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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	CHEMBL497003
Molecular formula	C23H22N6
IUPAC name	1-(pyridin-4-ylmethyl)-4-(4-pyridin-2-ylpiperazin-1-yl)phthalazine
Molecular weight	382.471
Hydrogen bond acceptor	6
Hydrogen bond donor	0
XlogP	3.3
Synonyms	1-Pyridin-4-ylmethyl-4-(4-pyridin-2-ylpiperazin-1-yl)phthalazine BDBM50268375 MCULE-1202859481 1-(4-pyridylmethyl)-4-[4-(2-pyridyl)piperazino]phthalazine SCHEMBL3613533 AKOS004916945 [ Show all ]
Inchi Key	HVCKRXNCZNJASA-UHFFFAOYSA-N
Inchi ID	InChI=1S/C23H22N6/c1-2-6-20-19(5-1)21(17-18-8-11-24-12-9-18)26-27-23(20)29-15-13-28(14-16-29)22-7-3-4-10-25-22/h1-12H,13-17H2
PubChem CID	20875737
ChEMBL	CHEMBL497003
IUPHAR	N/A
BindingDB	50268375
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
124842	Smoothened homolog	P56726	Smo	Mus musculus (Mouse)	793
124843	Smoothened homolog	Q99835	SMO	Homo sapiens (Human)	787

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