| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 9th, 2010 | 31 | 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) | 4.52 | 12.06 | -17.2 | 0 | 5 | 0 | 41 | 416.569 | 4 | ↓ |
| Mid Mid (pH 6-8) | 4.52 | 12.39 | -33.48 | 1 | 5 | 1 | 42 | 417.577 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 4.52 | 14.6 | -108.56 | 2 | 5 | 2 | 43 | 418.585 | 4 | ↓ |
