| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 17th, 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) | 2.19 | 2.04 | -12.46 | 3 | 5 | 0 | 85 | 309.416 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.19 | 2.52 | -45.34 | 2 | 5 | -1 | 83 | 308.408 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
