| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 11th, 2010 | 9 | Yes |
Popular Name: (3S,5S)-heptane-3,5-diol (3S,5S)-heptane-3,5-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) | 1.05 | -0.45 | -4.09 | 2 | 2 | 0 | 40 | 132.203 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | EP0912583A1; US5936109 | IBM Patent Data |
| PUBCHEM_PATENT_ID | US4225695 | IBM Patent Data |
| PUBCHEM_PATENT_ID | WO1997034972A1; WO1998017756A1 | IBM Patent Data |
