| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 21st, 2008 | 28 | 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) | 2.61 | 9.29 | -75.54 | 1 | 6 | 0 | 74 | 400.5 | 8 | ↓ |
| Mid Mid (pH 6-8) | 3.06 | 8.64 | -48.13 | 2 | 6 | 1 | 71 | 401.508 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.03 | 8.93 | -46.66 | 1 | 6 | 1 | 68 | 401.508 | 8 | ↓ |
