| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 21st, 2009 | 25 | 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) | 1.45 | 1.16 | -44.04 | 3 | 7 | 1 | 83 | 353.487 | 9 | ↓ |
| Mid Mid (pH 6-8) | 1.45 | -1.12 | -8.16 | 2 | 7 | 0 | 82 | 352.479 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 1.45 | 1.17 | -42.38 | 3 | 7 | 1 | 83 | 353.487 | 9 | ↓ |
