| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 12th, 2011 | 12 | No |
None
| 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) | -0.02 | 1.65 | -41.8 | 3 | 6 | -1 | 85 | 181.204 | 1 | ↓ |
| Mid Mid (pH 6-8) | -0.74 | 1.61 | -11.81 | 4 | 6 | 0 | 88 | 182.212 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
