| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 12th, 2008 | 25 | 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) | 3.70 | 9.18 | -118.65 | 3 | 4 | 2 | 47 | 337.467 | 8 | ↓ |
| Hi High (pH 8-9.5) | 3.70 | 7.84 | -38.78 | 2 | 4 | 1 | 42 | 336.459 | 8 | ↓ |
| Hi High (pH 8-9.5) | 3.70 | 5.36 | -7.51 | 1 | 4 | 0 | 41 | 335.451 | 8 | ↓ |
| Mid Mid (pH 6-8) | 3.70 | 6.72 | -46.12 | 2 | 4 | 1 | 46 | 336.459 | 8 | ↓ |
