| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 3rd, 2005 | 13 | 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) | 2.98 | 6.96 | -44.19 | 1 | 1 | -1 | 16 | 206.315 | 0 | ↓ |
| Lo Low (pH 4.5-6) | 2.98 | 6.53 | -19.13 | 1 | 1 | 0 | 16 | 207.323 | 0 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| mp | 166 - 168 | MolMall (formerly Molecular Diversity Preservation International) |
No pre-computed analogs available. Try a structural similarity search.