| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2010 | 14 | 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) | 0.40 | 3.14 | -46.2 | 3 | 4 | 1 | 54 | 193.274 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.40 | 3.31 | -82.66 | 4 | 4 | 2 | 56 | 194.282 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.40 | 3.32 | -84.1 | 4 | 4 | 2 | 56 | 194.282 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
