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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	CHEMBL211012
Molecular formula	C25H40N4O3S
IUPAC name	N-[3-[4-[[1-(cyclohexylmethylsulfonyl)piperidin-4-yl]methyl]piperazin-1-yl]phenyl]acetamide
Molecular weight	476.68
Hydrogen bond acceptor	6
Hydrogen bond donor	1
XlogP	3.4
Synonyms	SCHEMBL1384812 BDBM50187385 N-{3-[4-(1-Cyclohexylmethanesulfonyl-piperidin-4-ylmethyl)-piperizine-1-yl]-phenyl}-acetamide
Inchi Key	KSDUDINTMMXLNJ-UHFFFAOYSA-N
Inchi ID	InChI=1S/C25H40N4O3S/c1-21(30)26-24-8-5-9-25(18-24)28-16-14-27(15-17-28)19-22-10-12-29(13-11-22)33(31,32)20-23-6-3-2-4-7-23/h5,8-9,18,22-23H,2-4,6-7,10-17,19-20H2,1H3,(H,26,30)
PubChem CID	10457710
ChEMBL	CHEMBL211012
IUPHAR	N/A
BindingDB	50187385
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
176958	5-hydroxytryptamine receptor 1A	P08908	HTR1A	Homo sapiens (Human)	422
176959	Alpha-2A adrenergic receptor	P22909	Adra2a	Rattus norvegicus (Rat)	450

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