| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 10th, 2010 | 18 | 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) | 2.81 | 5.29 | -31.06 | 3 | 3 | 1 | 40 | 336.319 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.81 | 4.13 | -1.62 | 2 | 3 | 0 | 38 | 335.311 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.81 | 4.47 | -38.48 | 3 | 3 | 1 | 40 | 336.319 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.81 | 5.55 | -109.61 | 4 | 3 | 2 | 41 | 337.327 | 7 | ↓ |
