| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2008 | 17 | 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) | 2.43 | 5.6 | -117.77 | 4 | 3 | 2 | 41 | 236.359 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.43 | 3.9 | -46.55 | 2 | 3 | 0 | 43 | 234.343 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.43 | 4.48 | -36.63 | 3 | 3 | 1 | 37 | 235.351 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
