CC	combinatorial chemistry
HTS	high-throughput screening
VS	virtual screening
HTVS	high-throughput virtual screening
ADME	absorption, distribution, metabolism, and excretion
MW	molecular weight
Ro4	Rule-of-4
Ro5	Rule-of-5
Ro3	Rule-of-3
SDF	structure-data file format
MOL	MDL Molfile
SMILES	simplified molecular input line entry specification format
SMARTS	SMILES arbitrary target specification
KNIME	Konstanz Information Miner
SD	standard deviations
SMR	molecular refractivity
TPSA	total polar surface area
MW	molecular weight
HBA	No. of hydrogen bond acceptors
HBD	No. of hydrogen bond donors
REOS	rapid elimination of swill
PAINS	pan-assay interference compounds
CNS	central nervous system