| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 13th, 2011 | 25 | No |
| 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) | 3.40 | 5.39 | -54.45 | 4 | 3 | 1 | 57 | 370.416 | 3 | ↓ |
| Hi High (pH 8-9.5) | 3.40 | 6.29 | -74.05 | 3 | 3 | 0 | 60 | 369.408 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
