| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 21st, 2011 | 17 | No |
Popular Name: (4S)-4-(4-aminophenyl)-4-ethyl-cyclohexane-1,3-dione (4S)-4-(4-aminophenyl)-4-ethyl-c…
| 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) | 0.52 | 3.96 | -47.26 | 2 | 3 | -1 | 66 | 230.287 | 2 | ↓ |
| Mid Mid (pH 6-8) | -0.22 | 5.09 | -10.6 | 2 | 3 | 0 | 60 | 231.295 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
