Table 4.
Compounds from Animalia and their inclusion within the defined chemical spaces.
Overall | Lead-Like Space | Drug-Like Space | Known Drug Space |
---|---|---|---|
Molecular weight (g mol−1) | 12.5% | 58.7% | 78.8% |
Lipophilicity (Log P) | 31.7% | 61.5% | 80.8% |
Hydrogen bond donors | 75.0% | 84.6% | 84.6% |
Hydrogen bond acceptors | 22.1% | 75.0% | 81.7% |
Polar surface area (Å2) | 31.7% | 65.4% | 82.7% |
Rotatable bonds | 12.5% | 42.3% | 71.2% |
All criteria | 1.0% | 21.2% | 54.8% |