| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 21st, 2011 | 16 | 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) | 1.07 | 4.41 | -82 | 3 | 3 | 2 | 24 | 227.396 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.07 | 2.22 | -37.52 | 2 | 3 | 1 | 23 | 226.388 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.07 | 6.76 | -185.35 | 4 | 3 | 3 | 25 | 228.404 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
