| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 16th, 2008 | 34 | 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) | 2.81 | 4.25 | -18.45 | 3 | 9 | 0 | 117 | 467.522 | 8 | ↓ |
| Ref Reference (pH 7) | 2.81 | 3.98 | -18.51 | 3 | 9 | 0 | 117 | 467.522 | 8 | ↓ |
| Hi High (pH 8-9.5) | 2.81 | 5.15 | -43.49 | 2 | 9 | -1 | 120 | 466.514 | 8 | ↓ |
| Hi High (pH 8-9.5) | 2.58 | 4.25 | -59.81 | 1 | 9 | -1 | 116 | 466.514 | 8 | ↓ |
| Hi High (pH 8-9.5) | 2.58 | 4.63 | -53.71 | 1 | 9 | -1 | 116 | 466.514 | 8 | ↓ |
