| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 29th, 2010 | 16 | 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) | 1.21 | 5.77 | -57.68 | 1 | 4 | 0 | 48 | 228.336 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.21 | 3.63 | -44.32 | 0 | 4 | -1 | 47 | 227.328 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.21 | 5.88 | -51.41 | 1 | 4 | 0 | 48 | 228.336 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 1.21 | 8.06 | -109.95 | 2 | 4 | 1 | 49 | 229.344 | 5 | ↓ |
