| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 28th, 2008 | 32 | 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) | 7.49 | 14.13 | -8.19 | 0 | 4 | 0 | 37 | 449.664 | 5 | ↓ |
| Hi High (pH 8-9.5) | 7.49 | 13.16 | -8.76 | 0 | 4 | 0 | 37 | 449.664 | 5 | ↓ |
| Mid Mid (pH 6-8) | 7.49 | 13.98 | -94.89 | 2 | 4 | 2 | 40 | 451.68 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 7.49 | 14.5 | -25.3 | 1 | 4 | 1 | 39 | 450.672 | 5 | ↓ |
