In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2005 | 28 | 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) | 4.25 | -2.12 | -48.42 | 2 | 4 | -1 | 80 | 391.572 | 4 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
mp | 140 - 144 | MolMall (formerly Molecular Diversity Preservation International) |