| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2009 | 15 | Yes |
Popular Name: 3-[5-(trifluoromethyl)-1H-imidazol-2-yl]piperidine 3-[5-(trifluoromethyl)-1H-imidaz…
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CAS Number: 1153265-18-9
| 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) | 0.97 | 3.6 | -44.5 | 3 | 3 | 1 | 45 | 220.218 | 2 | ↓ |
| Hi High (pH 8-9.5) | 0.97 | 3.04 | -44.73 | 2 | 3 | 0 | 44 | 219.21 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
No pre-computed analogs available. Try a structural similarity search.
