| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 27th, 2007 | 32 | 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) | 4.49 | 11.39 | -69.54 | 1 | 6 | 0 | 74 | 477.388 | 8 | ↓ |
| Hi High (pH 8-9.5) | 4.49 | 8.86 | -56.27 | 0 | 6 | -1 | 73 | 476.38 | 8 | ↓ |
| Mid Mid (pH 6-8) | 4.93 | 11.25 | -45.87 | 2 | 6 | 1 | 71 | 478.396 | 7 | ↓ |
