In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2005 | 27 | 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) | 5.63 | 1.3 | -47.23 | 1 | 3 | -1 | 60 | 375.573 | 4 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
mp | 186 - 188 | MolMall (formerly Molecular Diversity Preservation International) |