| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 19th, 2011 | 41 | No |
Popular Name: 1-(4-cyclohexylpiperazine-1-carbonyl)-6-(3,4-dimethoxyphenyl)-10,10-dioxo-thioxanthen-9-one 1-(4-cyclohexylpiperazine-1-carb…
| 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) | 4.51 | 13.03 | -56.96 | 1 | 8 | 1 | 94 | 575.707 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.51 | 10.89 | -22.51 | 0 | 8 | 0 | 93 | 574.699 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
