| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 6th, 2010 | 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) | 2.99 | 6.79 | -110.14 | 4 | 3 | 2 | 41 | 312.885 | 8 | ↓ |
| Hi High (pH 8-9.5) | 2.99 | 6.46 | -30.22 | 3 | 3 | 1 | 40 | 311.877 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.99 | 5.11 | -42.99 | 3 | 3 | 1 | 40 | 311.877 | 8 | ↓ |
