| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 1st, 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) | 5.08 | 8.53 | -11.53 | 1 | 6 | 0 | 73 | 398.484 | 6 | ↓ |
| Mid Mid (pH 6-8) | 4.59 | 7.98 | -42.09 | 0 | 6 | -1 | 72 | 397.476 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 4.59 | 8.51 | -18.09 | 1 | 6 | 0 | 70 | 398.484 | 7 | ↓ |
