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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	CHEMBL172354
Molecular formula	C30H36N4O5
IUPAC name	2-[(2S,5S)-5-benzyl-1-[(2S)-2-[3-(1H-indol-3-yl)propanoylamino]-4-methylpentanoyl]-3-oxopiperazin-2-yl]acetic acid
Molecular weight	532.641
Hydrogen bond acceptor	5
Hydrogen bond donor	4
XlogP	3.5
Synonyms	BDBM50284153 {(2S,5S)-5-Benzyl-1-[(S)-2-(3-1H-indol-3-yl-propionylamino)-4-methyl-pentanoyl]-3-oxo-piperazin-2-yl}-acetic acid
Inchi Key	NZIAQNWQWOCPMT-HRNNMHKYSA-N
Inchi ID	InChI=1S/C30H36N4O5/c1-19(2)14-25(33-27(35)13-12-21-17-31-24-11-7-6-10-23(21)24)30(39)34-18-22(15-20-8-4-3-5-9-20)32-29(38)26(34)16-28(36)37/h3-11,17,19,22,25-26,31H,12-16,18H2,1-2H3,(H,32,38)(H,33,35)(H,36,37)/t22-,25-,26-/m0/s1
PubChem CID	44382749
ChEMBL	CHEMBL172354
IUPHAR	N/A
BindingDB	50284153
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
235749	Cholecystokinin receptor type A	O08786	Cckar	Mus musculus (Mouse)	436
235750	Gastrin/cholecystokinin type B receptor	P56481	Cckbr	Mus musculus (Mouse)	453

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