| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 2nd, 2009 | 20 | 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) | 2.33 | 6.33 | -12.25 | 2 | 5 | 0 | 60 | 312.416 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.58 | 5.25 | -36.54 | 1 | 5 | -1 | 66 | 311.408 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
