| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 4th, 2011 | 20 | Yes |
Popular Name: N-[(S)-2,3-dihydro-1,4-benzodioxin-6-yl(pyrimidin-4-yl)methyl]ethanamine N-[(S)-2,3-dihydro-1,4-benzodiox…
| 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) | 1.47 | 6.18 | -40.64 | 2 | 5 | 1 | 61 | 272.328 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.47 | 5.39 | -8.05 | 1 | 5 | 0 | 56 | 271.32 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
