| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 11th, 2011 | 12 | 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) | 1.38 | 2.1 | -13.13 | 1 | 3 | 0 | 46 | 178.216 | 1 | ↓ |
| Hi High (pH 8-9.5) | 1.84 | 0.1 | -47.26 | 0 | 3 | -1 | 49 | 177.208 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
