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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	MLS000923861
Molecular formula	C22H27N9O2
IUPAC name	1-(4-amino-1,2,5-oxadiazol-3-yl)-N-[[(Z)-2-methyl-3-phenylprop-2-enylidene]amino]-5-[(4-methylpiperidin-1-yl)methyl]triazole-4-carboxamide
Molecular weight	449.519
Hydrogen bond acceptor	9
Hydrogen bond donor	2
XlogP	2.4
Synonyms	1-(4-aminofurazan-3-yl)-N-[[(Z)-2-methyl-3-phenyl-prop-2-enylidene]amino]-5-[(4-methylpiperidino)methyl]triazole-4-carboxamide MLS-0356435.0001 BDBM61132 1-(4-amino-1,2,5-oxadiazol-3-yl)-N-[[(Z)-2-methyl-3-phenylprop-2-enylidene]amino]-5-[(4-methyl-1-piperidinyl)methyl]-4-triazolecarboxamide cid_24789557 1-(4-azanyl-1,2,5-oxadiazol-3-yl)-N-[[(Z)-2-methyl-3-phenyl-prop-2-enylidene]amino]-5-[(4-methylpiperidin-1-yl)methyl]-1,2,3-triazole-4-carboxamide 1-(4-amino-1,2,5-oxadiazol-3-yl)-N-[[(Z)-2-methyl-3-phenylprop-2-enylidene]amino]-5-[(4-methylpiperidin-1-yl)methyl]triazole-4-carboxamide HMS2889L19 SMR000620326 CHEMBL1446359 [ Show all ]
Inchi Key	DEARTAGYOFLSII-SBRBTQSLSA-N
Inchi ID	InChI=1S/C22H27N9O2/c1-15-8-10-30(11-9-15)14-18-19(25-29-31(18)21-20(23)27-33-28-21)22(32)26-24-13-16(2)12-17-6-4-3-5-7-17/h3-7,12-13,15H,8-11,14H2,1-2H3,(H2,23,27)(H,26,32)/b16-12-,24-13?
PubChem CID	24789557
ChEMBL	CHEMBL1446359
IUPHAR	N/A
BindingDB	61132
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
57628	Cannabinoid receptor 1	P21554	CNR1	Homo sapiens (Human)	472
57630	Cannabinoid receptor 2	P34972	CNR2	Homo sapiens (Human)	360
57629	G-protein coupled receptor 35	Q9HC97	GPR35	Homo sapiens (Human)	309
57631	G-protein coupled receptor 55	Q9Y2T6	GPR55	Homo sapiens (Human)	319

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