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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	SMR000105036
Molecular formula	C25H33N3O
IUPAC name	2-(4-methylpiperazin-1-yl)-1-(2,2,4-trimethyl-4-phenyl-3H-quinolin-1-yl)ethanone
Molecular weight	391.559
Hydrogen bond acceptor	3
Hydrogen bond donor	0
XlogP	4.2
Synonyms	AC1MX73R ChemDiv1_028765 2-(4-methylpiperazin-1-yl)-1-(2,2,4-trimethyl-4-phenyl-1,2,3,4-tetrahydroquinolin-1-yl)ethan-1-one BIM-0036005.P001 MCULE-1658207882 STK508693 332144-58-8 NCGC00077069-02 AC1Q3ZRQ HMS2301J14 SR-01000493348 2-(4-methylpiperazin-1-yl)-1-(2,2,4-trimethyl-4-phenyl-3,4-dihydroquinolin-1(2H)-yl)ethanone Cambridge id 5878857 MLS000109090 AB00100123-01 CHEMBL1564312 REGID_for_CID_3761008 AKOS001671042 HMS668L11 SR-01000493348-1 2-(4-methylpiperazin-1-yl)-1-(2,2,4-trimethyl-4-phenyl-3H-quinolin-1-yl)ethanone CBMicro_035943 MolPort-001-843-653 [ Show all ]
Inchi Key	ABWVZIKPCCNRGU-UHFFFAOYSA-N
Inchi ID	InChI=1S/C25H33N3O/c1-24(2)19-25(3,20-10-6-5-7-11-20)21-12-8-9-13-22(21)28(24)23(29)18-27-16-14-26(4)15-17-27/h5-13H,14-19H2,1-4H3
PubChem CID	3761008
ChEMBL	CHEMBL1564312
IUPHAR	N/A
BindingDB	N/A
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
1263	Glucagon-like peptide 1 receptor	P43220	GLP1R	Homo sapiens (Human)	463

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