In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 25th, 2010 | 25 | Yes |
Popular Name: (3,5-dimethylphenyl)methyl (3,5-dimethylphenyl)methyl
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) | 4.42 | 11.72 | -41.38 | 3 | 3 | 1 | 54 | 334.439 | 6 | ↓ |
Mid Mid (pH 6-8) | 4.42 | 11.4 | -6.64 | 2 | 3 | 0 | 52 | 333.431 | 6 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | EP0593559A1; US5472978; WO1993001169A2 | IBM Patent Data |