| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 6th, 2011 | 16 | 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) | -1.20 | -3 | -50.82 | 5 | 6 | 1 | 87 | 229.304 | 0 | ↓ |
| Hi High (pH 8-9.5) | -1.20 | -4.23 | -20.76 | 4 | 6 | 0 | 82 | 228.296 | 0 | ↓ |
| Lo Low (pH 4.5-6) | -1.20 | -1.84 | -113.1 | 6 | 6 | 2 | 91 | 230.312 | 0 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| mp | 141 | MolMall (formerly Molecular Diversity Preservation International) |
