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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	NSC697166
Molecular formula	C38H40Cl2N8O2
IUPAC name	3-[8-[4-anilino-5-[(4-chlorophenoxy)methyl]-1,2,4-triazol-3-yl]octyl]-5-[(4-chlorophenoxy)methyl]-N-phenyl-1,2,4-triazol-4-amine
Molecular weight	711.692
Hydrogen bond acceptor	8
Hydrogen bond donor	2
XlogP	10.3
Synonyms	NCI60_034635 4H-1,4-Triazol-4-amine, 3,3'-(1,8-octanediyl)bis[5-[(4-chlorophenoxy)methyl]- N-phenyl- CHEMBL195851 NSC-697166 AC1L97GG N-(3-(8-(4-Anilino-5-((4-chlorophenoxy)methyl)-4H-1,2,4-triazol-3-yl)octyl)-5-((4-chlorophenoxy)methyl)-4H-1,2,4-triazol-4-yl)-N-phenylamine 3-[8-[4-anilino-5-[(4-chlorophenoxy)methyl]-1,2,4-triazol-3-yl]octyl]-5-[(4-chlorophenoxy)methyl]-N-phenyl-1,2,4-triazol-4-amine [ Show all ]
Inchi Key	RQIVURUKFMFAAP-UHFFFAOYSA-N
Inchi ID	InChI=1S/C38H40Cl2N8O2/c39-29-19-23-33(24-20-29)49-27-37-43-41-35(47(37)45-31-13-7-5-8-14-31)17-11-3-1-2-4-12-18-36-42-44-38(28-50-34-25-21-30(40)22-26-34)48(36)46-32-15-9-6-10-16-32/h5-10,13-16,19-26,45-46H,1-4,11-12,17-18,27-28H2
PubChem CID	394048
ChEMBL	CHEMBL195851
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
302608	G-protein coupled receptor 182	O15218	GPR182	Homo sapiens (Human)	404

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