| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 19th, 2008 | 25 | 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) | 1.70 | 5.75 | -46.02 | 3 | 9 | 1 | 118 | 353.399 | 8 | ↓ |
| Hi High (pH 8-9.5) | 1.70 | 3.46 | -14.28 | 2 | 9 | 0 | 116 | 352.391 | 8 | ↓ |
| Hi High (pH 8-9.5) | 1.88 | 4.26 | -36.56 | 2 | 9 | 0 | 124 | 352.391 | 8 | ↓ |
