| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 29th, 2011 | 24 | Yes |
Popular Name: [4-[(1R)-1-(2-fluorophenyl)ethyl]piperazin-1-yl]-(6-methyl-3-pyridyl)methanone [4-[(1R)-1-(2-fluorophenyl)ethyl…
| 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) | 1.69 | 7.64 | -12.3 | 0 | 4 | 0 | 36 | 327.403 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.69 | 9.19 | -44.78 | 1 | 4 | 1 | 38 | 328.411 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
