| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 6th, 2008 | 30 | Yes |
Popular Name: (5S)-5-methyl-3-(p-tolyl)-2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]-5H-imidazol-4-one (5S)-5-methyl-3-(p-tolyl)-2-[4-[…
| 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) | 4.40 | 11.19 | -8.34 | 0 | 5 | 0 | 39 | 416.447 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.41 | 12.99 | -19.24 | 1 | 5 | 0 | 49 | 416.447 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.41 | 10.78 | -41.73 | 2 | 5 | 1 | 50 | 417.455 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
