| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 6th, 2010 | 15 | 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) | 1.71 | 5.34 | -12.18 | 1 | 3 | 0 | 58 | 209.289 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.30 | 4.04 | -43.91 | 1 | 3 | -1 | 64 | 208.281 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.71 | 6.54 | -13.69 | 1 | 3 | 0 | 58 | 209.289 | 3 | ↓ |
