| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 17th, 2008 | 28 | 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) | 4.11 | 11.21 | -10.4 | 1 | 4 | 0 | 41 | 411.596 | 3 | ↓ |
| Hi High (pH 8-9.5) | 4.57 | 10.79 | -38.31 | 0 | 4 | -1 | 44 | 410.588 | 3 | ↓ |
| Mid Mid (pH 6-8) | 4.11 | 13.6 | -52.94 | 2 | 4 | 1 | 42 | 412.604 | 3 | ↓ |
