| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 27th, 2010 | 26 | Yes |
Popular Name: 2-[(2R)-1-[(2-fluorophenyl)methyl]-4-(1-isopropyl-4-piperidyl)piperazin-2-yl]ethanol 2-[(2R)-1-[(2-fluorophenyl)methy…
| 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) | 2.47 | 5.22 | -35.45 | 2 | 4 | 1 | 31 | 364.529 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.47 | 5.43 | -35.59 | 2 | 4 | 1 | 31 | 364.529 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 2.47 | 7.36 | -82.5 | 3 | 4 | 2 | 32 | 365.537 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 2.47 | 7.65 | -103.39 | 3 | 4 | 2 | 32 | 365.537 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
