| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 21st, 2009 | 17 | Yes |
Popular Name: 1-(3,4-dimethylphenyl)-N-[[(2S)-1,4-dioxan-2-yl]methyl]methanamine 1-(3,4-dimethylphenyl)-N-[[(2S)-…
| 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) | 1.95 | 5.78 | -40.56 | 2 | 3 | 1 | 35 | 236.335 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.95 | 4.42 | -4.33 | 1 | 3 | 0 | 30 | 235.327 | 4 | ↓ |
