| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 3rd, 2007 | 31 | 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) | 1.47 | 4.93 | -16.89 | 4 | 11 | 0 | 147 | 495.334 | 8 | ↓ |
| Hi High (pH 8-9.5) | 1.47 | 5.7 | -48.95 | 3 | 11 | -1 | 150 | 494.326 | 8 | ↓ |
| Mid Mid (pH 6-8) | 1.47 | -7.61 | -42.79 | 5 | 11 | 1 | 148 | 496.342 | 8 | ↓ |
