| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 21st, 2011 | 30 | 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 | 5.22 | -52.32 | 5 | 7 | 1 | 107 | 444.503 | 8 | ↓ |
| Hi High (pH 8-9.5) | 2.19 | 4.23 | -20.44 | 4 | 7 | 0 | 102 | 443.495 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
