| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 21st, 2010 | 21 | 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) | 2.49 | 7.73 | -114.96 | 3 | 4 | 2 | 40 | 294.439 | 8 | ↓ |
| Hi High (pH 8-9.5) | 2.49 | 4.84 | -4.79 | 1 | 4 | 0 | 34 | 292.423 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.49 | 5.72 | -32.5 | 2 | 4 | 1 | 38 | 293.431 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.49 | 6.66 | -36.66 | 2 | 4 | 1 | 35 | 293.431 | 8 | ↓ |
