| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 27th, 2010 | 20 | Yes |
Popular Name: (1S,2S,4S)-2-(isoindolin-2-ylmethyl)-4-propyl-cyclohexanol (1S,2S,4S)-2-(isoindolin-2-ylmet…
| 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) | 3.72 | 9.03 | -30.59 | 2 | 2 | 1 | 25 | 274.428 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.72 | 7.28 | -3.15 | 1 | 2 | 0 | 23 | 273.42 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
