| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 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) | 2.85 | 7.5 | -57.23 | 0 | 8 | -1 | 91 | 499.971 | 9 | ↓ |
| Mid Mid (pH 6-8) | 2.85 | 9.83 | -77.52 | 1 | 8 | 0 | 93 | 500.979 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 2.85 | 9.01 | -59.68 | 2 | 8 | 1 | 90 | 501.987 | 9 | ↓ |
