| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 1st, 2011 | 14 | 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) | 1.53 | 2.25 | -47.15 | 3 | 3 | 1 | 53 | 186.238 | 1 | ↓ |
| Hi High (pH 8-9.5) | 1.53 | 1.96 | -7.44 | 2 | 3 | 0 | 52 | 185.23 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
