| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 31st, 2007 | 34 | 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) | 5.04 | 12.13 | -55.74 | 0 | 7 | -1 | 96 | 459.522 | 7 | ↓ |
| Mid Mid (pH 6-8) | 4.46 | 12.54 | -24.18 | 0 | 7 | 0 | 90 | 460.53 | 7 | ↓ |
| Mid Mid (pH 6-8) | 5.49 | 11.53 | -34.76 | 1 | 7 | 0 | 93 | 460.53 | 6 | ↓ |
