In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 4th, 2009 | 19 | Yes |
Popular Name: 1-(3,4-dimethoxyphenyl)-N-[[(2S)-1,4-dioxan-2-yl]methyl]methanamine 1-(3,4-dimethoxyphenyl)-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) | 0.77 | 3.81 | -48.68 | 2 | 5 | 1 | 54 | 268.333 | 6 | ↓ |
Hi High (pH 8-9.5) | 0.77 | 2.39 | -8.22 | 1 | 5 | 0 | 49 | 267.325 | 6 | ↓ |