| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 4th, 2011 | 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) | 0.17 | 5.44 | -56.14 | 3 | 2 | 1 | 41 | 235.257 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.17 | 5.13 | -7.78 | 2 | 2 | 0 | 39 | 234.249 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 0.17 | 5.89 | -114.42 | 4 | 2 | 2 | 42 | 236.265 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
