In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2005 | 34 | 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) | 2.95 | -1.51 | -109.24 | 2 | 10 | -2 | 156 | 506.558 | 15 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
mp | 83 - 84 | MolMall (formerly Molecular Diversity Preservation International) |