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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	SMR000634331
Molecular formula	C26H30N4O5S
IUPAC name	7-[6-[4-(3-methoxyphenyl)piperazin-1-yl]-6-oxohexyl]-6-sulfanylidene-5H-[1,3]dioxolo[4,5-g]quinazolin-8-one
Molecular weight	510.609
Hydrogen bond acceptor	7
Hydrogen bond donor	1
XlogP	3.1
Synonyms	7-(6-(4-(3-methoxyphenyl)piperazin-1-yl)-6-oxohexyl)-6-thioxo-6,7-dihydro-[1,3]dioxolo[4,5-g]quinazolin-8(5H)-one MCULE-7344905632 MolPort-007-912-013 F3168-1981 SR-01000559929-1 7-{6-[4-(3-methoxyphenyl)piperazin-1-yl]-6-oxohexyl}-6-thioxo-6,7-dihydro[1,3]dioxolo[4,5-g]quinazolin-8(5H)-one MLS001029371 CHEMBL1413061 HMS2942K11 ZINC15962849 AKOS002103456 MLS003881777 EU-0094562 SR-01000559929 [ Show all ]
Inchi Key	ADFQVBGUPIOXRT-UHFFFAOYSA-N
Inchi ID	InChI=1S/C26H30N4O5S/c1-33-19-7-5-6-18(14-19)28-10-12-29(13-11-28)24(31)8-3-2-4-9-30-25(32)20-15-22-23(35-17-34-22)16-21(20)27-26(30)36/h5-7,14-16H,2-4,8-13,17H2,1H3,(H,27,36)
PubChem CID	15996885
ChEMBL	CHEMBL1413061
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
2234	Relaxin receptor 1	Q9HBX9	RXFP1	Homo sapiens (Human)	757

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