In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 8th, 2010 | 17 | Yes |
Popular Name: 1-[5-[[(2R,6R)-2,6-dimethylmorpholin-4-yl]methyl]isoxazol-3-yl]-N-methyl-methanamine 1-[5-[[(2R,6R)-2,6-dimethylmorph…
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) | 0.84 | 2.42 | -44.19 | 2 | 5 | 1 | 55 | 240.327 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.84 | 0.97 | -7.36 | 1 | 5 | 0 | 51 | 239.319 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.84 | 4.38 | -99.53 | 3 | 5 | 2 | 56 | 241.335 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.