In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 3rd, 2005 | 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) | 8.28 | 16.69 | -4.08 | 0 | 2 | 0 | 26 | 428.701 | 7 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
MP | 112-114 °C(lit.) | Indofine |
mp | 183 - 184 | MolMall (formerly Molecular Diversity Preservation International) |