In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 9th, 2010 | 19 | Yes |
Popular Name: 2-methyl-N-[[5-[[(2R)-2-methylmorpholin-4-yl]methyl]isoxazol-3-yl]methyl]propan-1-amine 2-methyl-N-[[5-[[(2R)-2-methylmo…
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) | 1.59 | 3.69 | -44.64 | 2 | 5 | 1 | 55 | 268.381 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.59 | 5.97 | -101.42 | 3 | 5 | 2 | 56 | 269.389 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.