In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 14th, 2009 | 24 | Yes |
Popular Name: 2-(4-fluorophenyl)-N-[6-(3-oxopiperazin-1-yl)-3-pyridyl]acetamide 2-(4-fluorophenyl)-N-[6-(3-oxopi…
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) | 1.93 | 3.91 | -18.88 | 2 | 6 | 0 | 74 | 328.347 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.93 | 4.17 | -54.87 | 3 | 6 | 1 | 76 | 329.355 | 4 | ↓ |