| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 3rd, 2007 | 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) | 3.23 | 8.18 | -27.6 | 2 | 5 | 0 | 76 | 373.408 | 2 | ↓ |
| Hi High (pH 8-9.5) | 3.23 | 9.12 | -86.5 | 1 | 5 | -1 | 78 | 372.4 | 2 | ↓ |
| Mid Mid (pH 6-8) | 3.63 | 7.65 | -21.61 | 1 | 5 | 0 | 76 | 373.408 | 2 | ↓ |
| Mid Mid (pH 6-8) | 3.63 | 7.41 | -14.52 | 1 | 5 | 0 | 76 | 373.408 | 2 | ↓ |
