| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 3rd, 2004 | 25 | No |
| 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) | 5.45 | 6.68 | -12.39 | 2 | 5 | 0 | 75 | 395.267 | 3 | ↓ |
| Ref Reference (pH 7) | 5.45 | 6.4 | -12.41 | 2 | 5 | 0 | 75 | 395.267 | 3 | ↓ |
| Hi High (pH 8-9.5) | 5.90 | 5.14 | -42.65 | 1 | 5 | -1 | 78 | 394.259 | 3 | ↓ |
| Hi High (pH 8-9.5) | 5.90 | 6.06 | -103.76 | 0 | 5 | -2 | 81 | 393.251 | 3 | ↓ |
| Hi High (pH 8-9.5) | 5.45 | 7.6 | -50.51 | 1 | 5 | -1 | 78 | 394.259 | 3 | ↓ |
| Hi High (pH 8-9.5) | 5.90 | 4.66 | -45.28 | 1 | 5 | -1 | 78 | 394.259 | 3 | ↓ |
| Hi High (pH 8-9.5) | 5.90 | 5.57 | -107.2 | 0 | 5 | -2 | 81 | 393.251 | 3 | ↓ |
| Hi High (pH 8-9.5) | 5.45 | 7.32 | -51.18 | 1 | 5 | -1 | 78 | 394.259 | 3 | ↓ |
