| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 4th, 2010 | 17 | Yes |
Popular Name: (2S,3S,5S)-2-amino-1-cyclohexyl-6-methyl-heptane-3,5-diol (2S,3S,5S)-2-amino-1-cyclohexyl-…
None
| 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) | 2.02 | 1.91 | -51.05 | 5 | 3 | 1 | 68 | 244.399 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.02 | 1.62 | -3.77 | 4 | 3 | 0 | 66 | 243.391 | 6 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | EP0396065A1 | IBM Patent Data |
