| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 15th, 2009 | 31 | No |
| 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) | 2.41 | 12.23 | -26.64 | 2 | 6 | 0 | 94 | 422.525 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.41 | 10.52 | -52.59 | 1 | 6 | -1 | 90 | 421.517 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.41 | 12.04 | -46.47 | 1 | 6 | -1 | 90 | 421.517 | 7 | ↓ |
