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. Author manuscript; available in PMC: 2010 Jan 15.
Published in final edited form as: J Chem Inf Model. 2008 Jul 8;48(7):1311–1324. doi: 10.1021/ci700342h

Table 5.

For each database, the percentage of molecules that do not contain rings, the maximum number of rings found in a single compound, and the population of molecules that possess at least one 5- or 6-node.

Database % no rings Maximum rings > 4-nodes population
ChemNavigator 0.245 62 95
DNP 8.633 32 61
Drugs 6.492 18 0
PubChem 2.466 165 6488
PC actives 3.837 23 198
DSSTox 25.057 11 0
WOMBAT 1.641 34 0

merged 1.225 165 6593

GDB 15.414 6 0