In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 30th, 2008 | 29 | Yes |
Popular Name: 2-[(2S)-1,4-bis[(4-ethoxyphenyl)methyl]piperazin-2-yl]ethanol 2-[(2S)-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 | 7.7 | -44.59 | 2 | 5 | 1 | 46 | 399.555 | 10 | ↓ |
Mid Mid (pH 6-8) | 3.52 | 7.58 | -40.23 | 2 | 5 | 1 | 46 | 399.555 | 10 | ↓ |
Mid Mid (pH 6-8) | 3.52 | 5.43 | -7.36 | 1 | 5 | 0 | 45 | 398.547 | 10 | ↓ |