| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 17th, 2010 | 15 | 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) | -2.23 | 2.97 | -74.88 | 4 | 5 | 1 | 75 | 216.305 | 5 | ↓ |
| Hi High (pH 8-9.5) | -2.23 | 2.31 | -56.81 | 3 | 5 | 0 | 74 | 215.297 | 5 | ↓ |
| Hi High (pH 8-9.5) | -2.23 | 0.02 | -41.54 | 2 | 5 | -1 | 73 | 214.289 | 5 | ↓ |
| Hi High (pH 8-9.5) | -2.23 | 0.71 | -33.02 | 3 | 5 | 0 | 74 | 215.297 | 5 | ↓ |
