| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 7th, 2009 | 16 | 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) | 0.05 | -0.75 | -30.2 | 4 | 5 | 1 | 67 | 223.3 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.05 | -1.21 | -7.1 | 3 | 5 | 0 | 66 | 222.292 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.05 | 1.56 | -81.46 | 5 | 5 | 2 | 68 | 224.308 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
