| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 21st, 2006 | 12 | Yes |
Popular Name: (3S,6S)-2,7-Dimethyl-3,6-octanediol (3S,6S)-2,7-Dimethyl-3,6-octanediol
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CAS Number: 129705-30-2
| 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) | 1.81 | 1.56 | -2.42 | 2 | 2 | 0 | 40 | 174.284 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.