| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 16th, 2010 | 34 | 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) | 4.62 | 13.92 | -48.58 | 1 | 6 | 1 | 44 | 463.646 | 11 | ↓ |
| Hi High (pH 8-9.5) | 4.62 | 11.55 | -14.74 | 0 | 6 | 0 | 43 | 462.638 | 11 | ↓ |
| Mid Mid (pH 6-8) | 4.62 | 13.8 | -51.42 | 1 | 6 | 1 | 44 | 463.646 | 11 | ↓ |
| Lo Low (pH 4.5-6) | 4.62 | 14.22 | -81.25 | 2 | 6 | 2 | 45 | 464.654 | 11 | ↓ |
