| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 18th, 2008 | 26 | 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) | 5.18 | 7.98 | -10.13 | 2 | 5 | 0 | 75 | 368.458 | 4 | ↓ |
| Hi High (pH 8-9.5) | 5.64 | 6.43 | -44.47 | 1 | 5 | -1 | 78 | 367.45 | 4 | ↓ |
| Hi High (pH 8-9.5) | 5.64 | 5.94 | -45.11 | 1 | 5 | -1 | 78 | 367.45 | 4 | ↓ |
| Mid Mid (pH 6-8) | 4.69 | 7.85 | -49.44 | 1 | 5 | -1 | 74 | 367.45 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 4.69 | 8.27 | -16.8 | 2 | 5 | 0 | 71 | 368.458 | 5 | ↓ |
