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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	CHEMBL163506
Molecular formula	C29H27N5O6S2
IUPAC name	2-[[4-[2-(benzhydrylcarbamothioyl)hydrazinyl]-3-nitrophenyl]sulfonyl-benzylamino]acetic acid
Molecular weight	605.684
Hydrogen bond acceptor	9
Hydrogen bond donor	4
XlogP	5.7
Synonyms	N-[3-Nitro-4-[2-(benzhydrylthiocarbamoyl)hydrazino]phenylsulfonyl]-N-benzylglycine BDBM50097740
Inchi Key	NZHNZHDVZIVCNG-UHFFFAOYSA-N
Inchi ID	InChI=1S/C29H27N5O6S2/c35-27(36)20-33(19-21-10-4-1-5-11-21)42(39,40)24-16-17-25(26(18-24)34(37)38)31-32-29(41)30-28(22-12-6-2-7-13-22)23-14-8-3-9-15-23/h1-18,28,31H,19-20H2,(H,35,36)(H2,30,32,41)
PubChem CID	44375675
ChEMBL	CHEMBL163506
IUPHAR	N/A
BindingDB	N/A
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
235731	B2 bradykinin receptor	P25023	Bdkrb2	Rattus norvegicus (Rat)	396
235730	Gastrin/cholecystokinin type B receptor	P56481	Cckbr	Mus musculus (Mouse)	453

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