| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 11th, 2010 | 25 | 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) | 1.45 | 7.38 | -92.9 | 2 | 7 | 2 | 66 | 350.463 | 10 | ↓ |
| Hi High (pH 8-9.5) | 1.45 | 2.47 | -11.07 | 0 | 7 | 0 | 64 | 348.447 | 10 | ↓ |
| Mid Mid (pH 6-8) | 1.45 | 4.96 | -40.31 | 1 | 7 | 1 | 65 | 349.455 | 10 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
