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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	CHEMBL1779419
Molecular formula	C31H31ClN4O6S
IUPAC name	(3R)-5-chloro-3-[2-methoxy-5-(methylaminomethyl)phenyl]-1-(4-methoxyphenyl)sulfonyl-3-[(2S)-2-(1,3-oxazol-2-yl)pyrrolidin-1-yl]indol-2-one
Molecular weight	623.121
Hydrogen bond acceptor	9
Hydrogen bond donor	1
XlogP	4.1
Synonyms	BDBM50345141 (R)-5-chloro-3-(2-methoxy-5-((methylamino)methyl)phenyl)-1-(4-methoxyphenylsulfonyl)-3-((S)-2-(oxazol-2-yl)pyrrolidin-1-yl)indolin-2-one
Inchi Key	CCDGXHHJZYGCCT-JTSJOTPCSA-N
Inchi ID	InChI=1S/C31H31ClN4O6S/c1-33-19-20-6-13-28(41-3)25(17-20)31(35-15-4-5-27(35)29-34-14-16-42-29)24-18-21(32)7-12-26(24)36(30(31)37)43(38,39)23-10-8-22(40-2)9-11-23/h6-14,16-18,27,33H,4-5,15,19H2,1-3H3/t27-,31+/m0/s1
PubChem CID	54582526
ChEMBL	CHEMBL1779419
IUPHAR	N/A
BindingDB	50345141
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
38473	Oxytocin receptor	P30559	OXTR	Homo sapiens (Human)	389
38474	Vasopressin V1a receptor	P37288	AVPR1A	Homo sapiens (Human)	418
38475	Vasopressin V1b receptor	P47901	AVPR1B	Homo sapiens (Human)	424
38472	Vasopressin V2 receptor	P30518	AVPR2	Homo sapiens (Human)	371

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