| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 19th, 2011 | 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) | 2.71 | 9.71 | -34.32 | 1 | 4 | 0 | 57 | 270.332 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.71 | 9.51 | -44.56 | 1 | 4 | 0 | 58 | 270.332 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.71 | 9.09 | -54.1 | 0 | 4 | -1 | 56 | 269.324 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
