| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 15th, 2007 | 31 | 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) | 4.92 | 7.23 | -16.02 | 3 | 6 | 0 | 89 | 439.943 | 6 | ↓ |
| Ref Reference (pH 7) | 4.92 | 7.18 | -11.52 | 3 | 6 | 0 | 89 | 439.943 | 6 | ↓ |
| Hi High (pH 8-9.5) | 4.90 | 7.01 | -53.88 | 1 | 6 | -1 | 88 | 438.935 | 6 | ↓ |
| Hi High (pH 8-9.5) | 4.90 | 6.99 | -48.92 | 1 | 6 | -1 | 88 | 438.935 | 6 | ↓ |
| Hi High (pH 8-9.5) | 4.92 | 7.98 | -44.07 | 2 | 6 | -1 | 92 | 438.935 | 6 | ↓ |
| Mid Mid (pH 6-8) | 4.92 | 7.95 | -48.98 | 2 | 6 | -1 | 92 | 438.935 | 6 | ↓ |
