| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 5th, 2010 | 16 | 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) | 1.23 | 7.37 | -102.8 | 4 | 3 | 2 | 47 | 217.316 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.23 | 6.25 | -5.39 | 2 | 3 | 0 | 44 | 215.3 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.23 | 6.53 | -50.42 | 3 | 3 | 1 | 45 | 216.308 | 3 | ↓ |
