| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2009 | 13 | 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) | -1.29 | 1.74 | -54.42 | 4 | 4 | 1 | 69 | 178.215 | 2 | ↓ |
| Hi High (pH 8-9.5) | -1.29 | 1.4 | -8.3 | 3 | 4 | 0 | 68 | 177.207 | 2 | ↓ |
| Hi High (pH 8-9.5) | -1.29 | 1.37 | -6.42 | 3 | 4 | 0 | 68 | 177.207 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
