In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 14th, 2008 | 28 | Yes |
Popular Name: (3R)-N-(1,3-benzodioxol-5-ylmethyl)-6-oxo-1-[2-(2-pyridyl)ethyl]piperidine-3-carboxamide (3R)-N-(1,3-benzodioxol-5-ylmeth…
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) | 1.47 | -2.76 | -16.35 | 1 | 7 | 0 | 81 | 381.432 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.47 | -2.63 | -41.69 | 2 | 7 | 1 | 82 | 382.44 | 6 | ↓ |