In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 7th, 2009 | 27 | Yes |
Popular Name: [4-[(3,4-dimethoxyphenyl)methyl]piperazin-1-yl]-(3-fluoro-4-methyl-phenyl)methanone [4-[(3,4-dimethoxyphenyl)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) | 2.38 | 7.49 | -14.41 | 0 | 5 | 0 | 42 | 372.44 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.38 | 9.71 | -52.29 | 1 | 5 | 1 | 43 | 373.448 | 5 | ↓ |