| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2008 | 30 | Yes |
None
| 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) | 3.32 | 4.75 | -37.55 | 2 | 5 | 1 | 40 | 430.535 | 8 | ↓ |
| Hi High (pH 8-9.5) | 3.32 | 4.85 | -36.57 | 2 | 5 | 1 | 40 | 430.535 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 3.32 | 7 | -104.21 | 3 | 5 | 2 | 42 | 431.543 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 3.32 | 7.35 | -94.17 | 3 | 5 | 2 | 42 | 431.543 | 8 | ↓ |
