| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 9th, 2010 | 20 | Yes |
Popular Name: [4-fluoro-3-[[(2R)-2-methylmorpholin-4-yl]methyl]benzothiophen-2-yl]methanamine [4-fluoro-3-[[(2R)-2-methylmorph…
| 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) | 2.38 | 3.42 | -48.64 | 3 | 3 | 1 | 40 | 295.403 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.38 | 3.01 | -5.76 | 2 | 3 | 0 | 38 | 294.395 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.38 | 5.96 | -120.23 | 4 | 3 | 2 | 41 | 296.411 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
