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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	CHEMBL301147
Molecular formula	C33H37ClN4O5
IUPAC name	ethyl 1-[(2S)-1-[4-[[2-butyl-4-chloro-5-(2-methoxy-2-oxoethyl)imidazol-1-yl]methyl]anilino]-1-oxo-3-phenylpropan-2-yl]pyrrole-3-carboxylate
Molecular weight	605.132
Hydrogen bond acceptor	6
Hydrogen bond donor	1
XlogP	6.1
Synonyms	1-[4-[[(2S)-2-(3-Ethoxycarbonyl-1H-pyrrol-1-yl)-3-phenyl-1-oxopropyl]amino]benzyl]-2-butyl-4-chloro-1H-imidazole-5-acetic acid methyl ester
Inchi Key	DDEOOVQJXFDRHJ-NDEPHWFRSA-N
Inchi ID	InChI=1S/C33H37ClN4O5/c1-4-6-12-29-36-31(34)27(20-30(39)42-3)38(29)21-24-13-15-26(16-14-24)35-32(40)28(19-23-10-8-7-9-11-23)37-18-17-25(22-37)33(41)43-5-2/h7-11,13-18,22,28H,4-6,12,19-21H2,1-3H3,(H,35,40)/t28-/m0/s1
PubChem CID	44293940
ChEMBL	CHEMBL301147
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
57026	Type-1B angiotensin II receptor	P29089	Agtr1b	Rattus norvegicus (Rat)	359

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