| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 1st, 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) | 0.97 | 7.04 | -108.7 | 5 | 4 | 2 | 49 | 286.423 | 2 | ↓ |
| Hi High (pH 8-9.5) | 0.97 | 4.97 | -6.25 | 3 | 4 | 0 | 46 | 284.407 | 2 | ↓ |
| Mid Mid (pH 6-8) | 0.97 | 7.25 | -39.7 | 4 | 4 | 1 | 47 | 285.415 | 2 | ↓ |
