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Ligand

NameCHEMBL92821
Molecular formulaC30H29ClN6O2
IUPAC nameethyl 5-butyl-2-(2-chlorophenyl)-4-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]pyrazole-3-carboxylate
Molecular weight541.052
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP7.6
Synonyms1-(2-Chlorophenyl)-3-butyl-4-[2'-(1H-tetrazole-5-yl)-4-biphenylylmethyl]-1H-pyrazole-5-carboxylic acid ethyl ester
BDBM50042561
SCHEMBL9527894
5-Butyl-2-(2-chloro-phenyl)-4-[2''-(1H-tetrazol-5-yl)-biphenyl-4-ylmethyl]-2H-pyrazole-3-carboxylic acid ethyl ester
Inchi KeyBGVVQFKZMVLQSY-UHFFFAOYSA-N
Inchi IDInChI=1S/C30H29ClN6O2/c1-3-5-13-26-24(28(30(38)39-4-2)37(34-26)27-14-9-8-12-25(27)31)19-20-15-17-21(18-16-20)22-10-6-7-11-23(22)29-32-35-36-33-29/h6-12,14-18H,3-5,13,19H2,1-2H3,(H,32,33,35,36)
PubChem CID9958963
ChEMBLCHEMBL92821
IUPHARN/A
BindingDB50042561
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
23471Type-1 angiotensin II receptorP34976AGTR1Oryctolagus cuniculus (Rabbit)359

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