In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 12th, 2008 | 22 | Yes |
Popular Name: 1-[1-[(4-bromophenyl)methyl]-4-piperidyl]-4-ethyl-piperazine 1-[1-[(4-bromophenyl)methyl]-4-p…
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) | 3.24 | 7.72 | -34.26 | 1 | 3 | 1 | 11 | 367.355 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.24 | 10.02 | -111.3 | 2 | 3 | 2 | 12 | 368.363 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.24 | 7.78 | -42.39 | 1 | 3 | 1 | 11 | 367.355 | 4 | ↓ |