| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 22nd, 2006 | 30 | Yes |
None
| 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) | 3.07 | 7.24 | -14.84 | 2 | 6 | 0 | 82 | 400.413 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.07 | 8.21 | -37.88 | 1 | 6 | -1 | 85 | 399.405 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.07 | 8.02 | -54.33 | 1 | 6 | -1 | 85 | 399.405 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 3.07 | -2.1 | -52.06 | 3 | 6 | 1 | 83 | 401.421 | 4 | ↓ |
