| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2011 | 21 | 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) | 2.73 | 6.56 | -100.24 | 4 | 3 | 2 | 35 | 297.531 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.73 | 4.16 | -44.5 | 3 | 3 | 1 | 34 | 296.523 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 2.73 | 8.43 | -211.96 | 5 | 3 | 3 | 37 | 298.539 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
