| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 23rd, 2009 | 18 | Yes |
Popular Name: (2S)-1-(3,4-dimethylphenoxy)-3-[[(1S)-1-methylpropyl]amino]propan-2-ol (2S)-1-(3,4-dimethylphenoxy)-3-[…
| 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) | 3.17 | 5.32 | -36.39 | 3 | 3 | 1 | 46 | 252.378 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.17 | 4.02 | -4.38 | 2 | 3 | 0 | 41 | 251.37 | 7 | ↓ |
