| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 15th, 2006 | 30 | 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) | 4.38 | 1.85 | -13.3 | 0 | 5 | 0 | 79 | 442.537 | 8 | ↓ |
| Mid Mid (pH 6-8) | 4.94 | 0.14 | -12.7 | 0 | 5 | 0 | 79 | 442.537 | 8 | ↓ |
| Mid Mid (pH 6-8) | 4.76 | 1.14 | -10.81 | 0 | 5 | 0 | 79 | 442.537 | 8 | ↓ |
