| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 21st, 2008 | 31 | 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) | 3.06 | 11.99 | -61.9 | 1 | 8 | 0 | 111 | 423.469 | 8 | ↓ |
| Mid Mid (pH 6-8) | 3.06 | 11.48 | -53.9 | 2 | 8 | 1 | 108 | 424.477 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.48 | 11.86 | -55.11 | 1 | 8 | 1 | 105 | 424.477 | 8 | ↓ |
