| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 9th, 2010 | 16 | Yes |
Popular Name: N-methyl-1-[5-[[(2S)-2-methylmorpholin-4-yl]methyl]isoxazol-3-yl]methanamine N-methyl-1-[5-[[(2S)-2-methylmor…
| 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) | 0.47 | 1.44 | -43.77 | 2 | 5 | 1 | 55 | 226.3 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.47 | -0.01 | -7.5 | 1 | 5 | 0 | 51 | 225.292 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.47 | 3.73 | -99.29 | 3 | 5 | 2 | 56 | 227.308 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
