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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	CHEMBL75808
Molecular formula	C24H34N6O2
IUPAC name	1-[[2-amino-6-[[4-(2-propan-2-yloxyphenyl)piperazin-1-yl]methyl]pyrimidin-4-yl]methyl]piperidin-2-one
Molecular weight	438.576
Hydrogen bond acceptor	7
Hydrogen bond donor	1
XlogP	1.8
Synonyms	1-[2-Amino-6-[4-(2-isopropoxyphenyl)piperazinomethyl]-4-pyrimidinylmethyl]piperidine-2-one BDBM50093218 1-{2-Amino-6-[4-(2-isopropoxy-phenyl)-piperazin-1-ylmethyl]-pyrimidin-4-ylmethyl}-piperidin-2-one
Inchi Key	BFLQALILHDTZOK-UHFFFAOYSA-N
Inchi ID	InChI=1S/C24H34N6O2/c1-18(2)32-22-8-4-3-7-21(22)29-13-11-28(12-14-29)16-19-15-20(27-24(25)26-19)17-30-10-6-5-9-23(30)31/h3-4,7-8,15,18H,5-6,9-14,16-17H2,1-2H3,(H2,25,26,27)
PubChem CID	12134985
ChEMBL	CHEMBL75808
IUPHAR	N/A
BindingDB	50093218
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
22423	Alpha-1A adrenergic receptor	P35348	ADRA1A	Homo sapiens (Human)	466
22422	Alpha-1B adrenergic receptor	P35368	ADRA1B	Homo sapiens (Human)	520
22424	Alpha-1D adrenergic receptor	P25100	ADRA1D	Homo sapiens (Human)	572

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