| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 5th, 2009 | 26 | Yes |
Popular Name: 2-(3,5-dimethylphenoxy)-N-methyl-N-[(1S)-1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]ethanamine 2-(3,5-dimethylphenoxy)-N-methyl…
| 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) | 3.60 | 14.32 | -47.17 | 1 | 5 | 1 | 44 | 351.474 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.60 | 12.2 | -9.17 | 0 | 5 | 0 | 43 | 350.466 | 7 | ↓ |
