In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 11th, 2008 | 19 | Yes |
Popular Name: (4-ethylpiperazin-1-yl)-(2-hydroxy-3-methoxy-phenyl)methanone (4-ethylpiperazin-1-yl)-(2-hydro…
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) | 1.26 | 4.72 | -46.85 | 2 | 5 | 1 | 54 | 265.333 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.26 | 3.33 | -58.98 | 0 | 5 | -1 | 56 | 263.317 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.26 | 2.45 | -13.13 | 1 | 5 | 0 | 53 | 264.325 | 3 | ↓ |