In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 31st, 2009 | 15 | 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) | 2.12 | 4.51 | -52.18 | 0 | 4 | -1 | 59 | 219.094 | 1 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
mp | 137 - 138 | MolMall (formerly Molecular Diversity Preservation International) |