| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 2nd, 2011 | 25 | Yes |
Popular Name: [1-(2-fluorophenyl)pyrazol-4-yl]-[4-[(2S)-2-hydroxybutyl]piperazin-1-yl]methanone [1-(2-fluorophenyl)pyrazol-4-yl]…
| 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) | 1.01 | 4.31 | -13.56 | 1 | 6 | 0 | 62 | 346.406 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 1.01 | 6.58 | -49.19 | 2 | 6 | 1 | 63 | 347.414 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
