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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	CHEMBL333283
Molecular formula	C32H34ClN7O2
IUPAC name	(3R)-N-[(2R)-3-(4-chlorophenyl)-1-oxo-1-[4-[2-(1,2,4-triazol-4-ylmethyl)phenyl]piperazin-1-yl]propan-2-yl]-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
Molecular weight	584.121
Hydrogen bond acceptor	6
Hydrogen bond donor	2
XlogP	3.5
Synonyms	(R)-1,2,3,4-Tetrahydro-isoquinoline-3-carboxylic acid {(R)-1-(4-chloro-benzyl)-2-oxo-2-[4-(2-[1,2,4]triazol-4-ylmethyl-phenyl)-piperazin-1-yl]-ethyl}-amide (3R)-N-[(alphaR)-alpha-[4-[2-(4H-1,2,4-Triazole-4-ylmethyl)phenyl]piperazinocarbonyl]-4-chlorophenethyl]-1,2,3,4-tetrahydroisoquinoline-3beta-carboxamide BDBM50134488
Inchi Key	SQUPSEKHAYZJTP-FQLXRVMXSA-N
Inchi ID	InChI=1S/C32H34ClN7O2/c33-27-11-9-23(10-12-27)17-29(37-31(41)28-18-24-5-1-2-6-25(24)19-34-28)32(42)40-15-13-39(14-16-40)30-8-4-3-7-26(30)20-38-21-35-36-22-38/h1-12,21-22,28-29,34H,13-20H2,(H,37,41)/t28-,29-/m1/s1
PubChem CID	44349019
ChEMBL	CHEMBL333283
IUPHAR	N/A
BindingDB	50134488
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
320987	Adrenocorticotropic hormone receptor	Q64326	Mc2r	Mus musculus (Mouse)	296
320991	Melanocortin receptor 3	P41968	MC3R	Homo sapiens (Human)	323
320986	Melanocortin receptor 4	P32245	MC4R	Homo sapiens (Human)	332
320990	Melanocortin receptor 4	P56450	Mc4r	Mus musculus (Mouse)	332
320988	Melanocortin receptor 5	P33032	MC5R	Homo sapiens (Human)	325
320989	Melanocyte-stimulating hormone receptor	Q01726	MC1R	Homo sapiens (Human)	317

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