In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 5th, 2008 | 25 | Yes |
Popular Name: 1-benzyl-4-[(2-bromo-4,5-dimethoxy-phenyl)methyl]piperazine 1-benzyl-4-[(2-bromo-4,5-dimetho…
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) | 3.42 | 9.31 | -40.62 | 1 | 4 | 1 | 26 | 406.344 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.42 | 9.28 | -37.13 | 1 | 4 | 1 | 26 | 406.344 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.42 | 7 | -5.94 | 0 | 4 | 0 | 25 | 405.336 | 6 | ↓ |