| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 27th, 2010 | 25 | Yes |
| 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) | 2.19 | 3.68 | -125.95 | 8 | 6 | 2 | 113 | 358.571 | 16 | ↓ |
| Hi High (pH 8-9.5) | 2.19 | 3.03 | -13.22 | 6 | 6 | 0 | 110 | 356.555 | 16 | ↓ |
| Mid Mid (pH 6-8) | 2.19 | 3.37 | -50.15 | 7 | 6 | 1 | 112 | 357.563 | 16 | ↓ |
