In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 3rd, 2005 | 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) | 2.79 | -2.71 | -4.75 | 2 | 2 | 0 | 40 | 222.328 | 6 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
mp | 42 - 46 | MolMall (formerly Molecular Diversity Preservation International) |