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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	CHEMBL339575
Molecular formula	C36H35Cl2N3O4S
IUPAC name	4-[1-[(3S)-4-[(3-cyanonaphthalene-1-carbonyl)-methylamino]-3-(3,4-dichlorophenyl)butyl]piperidin-4-yl]-3-methylsulfinylbenzoic acid
Molecular weight	676.653
Hydrogen bond acceptor	7
Hydrogen bond donor	1
XlogP	4.4
Synonyms	N/A
Inchi Key	GQMYDNHVSUXMFN-WDGVMLFESA-N
Inchi ID	InChI=1S/C36H35Cl2N3O4S/c1-40(35(42)31-18-23(21-39)17-26-5-3-4-6-29(26)31)22-28(25-8-10-32(37)33(38)19-25)13-16-41-14-11-24(12-15-41)30-9-7-27(36(43)44)20-34(30)46(2)45/h3-10,17-20,24,28H,11-16,22H2,1-2H3,(H,43,44)/t28-,46?/m1/s1
PubChem CID	11735060
ChEMBL	CHEMBL339575
IUPHAR	N/A
BindingDB	N/A
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
102778	Substance-K receptor	P79218	TACR2	Oryctolagus cuniculus (Rabbit)	384
102777	Substance-P receptor	P25103	TACR1	Homo sapiens (Human)	407

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