| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 12th, 2011 | 18 | Yes |
Popular Name: (3R)-3-[[3-(trifluoromethyl)phenyl]methyl]piperazin-2-one (3R)-3-[[3-(trifluoromethyl)phen…
| 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) | 1.73 | 2.73 | -7.11 | 2 | 3 | 0 | 41 | 258.243 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.73 | 3.97 | -46.56 | 3 | 3 | 1 | 46 | 259.251 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
