| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 1st, 2009 | 30 | 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) | 0.52 | 7.47 | -27.28 | 3 | 7 | 0 | 114 | 408.454 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.52 | 6.1 | -51.87 | 2 | 7 | -1 | 110 | 407.446 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.52 | 6.34 | -50.34 | 2 | 7 | -1 | 110 | 407.446 | 5 | ↓ |
