| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 25th, 2007 | 26 | 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) | 4.50 | -4.98 | -16.2 | 1 | 5 | 0 | 63 | 426.35 | 4 | ↓ |
| Hi High (pH 8-9.5) | 4.50 | -4.4 | -44.79 | 0 | 5 | -1 | 66 | 425.342 | 4 | ↓ |
| Hi High (pH 8-9.5) | 4.50 | -4.16 | -45.44 | 1 | 5 | 0 | 67 | 426.35 | 4 | ↓ |
| Mid Mid (pH 6-8) | 4.50 | -4.74 | -35.87 | 2 | 5 | 1 | 65 | 427.358 | 4 | ↓ |
