| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 5th, 2006 | 30 | 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) | 3.79 | 10 | -35.43 | 2 | 6 | 0 | 80 | 403.482 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.93 | 8.7 | -14.56 | 1 | 6 | 0 | 81 | 403.482 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 3.91 | 8.64 | -34.39 | 2 | 6 | 1 | 82 | 404.49 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 3.93 | 8.47 | -33.61 | 2 | 6 | 1 | 82 | 404.49 | 4 | ↓ |
