In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 9th, 2008 | 22 | Yes |
Popular Name: 1-[4-[(2S)-2-(2,5-dimethoxyphenyl)-2-hydroxy-ethyl]piperazin-1-yl]ethanone 1-[4-[(2S)-2-(2,5-dimethoxypheny…
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) | 0.45 | 1.29 | -12.83 | 1 | 6 | 0 | 62 | 308.378 | 5 | ↓ |
Lo Low (pH 4.5-6) | 0.45 | 3.63 | -43.83 | 2 | 6 | 1 | 63 | 309.386 | 5 | ↓ |