| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 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) | 2.15 | 8.71 | -70.7 | 1 | 8 | 0 | 96 | 440.496 | 8 | ↓ |
| Hi High (pH 8-9.5) | 2.15 | 6.39 | -61.68 | 0 | 8 | -1 | 95 | 439.488 | 8 | ↓ |
| Mid Mid (pH 6-8) | 1.04 | 4.87 | -40.6 | 1 | 6 | 1 | 62 | 344.435 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.04 | 2.5 | -12.78 | 0 | 6 | 0 | 61 | 343.427 | 6 | ↓ |
