In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 5th, 2009 | 29 | Yes |
Popular Name: 4-[4-[(3,4-dichlorophenyl)methyl]piperazin-1-yl]-N-(2,4-difluorophenyl)butanamide 4-[4-[(3,4-dichlorophenyl)methyl…
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) | 4.52 | 10.23 | -49.06 | 2 | 4 | 1 | 37 | 443.345 | 7 | ↓ |
Mid Mid (pH 6-8) | 4.52 | 10.24 | -48.98 | 2 | 4 | 1 | 37 | 443.345 | 7 | ↓ |
Mid Mid (pH 6-8) | 4.52 | 7.85 | -9.56 | 1 | 4 | 0 | 36 | 442.337 | 7 | ↓ |