| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 14th, 2010 | 19 | 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) | 4.02 | 8.78 | -10.42 | 1 | 3 | 0 | 42 | 314.186 | 1 | ↓ |
| Hi High (pH 8-9.5) | 4.02 | 8.36 | -41.9 | 0 | 3 | -1 | 40 | 313.178 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 4.02 | 9.25 | -28.14 | 2 | 3 | 1 | 43 | 315.194 | 1 | ↓ |
