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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	CHEMBL3275931
Molecular formula	C66H81N13O14
IUPAC name	(3S)-4-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S,3S)-1-[[(2S)-1-[(2S)-2-[[(1S)-1-carboxy-2-phenylethyl]carbamoyl]pyrrolidin-1-yl]-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]amino]-3-methyl-1-oxopentan-2-yl]amino]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]amino]-3-(2-hydroxy-3-oxo-2,4-diphenylpyrrol-1-yl)-4-oxobutanoic acid
Molecular weight	1280.45
Hydrogen bond acceptor	17
Hydrogen bond donor	13
XlogP	4.1
Synonyms	N/A
Inchi Key	ATLXITDKIZNILM-YIFZSSHNSA-N
Inchi ID	InChI=1S/C66H81N13O14/c1-5-39(4)55(62(89)74-49(33-44-35-69-37-71-44)63(90)78-30-16-24-51(78)59(86)75-50(64(91)92)32-40-17-9-6-10-18-40)77-58(85)48(31-41-25-27-45(80)28-26-41)73-61(88)54(38(2)3)76-57(84)47(23-15-29-70-65(67)68)72-60(87)52(34-53(81)82)79-36-46(42-19-11-7-12-20-42)56(83)66(79,93)43-21-13-8-14-22-43/h6-14,17-22,25-28,35-39,47-52,54-55,80,93H,5,15-16,23-24,29-34H2,1-4H3,(H,69,71)(H,72,87)(H,73,88)(H,74,89)(H,75,86)(H,76,84)(H,77,85)(H,81,82)(H,91,92)(H4,67,68,70)/t39-,47-,48-,49-,50-,51-,52-,54-,55-,66?/m0/s1
PubChem CID	90679288
ChEMBL	CHEMBL3275931
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
14080	Type-1 angiotensin II receptor	P34976	AGTR1	Oryctolagus cuniculus (Rabbit)	359

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