| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 6th, 2009 | 18 | No |
| 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) | 1.94 | 0.85 | -55.6 | 1 | 5 | -1 | 82 | 269.346 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.52 | 9.93 | -43.2 | 2 | 4 | 1 | 43 | 341.475 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 2.31 | 2.81 | -12.95 | 2 | 5 | 0 | 75 | 270.354 | 5 | ↓ |
