In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 5th, 2008 | 20 | Yes |
Popular Name: 1-[(2-bromo-4,5-dimethoxy-phenyl)methyl]-4-ethyl-piperazine 1-[(2-bromo-4,5-dimethoxy-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) | 2.39 | 6.43 | -37.72 | 1 | 4 | 1 | 26 | 344.273 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.39 | 6.32 | -34.73 | 1 | 4 | 1 | 26 | 344.273 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.39 | 4.04 | -5.1 | 0 | 4 | 0 | 25 | 343.265 | 5 | ↓ |