In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 24th, 2008 | 21 | Yes |
Popular Name: (1S)-2-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-1-(4-propoxyphenyl)ethanamine (1S)-2-[(2S,6S)-2,6-dimethylmorp…
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) | 0.96 | 4.89 | -50.12 | 3 | 4 | 1 | 49 | 293.431 | 6 | ↓ |
Hi High (pH 8-9.5) | 0.96 | 4.56 | -4.34 | 2 | 4 | 0 | 48 | 292.423 | 6 | ↓ |
Lo Low (pH 4.5-6) | 0.96 | 6.72 | -139.73 | 4 | 4 | 2 | 51 | 294.439 | 6 | ↓ |