In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 14th, 2009 | 25 | Yes |
Popular Name: 2-(3-methoxyphenyl)-N-[6-(3-oxopiperazin-1-yl)-3-pyridyl]acetamide 2-(3-methoxyphenyl)-N-[6-(3-oxop…
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) | 1.80 | 3.16 | -19.28 | 2 | 7 | 0 | 84 | 340.383 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.80 | 3.41 | -53.22 | 3 | 7 | 1 | 85 | 341.391 | 5 | ↓ |