| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 9th, 2010 | 19 | 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) | -0.07 | 4.91 | -44.89 | 3 | 4 | 1 | 57 | 295.457 | 3 | ↓ |
| Mid Mid (pH 6-8) | -0.07 | 4.58 | -6.98 | 2 | 4 | 0 | 55 | 294.449 | 3 | ↓ |
| Mid Mid (pH 6-8) | -0.07 | 5.3 | -97.73 | 4 | 4 | 2 | 58 | 296.465 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
