In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2010 | 20 | Yes |
Popular Name: (1R)-1-(1,3-benzodioxol-5-yl)-N,N'-dimethyl-N'-[(1R)-1-methylbutyl]ethane-1,2-diamine (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) | 3.37 | 7.55 | -119.6 | 3 | 4 | 2 | 40 | 280.412 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.37 | 6.7 | -37.1 | 2 | 4 | 1 | 35 | 279.404 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.37 | 5.75 | -46.37 | 2 | 4 | 1 | 38 | 279.404 | 7 | ↓ |