| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 3rd, 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) | 3.12 | 9.47 | -78.94 | 1 | 7 | 0 | 83 | 438.524 | 9 | ↓ |
| Mid Mid (pH 6-8) | 2.54 | 11.58 | -46.57 | 1 | 7 | 1 | 77 | 439.532 | 9 | ↓ |
| Mid Mid (pH 6-8) | 3.57 | 9.6 | -44.22 | 2 | 7 | 1 | 81 | 439.532 | 8 | ↓ |
