| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 29th, 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) | 0.99 | 4.82 | -46.71 | 3 | 3 | 1 | 44 | 224.353 | 2 | ↓ |
| Hi High (pH 8-9.5) | 0.99 | 4.41 | -4.66 | 2 | 3 | 0 | 42 | 223.345 | 2 | ↓ |
| Mid Mid (pH 6-8) | 0.99 | 5.12 | -106.16 | 4 | 3 | 2 | 45 | 225.361 | 2 | ↓ |
