In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 4th, 2009 | 26 | Yes |
Popular Name: 6-[4-(1,3-benzodioxol-5-ylmethyl)-3-oxo-piperazin-1-yl]pyridine-3-carboxamide 6-[4-(1,3-benzodioxol-5-ylmethyl…
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) | 0.47 | 2.03 | -21.49 | 2 | 8 | 0 | 98 | 354.366 | 4 | ↓ |
Lo Low (pH 4.5-6) | 0.47 | 2.47 | -56.94 | 3 | 8 | 1 | 99 | 355.374 | 4 | ↓ |