| 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) | 0.39 | 5.49 | -43.43 | 3 | 4 | 1 | 53 | 282.433 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.39 | 5.17 | -6.75 | 2 | 4 | 0 | 51 | 281.425 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.39 | 5.9 | -93.85 | 4 | 4 | 2 | 54 | 283.441 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
