| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 1st, 2008 | 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) | 3.40 | 9.22 | -71.09 | 1 | 7 | 0 | 83 | 458.942 | 9 | ↓ |
| Mid Mid (pH 6-8) | 2.81 | 10.21 | -52.62 | 1 | 7 | 1 | 77 | 459.95 | 9 | ↓ |
| Mid Mid (pH 6-8) | 3.40 | 9.52 | -43.52 | 2 | 7 | 1 | 81 | 459.95 | 9 | ↓ |
