| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 4th, 2009 | 21 | 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) | -2.95 | -0.53 | -472.61 | 1 | 12 | -5 | 214 | 367.056 | 6 | ↓ |
| Mid Mid (pH 6-8) | -2.95 | 0.62 | -629.66 | 0 | 12 | -6 | 217 | 366.048 | 6 | ↓ |
| Mid Mid (pH 6-8) | -2.95 | -1.67 | -316.71 | 2 | 12 | -4 | 212 | 368.064 | 6 | ↓ |
| Lo Low (pH 4.5-6) | -2.95 | -2.82 | -190.89 | 3 | 12 | -3 | 209 | 369.072 | 6 | ↓ |
