| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 1st, 2008 | 34 | No |
| 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) | 3.47 | 12.59 | -11.99 | 10 | 10 | 0 | 178 | 505.458 | 13 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Molecular_Solubility | 8.612 | Bitter DB |
No pre-computed analogs available. Try a structural similarity search.