In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2010 | 21 | Yes |
Popular Name: (1R)-1-(1,3-benzodioxol-5-yl)-N-ethyl-2-[(2R)-2-ethylpyrrolidin-1-yl]ethanamine (1R)-1-(1,3-benzodioxol-5-yl)-N-…
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) | 3.24 | 8.63 | -123.77 | 3 | 4 | 2 | 40 | 292.423 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.24 | 7.59 | -35.24 | 2 | 4 | 1 | 35 | 291.415 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.24 | 7.07 | -40.13 | 2 | 4 | 1 | 38 | 291.415 | 6 | ↓ |