Oprea1_724488



Oprea1_724488


SMILES CCNC(=O)C1C(C(C(O1)N2C=NC3=C(N=CN=C32)NCC4=CC=CC=C4C)O)O
InChIKey HBTMNVJREDWGSK-UHFFFAOYSA-N

Chemical Properties

Hydrogen bond acceptors 9
Hydrogen bond donors 4
Rotatable bonds 6
Molecular weight (Da) 412.2

Database connections

Ligand site mutations A2A

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

Oprea1_724488


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

Ligand site mutations A2A

Sankey plot

Compound is not listed as a drug.