| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 18th, 2010 | 23 | 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) | 3.05 | 8.52 | -41.44 | 1 | 4 | 1 | 28 | 324.533 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.05 | 10.5 | -107.85 | 2 | 4 | 2 | 29 | 325.541 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.05 | 8.01 | -41.2 | 1 | 4 | 1 | 28 | 324.533 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
