Hydrophobic parameter calculation reference value (XlogP) :-0.5

Number of hydrogen bond donors :1

Number of hydrogen bond receptors :2

Number of rotatable bonds :2

Accurate quality :84.068748

Isotope mass :84.068748

Topological molecular polar surface area (TPSA) :35.8

Number of heavy atoms :6

Formal charge :0

Complexity :59.2

Number of isotope atoms :0

Determine the number of protonic centers :0

Number of uncertain protonic centers :0

Determine the number of chemical bond stereocenter :0

Number of uncertain bond stereocentes :0

Number of covalent bond units :1

Number of functional 3d receptors :1

Function 3 d Number of donors :1

Function 3 d Number of cations :1

Number of active rotors :2

Conformational isomer sampling RMSD:0.4

Number of CID isomers :7