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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	CHEMBL488857
Molecular formula	C25H32ClN5O3
IUPAC name	3-[[1-[4-(4-chloroanilino)-6,7-dimethoxyquinazolin-2-yl]piperidin-4-yl]-methylamino]propan-1-ol
Molecular weight	486.013
Hydrogen bond acceptor	8
Hydrogen bond donor	2
XlogP	4.7
Synonyms	BDBM50245071 3-[(1-{4-[(4-Chlorophenyl)amino]-6,7-dimethoxyquinazolin-2-yl}piperidin-4-yl)(methyl)amino]propan-1-ol
Inchi Key	COCWQKFCDRXFCL-UHFFFAOYSA-N
Inchi ID	InChI=1S/C25H32ClN5O3/c1-30(11-4-14-32)19-9-12-31(13-10-19)25-28-21-16-23(34-3)22(33-2)15-20(21)24(29-25)27-18-7-5-17(26)6-8-18/h5-8,15-16,19,32H,4,9-14H2,1-3H3,(H,27,28,29)
PubChem CID	44562191
ChEMBL	CHEMBL488857
IUPHAR	N/A
BindingDB	50245071
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
46560	C-C chemokine receptor type 4	P51680	Ccr4	Mus musculus (Mouse)	360
46561	C-C chemokine receptor type 4	P51679	CCR4	Homo sapiens (Human)	360

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