In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 18 | Yes |
Popular Name: 2-(4-ethylpiperazin-1-yl)-1-(4-hydroxyphenyl)ethanone 2-(4-ethylpiperazin-1-yl)-1-(4-h…
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) | 1.28 | 3.81 | -37.89 | 2 | 4 | 1 | 45 | 249.334 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.28 | 2.29 | -42.67 | 0 | 4 | -1 | 47 | 247.318 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.28 | 1.52 | -8.36 | 1 | 4 | 0 | 44 | 248.326 | 4 | ↓ |