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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	MLS000662404
Molecular formula	C18H17ClN2O4
IUPAC name	[3-(2-chloro-4-nitrophenoxy)phenyl]-piperidin-1-ylmethanone
Molecular weight	360.794
Hydrogen bond acceptor	4
Hydrogen bond donor	0
XlogP	4.2
Synonyms	3-(2-chloro-4-nitrophenoxy)phenyl piperidyl ketone HMS2623K16 [3-(2-chloranyl-4-nitro-phenoxy)phenyl]-piperidin-1-yl-methanone [3-(2-chloro-4-nitrophenoxy)phenyl]-piperidin-1-ylmethanone AKOS003651190 MolPort-002-258-891 CHEMBL1382402 ST45132359 MCULE-2428080833 [3-(2-chloro-4-nitro-phenoxy)phenyl]-piperidino-methanone BDBM61524 REGID_for_CID_1303358 1-[3-(2-chloro-4-nitrophenoxy)benzoyl]piperidine cid_1303358 ZINC1127709 AC1LP9J3 [3-(2-chloro-4-nitrophenoxy)phenyl]-(1-piperidinyl)methanone SMR000292929 [ Show all ]
Inchi Key	ACRDNASHOTUMTR-UHFFFAOYSA-N
Inchi ID	InChI=1S/C18H17ClN2O4/c19-16-12-14(21(23)24)7-8-17(16)25-15-6-4-5-13(11-15)18(22)20-9-2-1-3-10-20/h4-8,11-12H,1-3,9-10H2
PubChem CID	1303358
ChEMBL	CHEMBL1382402
IUPHAR	N/A
BindingDB	61524
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
1808	G-protein coupled receptor 55	Q9Y2T6	GPR55	Homo sapiens (Human)	319

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