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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	CHEMBL163816
Molecular formula	C27H28N6O6S2
IUPAC name	2-[[4-[2-[2-(1H-indol-3-yl)ethylcarbamothioyl]hydrazinyl]-3-nitrophenyl]sulfonyl-(2-phenylethyl)amino]acetic acid
Molecular weight	596.677
Hydrogen bond acceptor	9
Hydrogen bond donor	5
XlogP	5.0
Synonyms	BDBM50097731 N-[3-Nitro-4-[3-[2-(1H-indole-3-yl)ethyl]thioureidoamino]phenylsulfonyl]-N-phenethylglycine
Inchi Key	NUUDJVDHKBFIIC-UHFFFAOYSA-N
Inchi ID	InChI=1S/C27H28N6O6S2/c34-26(35)18-32(15-13-19-6-2-1-3-7-19)41(38,39)21-10-11-24(25(16-21)33(36)37)30-31-27(40)28-14-12-20-17-29-23-9-5-4-8-22(20)23/h1-11,16-17,29-30H,12-15,18H2,(H,34,35)(H2,28,31,40)
PubChem CID	44375216
ChEMBL	CHEMBL163816
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
232680	B2 bradykinin receptor	P25023	Bdkrb2	Rattus norvegicus (Rat)	396
232681	Gastrin/cholecystokinin type B receptor	P56481	Cckbr	Mus musculus (Mouse)	453

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