In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 17th, 2008 | 19 | Yes |
Popular Name: (1R)-1-(1,3-benzodioxol-5-yl)-2-(4-methyl-1-piperidyl)ethanamine (1R)-1-(1,3-benzodioxol-5-yl)-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) | 0.50 | 5.16 | -36.52 | 3 | 4 | 1 | 49 | 263.361 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.50 | 5.49 | -132.26 | 4 | 4 | 2 | 51 | 264.369 | 3 | ↓ |