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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	CHEMBL553451
Molecular formula	C38H47Cl2N5O5
IUPAC name	[(3R)-3-(3,4-dichlorophenyl)-3-[2-[4-(4-methylpiperazine-1-carbonyl)-4-pyridin-3-ylpiperidin-1-yl]ethyl]pyrrolidin-1-yl]-(3,4,5-trimethoxyphenyl)methanone
Molecular weight	724.724
Hydrogen bond acceptor	8
Hydrogen bond donor	0
XlogP	5.0
Synonyms	CHEMBL1194867 BDBM50290313 (1''-{2-[(R)-3-(3,4-Dichloro-phenyl)-1-(3,4,5-trimethoxy-benzoyl)-pyrrolidin-3-yl]-ethyl}-2'',3'',5'',6''-tetrahydro-1''H-[3,4'']bipyridinyl-4''-yl)-(4-methyl-piperazin-1-yl)-methanone; hydrochloride
Inchi Key	IVVCZKUEEUXLCC-QNGWXLTQSA-N
Inchi ID	InChI=1S/C38H47Cl2N5O5/c1-42-18-20-44(21-19-42)36(47)38(29-6-5-13-41-25-29)11-15-43(16-12-38)14-9-37(28-7-8-30(39)31(40)24-28)10-17-45(26-37)35(46)27-22-32(48-2)34(50-4)33(23-27)49-3/h5-8,13,22-25H,9-12,14-21,26H2,1-4H3/t37-/m0/s1
PubChem CID	44319084
ChEMBL	N/A
IUPHAR	N/A
BindingDB	50290313
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	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
143009	Substance-K receptor	P30549	Tacr2	Mus musculus (Mouse)	384
143010	Substance-P receptor	P30547	TACR1	Cavia porcellus (Guinea pig)	407

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