| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 27th, 2009 | 21 | No |
| 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) | -1.15 | 1.79 | -61.78 | 1 | 8 | -1 | 119 | 295.319 | 8 | ↓ |
| Hi High (pH 8-9.5) | -0.97 | 1.48 | -54.96 | 1 | 8 | -1 | 111 | 295.319 | 8 | ↓ |
| Mid Mid (pH 6-8) | -0.97 | 2.99 | -36.82 | 2 | 8 | 0 | 113 | 296.327 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
