| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2009 | 18 | Yes |
Popular Name: (1R)-1-[5-(1,3-benzodioxol-5-yl)-1H-imidazol-2-yl]propan-1-amine (1R)-1-[5-(1,3-benzodioxol-5-yl)…
| 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) | -0.04 | 2.78 | -48.8 | 4 | 5 | 1 | 75 | 246.29 | 3 | ↓ |
| Hi High (pH 8-9.5) | -0.04 | 2.47 | -11.35 | 3 | 5 | 0 | 73 | 245.282 | 3 | ↓ |
| Lo Low (pH 4.5-6) | -0.04 | 3.42 | -122.97 | 5 | 5 | 2 | 76 | 247.298 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
