| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 15th, 2010 | 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) | 3.35 | 9.19 | -4.45 | 3 | 4 | 0 | 52 | 275.396 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.35 | 8.18 | -7.37 | 2 | 4 | 0 | 50 | 274.388 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
