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Ligand

NameCHEMBL341934
Molecular formulaC36H35Cl2N5O5S
IUPAC nameN-[2-[4-[[1-[5-(butanoylamino)-2-chlorophenyl]-3-butyl-5-oxo-1,2,4-triazol-4-yl]methyl]phenyl]phenyl]sulfonyl-2-chlorobenzamide
Molecular weight720.666
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP7.3
SynonymsBDBM50035456
5-n-Butyl-2-[5-(butyrylamino)-2-chlorophenyl]-4-[[2'-[N-(2-chlorobenzoyl)-sulfamoyl]biphenyl-4-yl]methyl]-2,4-dihydro-3H-1,2,4-triazol-3-one
SCHEMBL9146443
CFQAEPBVILLRIS-UHFFFAOYSA-N
N-(2-Chlorobenzoyl)-4'-[[3-butyl-5-oxo-1-[2-chloro-5-(butyrylamino)phenyl]-1H-1,2,4-triazol-4(5H)-yl]methyl]-1,1'-biphenyl-2-sulfonamide
[ Show all ]
Inchi KeyCFQAEPBVILLRIS-UHFFFAOYSA-N
Inchi IDInChI=1S/C36H35Cl2N5O5S/c1-3-5-15-33-40-43(31-22-26(20-21-30(31)38)39-34(44)10-4-2)36(46)42(33)23-24-16-18-25(19-17-24)27-11-7-9-14-32(27)49(47,48)41-35(45)28-12-6-8-13-29(28)37/h6-9,11-14,16-22H,3-5,10,15,23H2,1-2H3,(H,39,44)(H,41,45)
PubChem CID10439862
ChEMBLCHEMBL341934
IUPHARN/A
BindingDB50035456
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
40873Type-1 angiotensin II receptorP34976AGTR1Oryctolagus cuniculus (Rabbit)359
40874Type-2 angiotensin II receptorP35351Agtr2Rattus norvegicus (Rat)363

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