| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 28th, 2009 | 27 | 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) | 4.54 | 7.61 | -10.37 | 1 | 4 | 0 | 45 | 399.585 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.54 | 10.02 | -40.04 | 2 | 4 | 1 | 46 | 400.593 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.54 | 7.99 | -36.68 | 2 | 4 | 1 | 46 | 400.593 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 4.54 | 10.41 | -79.96 | 3 | 4 | 2 | 48 | 401.601 | 5 | ↓ |
