In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 5th, 2009 | 28 | Yes |
Popular Name: 6-[4-(1,3-benzodioxol-5-ylmethyl)-3-oxo-piperazin-1-yl]-N,N-dimethyl-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) | 0.61 | 5.39 | -19.25 | 0 | 8 | 0 | 75 | 382.42 | 4 | ↓ |
Lo Low (pH 4.5-6) | 0.61 | 5.77 | -59.18 | 1 | 8 | 1 | 76 | 383.428 | 4 | ↓ |