In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 19th, 2010 | 20 | Yes |
Popular Name: 2-(4-acetylpiperazin-1-yl)-1-(2-fluoro-5-methyl-phenyl)ethanone 2-(4-acetylpiperazin-1-yl)-1-(2-…
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 | 5.73 | -17.76 | 0 | 4 | 0 | 41 | 278.327 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.28 | 7.83 | -55.01 | 1 | 4 | 1 | 42 | 279.335 | 3 | ↓ |