In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 6th, 2004 | 26 | 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) | 5.35 | 0.57 | -11.8 | 1 | 5 | 0 | 74 | 341.37 | 4 | ↓ |
Mid Mid (pH 6-8) | 5.35 | 0.73 | -42.43 | 1 | 5 | 1 | 74 | 341.37 | 4 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
mp | 243 - 246 | MolMall (formerly Molecular Diversity Preservation International) |