| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 28th, 2005 | 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) | 5.23 | 9.47 | -44.66 | 1 | 3 | -1 | 60 | 493.058 | 4 | ↓ |
| Hi High (pH 8-9.5) | 5.23 | 10.02 | -98.79 | 0 | 3 | -2 | 63 | 492.05 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 154 - 157 | KeyOrganics |
