| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 26th, 2011 | 18 | 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) | 2.45 | 9.39 | -46.86 | 0 | 4 | -1 | 58 | 245.302 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.45 | 9.69 | -52.29 | 1 | 4 | 0 | 59 | 246.31 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 2.45 | 7.71 | -30.85 | 2 | 4 | 1 | 56 | 247.318 | 6 | ↓ |
