In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 31st, 2010 | 25 | Yes |
Popular Name: N-[4-[[4-(2-pyridyl)piperazin-1-yl]methyl]phenyl]cyclopropanecarboxamide N-[4-[[4-(2-pyridyl)piperazin-1-…
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) | 2.48 | 8.35 | -32.55 | 2 | 5 | 1 | 50 | 337.447 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.48 | 8.04 | -10.86 | 1 | 5 | 0 | 48 | 336.439 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.48 | 10.58 | -96.37 | 3 | 5 | 2 | 51 | 338.455 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.48 | 10.26 | -44.11 | 2 | 5 | 1 | 50 | 337.447 | 5 | ↓ |