Molecule Details
InChIKeyIJGCUOYSJNXEAC-UHFFFAOYSA-N
Compound Nametert-butyl N-[2-[4-[[1-[2-bromo-5-(pentanoylamino)phenyl]-3-methyl-5-oxo-1,2,4-triazol-4-yl]methyl]-3-fluorophenyl]phenyl]sulfonylcarbamate
Canonical SMILESCCCCC(=O)Nc1ccc(Br)c(-n2nc(C)n(Cc3ccc(-c4ccccc4S(=O)(=O)NC(=O)OC(C)(C)C)cc3F)c2=O)c1
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)2
Pfam Stratification Homologous
Avg pChEMBL8.78
SourceChEMBL;BindingDB
2D Structure
2D structure
Activity Profile
Target Activities (2)
Target Gene Organism Category Pfam pChEMBL Type Source
P30556 AGTR1 Homo sapiens Human PF00001 8.9 IC50 ChEMBL;BindingDB
P50052 AGTR2 Homo sapiens Human PF00001 8.7 IC50 ChEMBL;BindingDB