In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 9th, 2010 | 25 | Yes |
Popular Name: N-(1,3-benzodioxol-5-ylmethyl)-2-piperazin-1-yl-pyridine-3-carboxamide N-(1,3-benzodioxol-5-ylmethyl)-2…
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) | 0.87 | 5.25 | -41.84 | 3 | 7 | 1 | 80 | 341.391 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.87 | 3.94 | -12.42 | 2 | 7 | 0 | 76 | 340.383 | 4 | ↓ |