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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	MLS000034919
Molecular formula	C21H18N4O3
IUPAC name	ethyl 7-benzyl-6-imino-2-oxo-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carboxylate
Molecular weight	374.4
Hydrogen bond acceptor	5
Hydrogen bond donor	1
XlogP	1.9
Synonyms	AKOS000529478 ethyl 2-azanylidene-5-oxidanylidene-1-(phenylmethyl)dipyrido[1,2-d:3'',4''-f]pyrimidine-3-carboxylate SR-01000322369 2-imino-5-oxo-1-(phenylmethyl)-3-dipyrido[1,2-d:3'',4''-f]pyrimidinecarboxylic acid ethyl ester MLS-0007957.0001 ZINC100318729 AB00428585-06 ethyl 1-benzyl-2-imino-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate MolPort-000-480-718 1-Benzyl-2-imino-10-oxo-1,10-dihydro-2H-1,9,10a-triaza-anthracene-3-carboxylic acid ethyl ester BAS 04995196 HMS2345I03 SR-01000322369-1 497242-28-1 CHEMBL1420151 AC1LCKF4 ethyl 1-benzyl-2-imino-5-oxodipyrido[1,2-d:3'',4''-f]pyrimidine-3-carboxylate SMR000013107 1-benzyl-2-imino-5-keto-dipyrido[1,2-d:3'',4''-f]pyrimidine-3-carboxylic acid ethyl ester BDBM61397 MCULE-6791835030 STK514554 cid_651615 MLS000889377 [ Show all ]
Inchi Key	FCFRRERPZXNRCF-UHFFFAOYSA-N
Inchi ID	InChI=1S/C21H18N4O3/c1-2-28-21(27)15-12-16-19(23-17-10-6-7-11-24(17)20(16)26)25(18(15)22)13-14-8-4-3-5-9-14/h3-12,22H,2,13H2,1H3
PubChem CID	651615
ChEMBL	CHEMBL1420151
IUPHAR	N/A
BindingDB	61397
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
74877	Cannabinoid receptor 1	P21554	CNR1	Homo sapiens (Human)	472
74875	Cannabinoid receptor 2	P34972	CNR2	Homo sapiens (Human)	360
74878	G-protein coupled receptor 35	Q9HC97	GPR35	Homo sapiens (Human)	309
74876	G-protein coupled receptor 55	Q9Y2T6	GPR55	Homo sapiens (Human)	319

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