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Ligand

NameSCHEMBL6448917
Molecular formulaC31H31N3O5S
IUPAC namemethyl 5-[(2,4-dioxo-1,3-thiazolidin-5-yl)methyl]-2-[2-(4-methyl-6-phenyl-2-propylbenzimidazol-1-yl)ethoxy]benzoate
Molecular weight557.665
Hydrogen bond acceptor7
Hydrogen bond donor1
XlogP6.2
SynonymsCHEMBL2260188
Inchi KeyMARBDPRGPCDNDA-UHFFFAOYSA-N
Inchi IDInChI=1S/C31H31N3O5S/c1-4-8-27-32-28-19(2)15-22(21-9-6-5-7-10-21)18-24(28)34(27)13-14-39-25-12-11-20(16-23(25)30(36)38-3)17-26-29(35)33-31(37)40-26/h5-7,9-12,15-16,18,26H,4,8,13-14,17H2,1-3H3,(H,33,35,37)
PubChem CID10053470
ChEMBLCHEMBL2260188
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.
This ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
200948Type-1A angiotensin II receptorP25095Agtr1Rattus norvegicus (Rat)359

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