| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 14th, 2011 | 18 | 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) | 0.66 | 1.72 | -43.92 | 4 | 5 | 1 | 82 | 244.274 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.66 | 0.03 | -10.32 | 3 | 5 | 0 | 77 | 243.266 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.66 | 2.15 | -89.75 | 5 | 5 | 2 | 83 | 245.282 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
