22515	Endothelin-1 receptor	Q29010	EDNRA	Sus scrofa (Pig)	427

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