| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 21st, 2010 | 21 | 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) | 3.91 | 8.11 | -34.15 | 2 | 3 | 1 | 29 | 293.475 | 9 | ↓ |
| Hi High (pH 8-9.5) | 3.91 | 6.46 | -1.45 | 1 | 3 | 0 | 24 | 292.467 | 9 | ↓ |
| Mid Mid (pH 6-8) | 3.91 | 8.33 | -30.34 | 2 | 3 | 1 | 26 | 293.475 | 9 | ↓ |
