In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 21st, 2009 | 18 | Yes |
Popular Name: N-[[(2S)-1,4-dioxan-2-yl]methyl]-1-(2,4,5-trimethylphenyl)methanamine N-[[(2S)-1,4-dioxan-2-yl]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) | 2.33 | 6.32 | -40.3 | 2 | 3 | 1 | 35 | 250.362 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.33 | 4.97 | -4.45 | 1 | 3 | 0 | 30 | 249.354 | 4 | ↓ |