| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 21st, 2011 | 21 | Yes |
Popular Name: (1S,2S,5R)-2-isopropyl-1-(4-isoquinolyl)-5-methyl-cyclohexanol (1S,2S,5R)-2-isopropyl-1-(4-isoq…
| 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) | 5.09 | 8 | -5.06 | 1 | 2 | 0 | 33 | 283.415 | 2 | ↓ |
| Mid Mid (pH 6-8) | 5.09 | 8.46 | -33.78 | 2 | 2 | 1 | 34 | 284.423 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
