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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	CHEMBL567198
Molecular formula	C27H34Cl3N3O2
IUPAC name	4-[4-[acetyl(methyl)amino]piperidin-1-yl]-N-[(2-chlorophenyl)methyl]-2-(3,4-dichlorophenyl)-N,2-dimethylbutanamide
Molecular weight	538.938
Hydrogen bond acceptor	3
Hydrogen bond donor	0
XlogP	5.5
Synonyms	BDBM50299470 SCHEMBL297642 4-[4-(acetylmethyl-amino)-piperidin-1-yl]-N-(2-chloro-benzyl)-2-(3,4-dichlorophenyl)-2,N-dimethylbutyramide
Inchi Key	OZJDKUMSRQSURZ-UHFFFAOYSA-N
Inchi ID	InChI=1S/C27H34Cl3N3O2/c1-19(34)32(4)22-11-14-33(15-12-22)16-13-27(2,21-9-10-24(29)25(30)17-21)26(35)31(3)18-20-7-5-6-8-23(20)28/h5-10,17,22H,11-16,18H2,1-4H3
PubChem CID	44550460
ChEMBL	CHEMBL567198
IUPHAR	N/A
BindingDB	50299470
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand is heavier than 500 daltons. This ligand has a partition coefficient log P greater than 5.

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
254002	Neuromedin-K receptor	P30098	TACR3	Cavia porcellus (Guinea pig)	440
254003	Neuromedin-K receptor	P29371	TACR3	Homo sapiens (Human)	465
254004	Substance-K receptor	P21452	TACR2	Homo sapiens (Human)	398
254005	Substance-P receptor	P25103	TACR1	Homo sapiens (Human)	407

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