| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 13th, 2006 | 31 | 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) | 0.33 | -4.13 | -16.11 | 6 | 10 | 0 | 166 | 434.397 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.33 | -3.14 | -62.45 | 5 | 10 | -1 | 169 | 433.389 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Molecular_Solubility | 2.048 | Bitter DB |
