| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 13th, 2011 | 19 | Yes |
Popular Name: (2S)-1-[1-[2-(4-bromophenoxy)ethyl]imidazol-2-yl]propan-2-amine (2S)-1-[1-[2-(4-bromophenoxy)eth…
| 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) | 1.98 | 6.4 | -40.49 | 3 | 4 | 1 | 55 | 325.23 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.98 | 6.04 | -7.23 | 2 | 4 | 0 | 53 | 324.222 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.98 | 6.92 | -110.26 | 4 | 4 | 2 | 56 | 326.238 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
