| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 29th, 2008 | 22 | 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) | 4.88 | 3.9 | -43.32 | 2 | 6 | -1 | 101 | 359.159 | 3 | ↓ |
| Ref Reference (pH 7) | 3.69 | 6.66 | -50.42 | 2 | 6 | -1 | 97 | 359.159 | 3 | ↓ |
| Hi High (pH 8-9.5) | 4.88 | 5.45 | -102.16 | 1 | 6 | -2 | 104 | 358.151 | 3 | ↓ |
| Hi High (pH 8-9.5) | 4.15 | 4.77 | -91.78 | 1 | 6 | -2 | 100 | 358.151 | 3 | ↓ |
| Hi High (pH 8-9.5) | 4.88 | 4.52 | -98.98 | 1 | 6 | -2 | 104 | 358.151 | 3 | ↓ |
