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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	CHEMBL2114965
Molecular formula	C34H38Cl2N2O6S
IUPAC name	[(2S)-2-(3,4-dichlorophenyl)-2-[2-[(2S)-2-oxospiro[1H-2-benzothiophene-3,4'-piperidine]-1'-yl]ethyl]morpholin-4-yl]-(3,4,5-trimethoxyphenyl)methanone
Molecular weight	673.646
Hydrogen bond acceptor	8
Hydrogen bond donor	0
XlogP	4.7
Synonyms	BDBM50403791
Inchi Key	RWSBBXFLRGQFQP-PWOKGZDBSA-N
Inchi ID	InChI=1S/C34H38Cl2N2O6S/c1-41-29-18-24(19-30(42-2)31(29)43-3)32(39)38-16-17-44-33(22-38,25-8-9-27(35)28(36)20-25)10-13-37-14-11-34(12-15-37)26-7-5-4-6-23(26)21-45(34)40/h4-9,18-20H,10-17,21-22H2,1-3H3/t33-,45+/m1/s1
PubChem CID	71454552
ChEMBL	CHEMBL2114965
IUPHAR	N/A
BindingDB	50403791
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
306973	Neuromedin-K receptor	P30098	TACR3	Cavia porcellus (Guinea pig)	440
306975	Substance-K receptor	Q64077	TACR2	Cavia porcellus (Guinea pig)	402
306974	Substance-P receptor	P30547	TACR1	Cavia porcellus (Guinea pig)	407

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