In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 12th, 2008 | 29 | Yes |
Popular Name: 1-benzyl-4-[1-[(4-ethoxyphenyl)methyl]-4-piperidyl]piperazine 1-benzyl-4-[1-[(4-ethoxyphenyl)m…
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) | 3.88 | 10.25 | -36.74 | 1 | 4 | 1 | 20 | 394.583 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.88 | 10.24 | -41.04 | 1 | 4 | 1 | 20 | 394.583 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.88 | 12.5 | -111.22 | 2 | 4 | 2 | 21 | 395.591 | 7 | ↓ |