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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	N-[3-(4,4-Diphenylpiperidino)propyl]-2-(4-methoxybutyl)-4-(4-nitrophenyl)-6-ethyl-1,4-dihydropyridine-3,5-dicarboxamide
Molecular formula	C40H49N5O5
IUPAC name	5-N-[3-(4,4-diphenylpiperidin-1-yl)propyl]-2-ethyl-6-(4-methoxybutyl)-4-(4-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxamide
Molecular weight	679.862
Hydrogen bond acceptor	7
Hydrogen bond donor	3
XlogP	6.0
Synonyms	N/A
Inchi Key	CPNQDPLKZHXMSB-UHFFFAOYSA-N
Inchi ID	InChI=1S/C40H49N5O5/c1-3-33-36(38(41)46)35(29-18-20-32(21-19-29)45(48)49)37(34(43-33)17-10-11-28-50-2)39(47)42-24-12-25-44-26-22-40(23-27-44,30-13-6-4-7-14-30)31-15-8-5-9-16-31/h4-9,13-16,18-21,35,43H,3,10-12,17,22-28H2,1-2H3,(H2,41,46)(H,42,47)
PubChem CID	44329026
ChEMBL	CHEMBL99864
IUPHAR	N/A
BindingDB	N/A
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand is heavier than 500 daltons. 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
47544	Alpha-1A adrenergic receptor	P35348	ADRA1A	Homo sapiens (Human)	466
47546	Alpha-1B adrenergic receptor	P35368	ADRA1B	Homo sapiens (Human)	520
47545	Alpha-1D adrenergic receptor	P25100	ADRA1D	Homo sapiens (Human)	572
47549	Alpha-2A adrenergic receptor	P08913	ADRA2A	Homo sapiens (Human)	450
47548	Alpha-2B adrenergic receptor	P18089	ADRA2B	Homo sapiens (Human)	450
47547	Alpha-2C adrenergic receptor	P18825	ADRA2C	Homo sapiens (Human)	462

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