| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 14th, 2010 | 30 | 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) | 2.94 | 11.9 | -81.28 | 2 | 6 | 2 | 51 | 404.514 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.94 | 9.46 | -15.9 | 0 | 6 | 0 | 49 | 402.498 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.94 | 9.55 | -32.83 | 1 | 6 | 1 | 50 | 403.506 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.94 | 11.81 | -47.9 | 1 | 6 | 1 | 50 | 403.506 | 3 | ↓ |
