In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 12th, 2006 | 17 | Yes |
Popular Name: [3-(2,6-dimethylphenoxy)-2-hydroxypropyl](propan-2-yl)amine [3-(2,6-dimethylphenoxy)-2-hydro…
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 | 4.58 | -39.33 | 3 | 3 | 1 | 46 | 238.351 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.61 | 3.31 | -4.89 | 2 | 3 | 0 | 41 | 237.343 | 6 | ↓ |