| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 18th, 2008 | 27 | 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) | 0.57 | 8.3 | -73.2 | 1 | 7 | 0 | 91 | 367.405 | 7 | ↓ |
| Hi High (pH 8-9.5) | 0.57 | 5.46 | -57.96 | 0 | 7 | -1 | 90 | 366.397 | 7 | ↓ |
| Hi High (pH 8-9.5) | 0.57 | 5.58 | -41 | 0 | 7 | -1 | 90 | 366.397 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 0.57 | 7.43 | -51.18 | 2 | 7 | 1 | 88 | 368.413 | 7 | ↓ |
