In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 14th, 2010 | 21 | Yes |
Popular Name: 1-(4-ethylpiperazin-1-yl)-2-(5-methylbenzofuran-3-yl)ethanone 1-(4-ethylpiperazin-1-yl)-2-(5-m…
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) | 2.41 | 6.76 | -12.29 | 0 | 4 | 0 | 37 | 286.375 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.41 | 8.97 | -49.13 | 1 | 4 | 1 | 38 | 287.383 | 3 | ↓ |