In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 15th, 2008 | 9 | Yes |
Popular Name: (2R,6S)-heptane-2,6-diol (2R,6S)-heptane-2,6-diol
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) | 0.82 | -0.55 | -4.84 | 2 | 2 | 0 | 40 | 132.203 | 4 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | WO1997034972A1 | IBM Patent Data |