| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 18th, 2009 | 32 | No |
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 3.67 | 10.5 | -13.75 | 1 | 6 | 0 | 40 | 456.656 | 11 | ↓ |
| Mid Mid (pH 6-8) | 3.67 | 12.95 | -56.25 | 2 | 6 | 1 | 41 | 457.664 | 11 | ↓ |
| Lo Low (pH 4.5-6) | 3.67 | 13.69 | -81.75 | 3 | 6 | 0 | 43 | 458.672 | 11 | ↓ |
