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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	CHEMBL54540
Molecular formula	C30H31Cl4N3O4S
IUPAC name	(2S)-3-[(3,4-dichlorophenyl)methoxy]-2-[(3,4-dichlorophenyl)methylamino]-1-(1-methylsulfonylspiro[2H-indole-3,4'-piperidine]-1'-yl)propan-1-one
Molecular weight	671.455
Hydrogen bond acceptor	6
Hydrogen bond donor	1
XlogP	5.9
Synonyms	BDBM50070966 2-(3,4-dichlorobenzylamino)-3-(3,4-dichlorobenzyloxy)-1-[1-methylsulfonylspiro[2,3-dihydro-1H-indole-3,4''-(hexahydropyridine)]-1-yl]-(2S)-propan-1-one
Inchi Key	AIYKBTXDRPARHM-MHZLTWQESA-N
Inchi ID	InChI=1S/C30H31Cl4N3O4S/c1-42(39,40)37-19-30(22-4-2-3-5-28(22)37)10-12-36(13-11-30)29(38)27(35-16-20-6-8-23(31)25(33)14-20)18-41-17-21-7-9-24(32)26(34)15-21/h2-9,14-15,27,35H,10-13,16-19H2,1H3/t27-/m0/s1
PubChem CID	10394703
ChEMBL	CHEMBL54540
IUPHAR	N/A
BindingDB	50070966
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
6649	Substance-P receptor	P25103	TACR1	Homo sapiens (Human)	407

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