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'-(2,2,2-trifluoroethyl)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) | 2.53 | 3.96 | -53.96 | 2 | 4 | 1 | 38 | 291.293 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.53 | 2.35 | -6.87 | 1 | 4 | 0 | 34 | 290.285 | 6 | ↓ |