| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 28th, 2009 | 13 | Yes |
Popular Name: 3-(2,5-dimethylpyrrolidin-1-yl)piperidine dihydrochloride 3-(2,5-dimethylpyrrolidin-1-yl)p…
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CAS Numbers: 1212248-94-6 , 1212823-19-2
| 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) | 1.23 | 5.57 | -99.54 | 3 | 2 | 2 | 21 | 184.327 | 1 | ↓ |
| Hi High (pH 8-9.5) | 1.23 | 3.69 | -36.66 | 2 | 2 | 1 | 20 | 183.319 | 1 | ↓ |
| Hi High (pH 8-9.5) | 1.23 | 2.35 | -1.14 | 1 | 2 | 0 | 15 | 182.311 | 1 | ↓ |
| Mid Mid (pH 6-8) | 1.23 | 4.24 | -26.08 | 2 | 2 | 1 | 16 | 183.319 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 290 - 292 | Enamine Building Blocks |
| MP | 290...292 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
No pre-computed analogs available. Try a structural similarity search.