In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 15th, 2010 | 20 | Yes |
Popular Name: (2R,4S,5R)-N-(1,3-benzodioxol-5-ylmethyl)-1,2,5-trimethyl-piperidin-4-amine (2R,4S,5R)-N-(1,3-benzodioxol-5-…
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) | 2.61 | 6.33 | -37.06 | 2 | 4 | 1 | 35 | 277.388 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.61 | 5.43 | -46.39 | 2 | 4 | 1 | 38 | 277.388 | 3 | ↓ |