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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	CHEMBL20826
Molecular formula	C29H30ClN3O2
IUPAC name	1-(4-benzyl-4-hydroxypiperidin-1-yl)-3-[2-(4-chlorophenyl)-1-methylpyrrolo[3,2-c]pyridin-3-yl]propan-1-one
Molecular weight	488.028
Hydrogen bond acceptor	3
Hydrogen bond donor	1
XlogP	4.6
Synonyms	1-(4-Benzyl-4-hydroxy-piperidin-1-yl)-3-[2-(4-chloro-phenyl)-1-methyl-1H-pyrrolo[3,2-c]pyridin-3-yl]-propan-1-one BDBM50099527 SCHEMBL7574961 1-(4-Hydroxy-4-benzylpiperidino)-3-[1-methyl-2-(4-chlorophenyl)-1H-pyrrolo[3,2-c]pyridine-3-yl]-1-propanone
Inchi Key	AMKINZCRNCDIPJ-UHFFFAOYSA-N
Inchi ID	InChI=1S/C29H30ClN3O2/c1-32-26-13-16-31-20-25(26)24(28(32)22-7-9-23(30)10-8-22)11-12-27(34)33-17-14-29(35,15-18-33)19-21-5-3-2-4-6-21/h2-10,13,16,20,35H,11-12,14-15,17-19H2,1H3
PubChem CID	10228092
ChEMBL	CHEMBL20826
IUPHAR	N/A
BindingDB	50099527
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
8982	Substance-P receptor	P25103	TACR1	Homo sapiens (Human)	407

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