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Ligand

NameCHEMBL400424
Molecular formulaC24H23N7O2
IUPAC name2-butyl-3-[[4-[2-(2H-tetrazol-5-yl)pyrrol-1-yl]phenyl]methyl]benzimidazole-4-carboxylic acid
Molecular weight441.495
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP3.9
Synonyms2-Butyl-1-[[4-[2-(1H-tetrazol-5-yl)-1-pyrrolyl]phenyl]methyl]benzimidazole-7-carboxylic acid
SCHEMBL7007856
ACUBPBCHAVPOHH-UHFFFAOYSA-N
3-(4-(2-(1H-tetrazol-5-yl)-1H-pyrrol-1-yl)benzyl)-2-butyl-3H-benzo[d]imidazole-4-carboxylic acid
BDBM50209823
[ Show all ]
Inchi KeyACUBPBCHAVPOHH-UHFFFAOYSA-N
Inchi IDInChI=1S/C24H23N7O2/c1-2-3-9-21-25-19-7-4-6-18(24(32)33)22(19)31(21)15-16-10-12-17(13-11-16)30-14-5-8-20(30)23-26-28-29-27-23/h4-8,10-14H,2-3,9,15H2,1H3,(H,32,33)(H,26,27,28,29)
PubChem CID15224471
ChEMBLCHEMBL400424
IUPHARN/A
BindingDB50209823
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
1937Type-1 angiotensin II receptorP34976AGTR1Oryctolagus cuniculus (Rabbit)359
1938Type-1 angiotensin II receptorP25104AGTR1Bos taurus (Bovine)359

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