| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 28th, 2008 | 19 | 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) | 4.97 | 4.11 | -10.3 | 2 | 4 | 0 | 61 | 316.158 | 2 | ↓ |
| Hi High (pH 8-9.5) | 4.97 | 4.9 | -46 | 1 | 4 | -1 | 64 | 315.15 | 2 | ↓ |
| Hi High (pH 8-9.5) | 4.24 | 4.23 | -43.2 | 1 | 4 | -1 | 60 | 315.15 | 2 | ↓ |
| Hi High (pH 8-9.5) | 4.24 | 3.97 | -47.71 | 1 | 4 | -1 | 60 | 315.15 | 2 | ↓ |
