| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 31st, 2009 | 35 | 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) | 5.46 | 14.41 | -48.34 | 2 | 5 | 1 | 53 | 504.441 | 5 | ↓ |
| Hi High (pH 8-9.5) | 5.46 | 14.82 | -13.43 | 1 | 5 | 0 | 52 | 503.433 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 5.46 | 15.62 | -125.81 | 3 | 5 | 2 | 58 | 505.449 | 5 | ↓ |
