| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 4th, 2010 | 28 | 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) | 3.08 | 10.44 | -96.56 | 3 | 5 | 2 | 41 | 400.489 | 9 | ↓ |
| Hi High (pH 8-9.5) | 3.08 | 6 | -10.25 | 1 | 5 | 0 | 39 | 398.473 | 9 | ↓ |
| Mid Mid (pH 6-8) | 3.08 | 8.22 | -38.04 | 2 | 5 | 1 | 40 | 399.481 | 9 | ↓ |
