| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 5th, 2009 | 30 | Yes |
Popular Name: 4-[4-[(2-chloro-6-fluoro-phenyl)methyl]piperazin-1-yl]-N-(3,4,5-trichlorophenyl)butanamide 4-[4-[(2-chloro-6-fluoro-phenyl)…
| 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) | 5.61 | 10.89 | -47.39 | 2 | 4 | 1 | 37 | 494.245 | 7 | ↓ |
| Mid Mid (pH 6-8) | 5.61 | 10.96 | -40.36 | 2 | 4 | 1 | 37 | 494.245 | 7 | ↓ |
| Mid Mid (pH 6-8) | 5.61 | 8.58 | -13.48 | 1 | 4 | 0 | 36 | 493.237 | 7 | ↓ |
