| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 21st, 2011 | 20 | Yes |
Popular Name: (1R,5S)-1-(4-isoquinolyl)-3,3,5-trimethyl-cyclohexanol (1R,5S)-1-(4-isoquinolyl)-3,3,5-…
| 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) | 4.00 | 7.35 | -5.51 | 1 | 2 | 0 | 33 | 269.388 | 1 | ↓ |
| Mid Mid (pH 6-8) | 4.00 | 7.81 | -33.64 | 2 | 2 | 1 | 34 | 270.396 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
