| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 10th, 2011 | 19 | 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) | 0.90 | 5.33 | -110.85 | 6 | 3 | 2 | 68 | 259.397 | 2 | ↓ |
| Hi High (pH 8-9.5) | 0.90 | 4.86 | -51.83 | 5 | 3 | 1 | 67 | 258.389 | 2 | ↓ |
| Hi High (pH 8-9.5) | 0.90 | 4.55 | -4 | 4 | 3 | 0 | 65 | 257.381 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
