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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	MLS000587374
Molecular formula	C30H44N2O4
IUPAC name	2,5-bis(ethylaminomethyl)-1,6-bis(4-propoxyphenyl)hexane-1,6-dione
Molecular weight	496.692
Hydrogen bond acceptor	6
Hydrogen bond donor	2
XlogP	5.2
Synonyms	2,5-bis[(ethylamino)methyl]-1,6-bis(4-propoxyphenyl)hexane-1,6-dione AKOS005471270 STK541333 2,5-bis(ethylaminomethyl)-1,6-bis(4-propoxyphenyl)hexane-1,6-dione;hydrochloride cid_12005598 MolPort-000-745-358 BDBM41950 2,5-Bis-ethylaminomethyl-1,6-bis-(4-propoxy-phenyl)-hexane-1,6-dione MCULE-3502299790 AC1MYPVY SMR000211418 2,5-bis(ethylaminomethyl)-1,6-bis(4-propoxyphenyl)hexane-1,6-dione CHEMBL1617453 [ Show all ]
Inchi Key	CKJMLCBLCIPXFD-UHFFFAOYSA-N
Inchi ID	InChI=1S/C30H44N2O4/c1-5-19-35-27-15-11-23(12-16-27)29(33)25(21-31-7-3)9-10-26(22-32-8-4)30(34)24-13-17-28(18-14-24)36-20-6-2/h11-18,25-26,31-32H,5-10,19-22H2,1-4H3
PubChem CID	3835696
ChEMBL	N/A
IUPHAR	N/A
BindingDB	41950
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand has a partition coefficient log P greater than 5.

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
44102	Delta-type opioid receptor	P41143	OPRD1	Homo sapiens (Human)	372
44100	Galanin receptor type 2	O43603	GALR2	Homo sapiens (Human)	387
44101	Melanocortin receptor 4	P32245	MC4R	Homo sapiens (Human)	332

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