| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 18th, 2011 | 20 | 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) | -0.55 | 7.77 | -70.23 | 3 | 5 | 1 | 70 | 285.408 | 9 | ↓ |
| Hi High (pH 8-9.5) | -0.55 | 6.63 | -38.02 | 2 | 5 | 0 | 66 | 284.4 | 9 | ↓ |
| Mid Mid (pH 6-8) | -0.55 | 5.85 | -27.8 | 2 | 5 | 0 | 69 | 284.4 | 9 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
