| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2008 | 35 | 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) | 3.72 | 12.03 | -66.06 | 1 | 7 | 0 | 83 | 484.568 | 12 | ↓ |
| Hi High (pH 8-9.5) | 3.72 | 9.82 | -56.1 | 0 | 7 | -1 | 82 | 483.56 | 12 | ↓ |
| Mid Mid (pH 6-8) | 2.52 | 9.46 | -39.5 | 2 | 4 | 1 | 43 | 317.453 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 3.72 | 11.21 | -51.11 | 2 | 7 | 1 | 81 | 485.576 | 12 | ↓ |
