| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 17th, 2009 | 40 | 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) | 7.85 | 17.12 | -14.29 | 0 | 6 | 0 | 57 | 531.704 | 8 | ↓ |
| Mid Mid (pH 6-8) | 7.85 | 19 | -68.46 | 1 | 6 | 1 | 58 | 532.712 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 7.85 | 19.41 | -103 | 2 | 6 | 2 | 59 | 533.72 | 8 | ↓ |
