In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2009 | 17 | Yes |
Popular Name: [2-[(2S,5R)-5-ethyl-2-methyl-morpholin-4-yl]-3-pyridyl]methanamine [2-[(2S,5R)-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) | 1.35 | 3.51 | -47.72 | 3 | 4 | 1 | 53 | 236.339 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.35 | 3.1 | -5.08 | 2 | 4 | 0 | 51 | 235.331 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.35 | 3.99 | -102.07 | 4 | 4 | 2 | 54 | 237.347 | 3 | ↓ |