| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 21st, 2010 | 26 | No |
None
None
| 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) | 3.46 | 8.99 | -45.68 | 2 | 5 | 1 | 68 | 353.442 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.46 | 9.56 | -28.97 | 1 | 5 | 0 | 71 | 352.434 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 3.46 | 9.46 | -101.92 | 3 | 5 | 2 | 69 | 354.45 | 6 | ↓ |
