| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 17th, 2006 | 27 | 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) | 1.15 | 7.28 | -69.82 | 0 | 8 | -1 | 113 | 364.337 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.59 | 1.83 | -24.2 | 1 | 8 | 0 | 109 | 365.345 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.59 | 1.94 | -54.28 | 2 | 8 | 1 | 110 | 366.353 | 3 | ↓ |
