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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	CHEMBL198668
Molecular formula	C40H50Cl2N6O8
IUPAC name	2-[4-[[3-[[[1-[2-(4-amino-5-chloro-2-methoxybenzoyl)oxyethyl]piperidine-4-carbonyl]amino]methyl]phenyl]methylcarbamoyl]piperidin-1-yl]ethyl 4-amino-5-chloro-2-methoxybenzoate
Molecular weight	813.774
Hydrogen bond acceptor	12
Hydrogen bond donor	4
XlogP	4.1
Synonyms	BDBM50174432 1-[2-(3-amino-4-chloro-2-methoxyphenylcarbonyloxy)ethyl]-4-(3-{1-[2-(4-amino-5-chloro-2-methoxyphenylcarbonyloxy)ethyl]hexahydro-4-pyridinylcarboxamidomethyl}benzylcarbamoyl)hexahydropyridine
Inchi Key	BBFDGHWDPNCAJJ-UHFFFAOYSA-N
Inchi ID	InChI=1S/C40H50Cl2N6O8/c1-53-35-21-33(43)31(41)19-29(35)39(51)55-16-14-47-10-6-27(7-11-47)37(49)45-23-25-4-3-5-26(18-25)24-46-38(50)28-8-12-48(13-9-28)15-17-56-40(52)30-20-32(42)34(44)22-36(30)54-2/h3-5,18-22,27-28H,6-17,23-24,43-44H2,1-2H3,(H,45,49)(H,46,50)
PubChem CID	11629247
ChEMBL	CHEMBL198668
IUPHAR	N/A
BindingDB	50174432
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand has more than 10 hydrogen bond acceptor. This ligand is heavier than 500 daltons.

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
19445	5-hydroxytryptamine receptor 4	Q13639	HTR4	Homo sapiens (Human)	388

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