| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 21st, 2010 | 21 | 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) | 1.53 | 3.51 | -33.06 | 2 | 5 | 1 | 48 | 299.435 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.53 | 1.83 | -4.23 | 1 | 5 | 0 | 43 | 298.427 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.53 | 4.33 | -29.12 | 2 | 5 | 1 | 44 | 299.435 | 4 | ↓ |
