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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	NSC697163
Molecular formula	C34H38N8O4
IUPAC name	1-[[4-amino-5-[8-[4-amino-5-[(2-hydroxynaphthalen-1-yl)oxymethyl]-1,2,4-triazol-3-yl]octyl]-1,2,4-triazol-3-yl]methoxy]naphthalen-2-ol
Molecular weight	622.73
Hydrogen bond acceptor	10
Hydrogen bond donor	4
XlogP	6.4
Synonyms	NCI60_034632 1-((4-Amino-5-(8-(4-amino-5-(((2-hydroxy-1-naphthyl)oxy)methyl)-4H-1,2,4-triazol-3-yl)octyl)-4H-1,2,4-triazol-3-yl)methoxy)-2-naphthol 2-naphthalenol, 1,1'-[1,8-octanediylbis[(4-amino-4h-1,2,4-triazole-5,3-diyl)methyleneoxy]]bis- CHEMBL195587 NSC-697163 1-[[4-amino-5-[8-[4-amino-5-[(2-hydroxy-1-naphthyl)oxymethyl]-1,2,4-triazol-3-yl]octyl]-1,2,4-triazol-3-yl]methoxy]naphthalen-2-ol AC1L97G7 CTK8D3464 1-[[4-amino-5-[8-[4-amino-5-[(2-hydroxynaphthalen-1-yl)oxymethyl]-1,2,4-triazol-3-yl]octyl]-1,2,4-triazol-3-yl]methoxy]naphthalen-2-ol [ Show all ]
Inchi Key	NUXQTLBRCMZPEU-UHFFFAOYSA-N
Inchi ID	InChI=1S/C34H38N8O4/c35-41-29(37-39-31(41)21-45-33-25-13-9-7-11-23(25)17-19-27(33)43)15-5-3-1-2-4-6-16-30-38-40-32(42(30)36)22-46-34-26-14-10-8-12-24(26)18-20-28(34)44/h7-14,17-20,43-44H,1-6,15-16,21-22,35-36H2
PubChem CID	394045
ChEMBL	CHEMBL195587
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
232766	G-protein coupled receptor 182	O15218	GPR182	Homo sapiens (Human)	404

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