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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	MLS000544236
Molecular formula	C14H16ClN7O4
IUPAC name	4-[(E)-C-[4-(4-chloro-2-nitrophenyl)piperazin-1-yl]-N-methoxycarbonimidoyl]-1,2,5-oxadiazol-3-amine
Molecular weight	381.777
Hydrogen bond acceptor	9
Hydrogen bond donor	1
XlogP	1.8
Synonyms	A1863/0078322 MolPort-002-703-021 [4-[(E)-C-[4-(4-chloro-2-nitro-phenyl)piperazino]-N-methoxy-carbonimidoyl]furazan-3-yl]amine 1-[(4-amino-1,2,5-oxadiazol-3-yl)(methoxyimino)methyl]-4-{4-chloro-2-nitrophenyl}piperazine SMR000163178 4-[(E)-[4-(4-chloro-2-nitrophenyl)-1-piperazinyl]-methoxyiminomethyl]-1,2,5-oxadiazol-3-amine MCULE-6677636091 STK758664 AKOS001742990 MolPort-019-759-662 4-[(E)-C-[4-(4-chloranyl-2-nitro-phenyl)piperazin-1-yl]-N-methoxy-carbonimidoyl]-1,2,5-oxadiazol-3-amine CHEMBL3194297 SR-01000090176 4-[(E)-[4-(4-chloro-2-nitrophenyl)piperazin-1-yl](methoxyimino)methyl]-1,2,5-oxadiazol-3-amine ZINC34687337 (4-amino-1,2,5-oxadiazol-3-yl)[4-(4-chloro-2-nitrophenyl)piperazino]methanone O-methyloxime BDBM95697 REGID_for_CID_9600464 4-[(E)-C-[4-(4-chloro-2-nitrophenyl)piperazin-1-yl]-N-methoxycarbonimidoyl]-1,2,5-oxadiazol-3-amine cid_9600464 SR-01000090176-1 [ Show all ]
Inchi Key	AFVYNTYQTFVLKP-XMHGGMMESA-N
Inchi ID	InChI=1S/C14H16ClN7O4/c1-25-19-14(12-13(16)18-26-17-12)21-6-4-20(5-7-21)10-3-2-9(15)8-11(10)22(23)24/h2-3,8H,4-7H2,1H3,(H2,16,18)/b19-14+
PubChem CID	9600464
ChEMBL	CHEMBL3194297
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
4545	Glucagon-like peptide 1 receptor	P43220	GLP1R	Homo sapiens (Human)	463
463437	Parathyroid hormone/parathyroid hormone-related peptide receptor	Q03431	PTH1R	Homo sapiens (Human)	593

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