| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 6th, 2007 | 36 | 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) | 4.75 | 9.48 | -57.62 | 0 | 8 | -1 | 101 | 501.54 | 7 | ↓ |
| Mid Mid (pH 6-8) | 4.17 | 9.73 | -13.9 | 0 | 8 | 0 | 95 | 502.548 | 7 | ↓ |
| Mid Mid (pH 6-8) | 4.75 | 9.33 | -16.52 | 1 | 8 | 0 | 98 | 502.548 | 7 | ↓ |
