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Ligand

NameCHEMBL319730
Molecular formulaC37H37Cl2N5O5S
IUPAC nameN-[2-[4-[[3-butyl-1-[2-chloro-5-(propanoylamino)phenyl]-5-oxo-1,2,4-triazol-4-yl]methyl]phenyl]-4-ethylphenyl]sulfonyl-2-chlorobenzamide
Molecular weight734.693
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP7.7
SynonymsAEPYFWHKXWJXGU-UHFFFAOYSA-N
5-n-Butyl-4-[[2'-[N-(2-chlorobenzoyl)sulfamoyl]-5'-ethylbiphenyl-4-yl]methyl]-2-[2-chloro-5-(propionylamino)phenyl]-2,4-dihydro-3H-1,2,4-triazol-3-on
BDBM50283759
N-(3-{3-Butyl-4-[2''-(2-chloro-benzoylsulfamoyl)-5''-ethyl-biphenyl-4-ylmethyl]-5-oxo-4,5-dihydro-[1,2,4]triazol-1-yl}-4-chloro-phenyl)-propionamide
SCHEMBL9143939
Inchi KeyAEPYFWHKXWJXGU-UHFFFAOYSA-N
Inchi IDInChI=1S/C37H37Cl2N5O5S/c1-4-7-12-34-41-44(32-22-27(18-19-31(32)39)40-35(45)6-3)37(47)43(34)23-25-13-16-26(17-14-25)29-21-24(5-2)15-20-33(29)50(48,49)42-36(46)28-10-8-9-11-30(28)38/h8-11,13-22H,4-7,12,23H2,1-3H3,(H,40,45)(H,42,46)
PubChem CID19939418
ChEMBLCHEMBL319730
IUPHARN/A
BindingDB50283759
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
3734Type-1 angiotensin II receptorP34976AGTR1Oryctolagus cuniculus (Rabbit)359
3735Type-2 angiotensin II receptorP35351Agtr2Rattus norvegicus (Rat)363

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