| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 26th, 2006 | 27 | 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) | 2.49 | 9.76 | -76.85 | 1 | 6 | 0 | 78 | 368.433 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.49 | 7.23 | -60.45 | 0 | 6 | -1 | 77 | 367.425 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.91 | 1.49 | -46.75 | 1 | 6 | 1 | 72 | 369.441 | 6 | ↓ |
