| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 22nd, 2010 | 29 | 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) | 1.80 | 2.97 | -58.02 | 2 | 8 | -1 | 123 | 465.276 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.80 | 3.89 | -108.58 | 1 | 8 | -2 | 126 | 464.268 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 1.80 | 2.08 | -14.92 | 3 | 8 | 0 | 120 | 466.284 | 7 | ↓ |
