In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 19th, 2008 | 32 | Yes |
Popular Name: 1-[1-(1,3-benzodioxol-4-ylmethyl)-4-piperidyl]-N-(2-pyridylmethyl)piperidine-4-carboxamide 1-[1-(1,3-benzodioxol-4-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) | 2.13 | 7.8 | -47.02 | 2 | 7 | 1 | 68 | 437.564 | 6 | ↓ |
Lo Low (pH 4.5-6) | 2.13 | 10.15 | -175.11 | 4 | 7 | 3 | 71 | 439.58 | 6 | ↓ |
Lo Low (pH 4.5-6) | 2.13 | 7.74 | -47.95 | 2 | 7 | 1 | 68 | 437.564 | 6 | ↓ |