| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 28th, 2008 | 32 | 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) | 3.82 | 8.66 | -16.3 | 2 | 6 | 0 | 82 | 428.467 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.82 | 10.12 | -41.62 | 1 | 6 | -1 | 85 | 427.459 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 3.82 | 9.47 | -38.96 | 3 | 6 | 1 | 83 | 429.475 | 4 | ↓ |
