In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 18 | Yes |
Popular Name: [4-[(2R,5S)-5-ethyl-2-methyl-morpholin-4-yl]-1-methyl-4-piperidyl]methanamine [4-[(2R,5S)-5-ethyl-2-methyl-mor…
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) | 0.71 | 2.5 | -116.53 | 4 | 4 | 2 | 45 | 257.422 | 3 | ↓ |
Hi High (pH 8-9.5) | 0.71 | 2.56 | -39.48 | 3 | 4 | 1 | 43 | 256.414 | 3 | ↓ |