| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2009 | 12 | 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) | -1.37 | -1.59 | -46.39 | 3 | 5 | 1 | 72 | 173.192 | 4 | ↓ |
| Hi High (pH 8-9.5) | -1.37 | -2.85 | -8.38 | 2 | 5 | 0 | 67 | 172.184 | 4 | ↓ |
| Hi High (pH 8-9.5) | -1.37 | -2.83 | -8.85 | 2 | 5 | 0 | 67 | 172.184 | 4 | ↓ |
| Mid Mid (pH 6-8) | -1.19 | -4.14 | -39.89 | 2 | 5 | 0 | 78 | 172.184 | 4 | ↓ |
| Mid Mid (pH 6-8) | -1.19 | -4.13 | -45.25 | 2 | 5 | 0 | 78 | 172.184 | 4 | ↓ |
