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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	SCHEMBL256565
Molecular formula	C25H29ClF3N5O5S
IUPAC name	tert-butyl N-[2-[[2-[3-(5-chlorothiophen-2-yl)-4-(2-methoxyethyl)-5-oxo-1,2,4-triazol-1-yl]acetyl]amino]-1-[2-(trifluoromethyl)phenyl]ethyl]carbamate
Molecular weight	604.042
Hydrogen bond acceptor	10
Hydrogen bond donor	2
XlogP	4.5
Synonyms	BDBM190362 tert-Butyl {2-({[3-(5-chloro-2-thienyl)-4-(2-methoxyethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]acetyl}amino)-1-[2-(trifluoromethyl)phenyl]ethyl}carbamate AAPSBWWMCXOCQQ-UHFFFAOYSA-N CHEMBL3965109 US9180120, 66
Inchi Key	AAPSBWWMCXOCQQ-UHFFFAOYSA-N
Inchi ID	InChI=1S/C25H29ClF3N5O5S/c1-24(2,3)39-22(36)31-17(15-7-5-6-8-16(15)25(27,28)29)13-30-20(35)14-34-23(37)33(11-12-38-4)21(32-34)18-9-10-19(26)40-18/h5-10,17H,11-14H2,1-4H3,(H,30,35)(H,31,36)
PubChem CID	56848685
ChEMBL	CHEMBL3965109
IUPHAR	N/A
BindingDB	190362
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
535911	Vasopressin V1a receptor	P37288	AVPR1A	Homo sapiens (Human)	418
535910	Vasopressin V2 receptor	P30518	AVPR2	Homo sapiens (Human)	371

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