All the descriptors were calculated with the cheminformatics library JOELib2.

GeometricalDiameter 
LogP 
TopologicalDiameter 
HBD1 
HBD2 
HBA1 
HBA2 
BasicGroups 
GraphShapeCoefficient 
ZagrebIndex1 
GeometricalShapeCoefficient 
PolarSurfaceArea 
NO2Groups 
HeavyBonds 
AromaticOHGroups 
SO2Groups 
AromaticBonds 
NumberOfBonds 
HeteroCycles 
FractionRotatableBonds 
NumberOfAtoms 
TopologicalRadius 
KierShape1 
KierShape2 
KierShape3 
MolarRefractivity 
NumberOfHal 
MolecularWeight 
RotatableBonds 
GeometricalRadius 
OSOGroups 
HydrophobicGroups 
AliphaticOHGroups 
SSSR_Counter 
NumberOfCL 
NumberOfBr 
NumberOfS 
NumberOfP 
NumberOfO 
NumberOfN 
NumberOfI 
NumberOfF 
NumberOfC 
NumberOfB 
Pharmacophoric fingerprint
class