In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 19th, 2010 | 16 | Yes |
Popular Name: (2R,5S)-5-ethyl-2-methyl-4-[[(2S)-morpholin-2-yl]methyl]morpholine (2R,5S)-5-ethyl-2-methyl-4-[[(2S…
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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) | 0.69 | 1.31 | -42.79 | 2 | 4 | 1 | 38 | 229.344 | 3 | ↓ |
Hi High (pH 8-9.5) | 0.69 | -0.06 | -3.66 | 1 | 4 | 0 | 34 | 228.336 | 3 | ↓ |
Lo Low (pH 4.5-6) | 0.68 | 2.19 | -30.78 | 2 | 4 | 1 | 35 | 229.344 | 3 | ↓ |
Lo Low (pH 4.5-6) | 0.69 | 3.56 | -100.59 | 3 | 4 | 2 | 40 | 230.352 | 3 | ↓ |