| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 27th, 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) | 3.82 | 11.83 | -52.85 | 0 | 5 | -1 | 74 | 404.417 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.82 | 10.79 | -11.81 | 1 | 5 | 0 | 71 | 405.425 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.24 | 11.16 | -11.03 | 0 | 5 | 0 | 68 | 405.425 | 6 | ↓ |
