| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2011 | 21 | Yes |
| 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) | 2.58 | 2.98 | -34.31 | 3 | 4 | 1 | 49 | 299.479 | 8 | ↓ |
| Hi High (pH 8-9.5) | 2.58 | 1.74 | -3.78 | 2 | 4 | 0 | 45 | 298.471 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.58 | 5.19 | -85.03 | 4 | 4 | 2 | 51 | 300.487 | 8 | ↓ |
