compound 1 [PMID: 37741852]



compound 1 [PMID: 37741852]


SMILES CCOC1=CC(C)=NC(=N1)N(CCOC)S(=O)(=O)C2=CC=C(NCC3=C(F)C=NC=C3F)N=C2OC
InChIKey APXQLSSVLHYGGM-UHFFFAOYSA-N

Chemical Properties

Hydrogen bond acceptors 10
Hydrogen bond donors 1
Rotatable bonds 12
Molecular weight (Da) 524.2

Database connections

Structure pdb 8TB7

Bioactivities

Receptor Activity Source
Protein Gene Species Family Class Type Min Avg Max Database
Receptor Activity Source
Protein Gene Species Family Class Type Min Avg Max Database

compound 1 [PMID: 37741852]


Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug No

Clinical Trials

Phase I 0
Phase II 0
Phase III 0
Approved No

Database connections

Structure pdb 8TB7

Sankey plot

Compound is not listed as a drug.