| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 22nd, 2009 | 20 | 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) | 1.41 | 2.1 | -48.61 | 2 | 5 | 1 | 55 | 273.36 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.41 | 0.73 | -9.14 | 1 | 5 | 0 | 50 | 272.352 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 1.41 | 2.99 | -42.68 | 2 | 5 | 1 | 51 | 273.36 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
