In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 18th, 2008 | 28 | Yes |
Popular Name: N-[6-[4-(3-cyanobenzoyl)piperazin-1-yl]-3-pyridyl]-2-methoxy-acetamide N-[6-[4-(3-cyanobenzoyl)piperazi…
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) | 0.66 | 6.08 | -24.61 | 1 | 8 | 0 | 99 | 379.42 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.66 | 6.38 | -54.47 | 2 | 8 | 1 | 100 | 380.428 | 5 | ↓ |