| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 25th, 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) | 0.81 | 3.72 | -37.06 | 4 | 3 | 1 | 53 | 228.319 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.81 | 4.85 | -32.48 | 4 | 3 | 1 | 56 | 228.319 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.81 | 4.91 | -117.25 | 5 | 3 | 2 | 57 | 229.327 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
