| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 24th, 2009 | 16 | 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) | 3.22 | 7.49 | -42.02 | 3 | 1 | 1 | 28 | 210.3 | 2 | ↓ |
| Hi High (pH 8-9.5) | 3.22 | 7.18 | -4.34 | 2 | 1 | 0 | 26 | 209.292 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
