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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	CHEMBL146108
Molecular formula	C25H33N3O3
IUPAC name	(3S)-2-[(2S)-2-amino-3-(4-hydroxy-2,6-dimethylphenyl)propanoyl]-N-tert-butyl-3,4-dihydro-1H-isoquinoline-3-carboxamide
Molecular weight	423.557
Hydrogen bond acceptor	4
Hydrogen bond donor	3
XlogP	3.1
Synonyms	(S)-2-[(S)-2-Amino-3-(4-hydroxy-2,6-dimethyl-phenyl)-propionyl]-1,2,3,4-tetrahydro-isoquinoline-3-carboxylic acid tert-butylamide BDBM50083165
Inchi Key	ASKBYBNQNYTQNX-VXKWHMMOSA-N
Inchi ID	InChI=1S/C25H33N3O3/c1-15-10-19(29)11-16(2)20(15)13-21(26)24(31)28-14-18-9-7-6-8-17(18)12-22(28)23(30)27-25(3,4)5/h6-11,21-22,29H,12-14,26H2,1-5H3,(H,27,30)/t21-,22-/m0/s1
PubChem CID	10526305
ChEMBL	CHEMBL146108
IUPHAR	N/A
BindingDB	50083165
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
13228	Delta-type opioid receptor	P33533	Oprd1	Rattus norvegicus (Rat)	372
13229	Mu-type opioid receptor	P33535	Oprm1	Rattus norvegicus (Rat)	398

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