| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 22nd, 2006 | 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) | 4.05 | 8 | -13.6 | 2 | 5 | 0 | 69 | 379.485 | 5 | ↓ |
| Hi High (pH 8-9.5) | 4.03 | 8.65 | -51.59 | 0 | 5 | -1 | 68 | 378.477 | 5 | ↓ |
| Hi High (pH 8-9.5) | 4.03 | 8.6 | -58.94 | 0 | 5 | -1 | 68 | 378.477 | 5 | ↓ |
| Hi High (pH 8-9.5) | 4.05 | 8.96 | -38.75 | 1 | 5 | -1 | 72 | 378.477 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.06 | 8.77 | -52.82 | 1 | 5 | -1 | 72 | 378.477 | 5 | ↓ |
