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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	CHEMBL309783
Molecular formula	C24H32N4O3
IUPAC name	1-[[(3S)-2-[(2S)-2-amino-3-(4-hydroxy-2,6-dimethylphenyl)propanoyl]-3,4-dihydro-1H-isoquinolin-3-yl]methyl]-3-ethylurea
Molecular weight	424.545
Hydrogen bond acceptor	4
Hydrogen bond donor	4
XlogP	2.3
Synonyms	(S)-1-[(3S)-3-(3-Ethylureidomethyl)-1,2,3,4-tetrahydroisoquinoline-2-yl]-3-(2,6-dimethyl-4-hydroxyphenyl)-2-amino-1-propanone BDBM50101631 1-{2-[2-Amino-3-(4-hydroxy-2,6-dimethyl-phenyl)-propionyl]-1,2,3,4-tetrahydro-isoquinolin-3-ylmethyl}-3-ethyl-urea
Inchi Key	AKFDHTVXZQKREB-UGKGYDQZSA-N
Inchi ID	InChI=1S/C24H32N4O3/c1-4-26-24(31)27-13-19-11-17-7-5-6-8-18(17)14-28(19)23(30)22(25)12-21-15(2)9-20(29)10-16(21)3/h5-10,19,22,29H,4,11-14,25H2,1-3H3,(H2,26,27,31)/t19-,22-/m0/s1
PubChem CID	11112699
ChEMBL	CHEMBL309783
IUPHAR	N/A
BindingDB	50101631
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
7485	Delta-type opioid receptor	P41143	OPRD1	Homo sapiens (Human)	372
7486	Kappa-type opioid receptor	P41145	OPRK1	Homo sapiens (Human)	380
7484	Mu-type opioid receptor	P35372	OPRM1	Homo sapiens (Human)	400

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