In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 9th, 2010 | 29 | Yes |
Popular Name: 1-[4-phenyl-1-(2-piperazin-1-ylpyridine-3-carbonyl)-4-piperidyl]ethanone 1-[4-phenyl-1-(2-piperazin-1-ylp…
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) | -0.20 | 9.38 | -43.18 | 2 | 6 | 1 | 70 | 393.511 | 4 | ↓ |
Hi High (pH 8-9.5) | -0.20 | 8.08 | -12.18 | 1 | 6 | 0 | 66 | 392.503 | 4 | ↓ |