| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 4th, 2011 | 20 | Yes |
Popular Name: 2-[1-[[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]triazol-4-yl]propan-2-amine 2-[1-[[(3R)-2,3-dihydro-1,4-benz…
| 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) | 1.43 | 3.41 | -59.63 | 3 | 6 | 1 | 77 | 275.332 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.43 | 3.16 | -14.81 | 2 | 6 | 0 | 75 | 274.324 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
