| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 21st, 2011 | 18 | Yes |
Popular Name: 2-methyl-1-[4-[(1-methylimidazol-2-yl)methyl]piperazin-1-yl]propan-2-ol 2-methyl-1-[4-[(1-methylimidazol…
| 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) | -0.03 | 2.15 | -28.55 | 2 | 5 | 1 | 46 | 253.37 | 4 | ↓ |
| Hi High (pH 8-9.5) | -0.03 | 1.48 | -8.83 | 1 | 5 | 0 | 45 | 252.362 | 4 | ↓ |
| Mid Mid (pH 6-8) | -0.03 | 3.94 | -82.47 | 3 | 5 | 2 | 47 | 254.378 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
