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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	CHEMBL3974259
Molecular formula	C72H115N21O22S2
IUPAC name	(2S)-2-[[2-[[2-[2-[2-[[2-[2-[2-[[2-[[(2R)-3-(acetamidomethylsulfanyl)-2-[[(2S)-2-[[2-(dimethylamino)acetyl]amino]-3-hydroxypropanoyl]amino]propanoyl]amino]acetyl]amino]ethoxy]ethoxy]acetyl]amino]ethoxy]ethoxy]acetyl]amino]acetyl]amino]-N-[(2S)-1-[[(2S)-1-[[(2S)-1-[[2-[[(2S)-1-[[(2S)-1-[[(2S)-1-amino-4-methylsulfanyl-1-oxobutan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]amino]-2-oxoethyl]amino]-3-methyl-1-oxobutan-2-yl]amino]-1-oxopropan-2-yl]amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]pentanediamide
Molecular weight	1690.96
Hydrogen bond acceptor	26
Hydrogen bond donor	20
XlogP	-5.0
Synonyms	N/A
Inchi Key	FMWJTIDTHDJCOK-RITIOPCCSA-N
Inchi ID	InChI=1S/C72H115N21O22S2/c1-41(2)26-51(69(108)88-49(64(74)103)16-25-116-9)89-70(109)53(28-46-30-75-39-82-46)86-59(99)33-81-72(111)63(42(3)4)92-65(104)43(5)84-68(107)52(27-45-29-78-48-13-11-10-12-47(45)48)90-67(106)50(14-15-56(73)96)85-58(98)32-79-62(102)37-115-24-22-113-20-18-77-61(101)36-114-23-21-112-19-17-76-57(97)31-80-66(105)55(38-117-40-83-44(6)95)91-71(110)54(35-94)87-60(100)34-93(7)8/h10-13,29-30,39,41-43,49-55,63,78,94H,14-28,31-38,40H2,1-9H3,(H2,73,96)(H2,74,103)(H,75,82)(H,76,97)(H,77,101)(H,79,102)(H,80,105)(H,81,111)(H,83,95)(H,84,107)(H,85,98)(H,86,99)(H,87,100)(H,88,108)(H,89,109)(H,90,106)(H,91,110)(H,92,104)/t43-,49-,50-,51-,52-,53-,54-,55-,63-/m0/s1
PubChem CID	134153943
ChEMBL	CHEMBL3974259
IUPHAR	N/A
BindingDB	N/A
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand has more than 5 hydrogen bond donor. This ligand has more than 10 hydrogen bond acceptor. 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
548858	Gastrin-releasing peptide receptor	P30550	GRPR	Homo sapiens (Human)	384

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