In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 14th, 2010 | 13 | 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) | 0.77 | 4.04 | -44.59 | 0 | 4 | -1 | 58 | 193.104 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
mp | 83 - 85 | MolMall (formerly Molecular Diversity Preservation International) |