In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 28th, 2010 | 29 | Yes |
Popular Name: 2-[(2R)-1,4-bis[(4-ethoxyphenyl)methyl]piperazin-2-yl]ethanol 2-[(2R)-1,4-bis[(4-ethoxyphenyl)…
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) | 3.52 | 7.72 | -44.88 | 2 | 5 | 1 | 46 | 399.555 | 10 | ↓ |
Mid Mid (pH 6-8) | 3.52 | 7.62 | -40.37 | 2 | 5 | 1 | 46 | 399.555 | 10 | ↓ |
Mid Mid (pH 6-8) | 3.52 | 5.47 | -7.44 | 1 | 5 | 0 | 45 | 398.547 | 10 | ↓ |