| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 31st, 2009 | 15 | Yes |
Popular Name: 8-methyl-3-(piperazin-1-yl)-8-azabicyclo[3.2.1]octane 8-methyl-3-(piperazin-1-yl)-8-az…
Find On: PubMed — Wikipedia — Google
CAS Number: 195504-08-6
| 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) | 0.44 | 2.27 | -28.9 | 2 | 3 | 1 | 20 | 210.345 | 1 | ↓ |
| Hi High (pH 8-9.5) | 0.44 | 5.76 | -83.78 | 3 | 3 | 2 | 24 | 211.353 | 1 | ↓ |
| Hi High (pH 8-9.5) | 0.44 | 4.4 | -29.75 | 2 | 3 | 1 | 20 | 210.345 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 0.44 | 5.95 | -188.87 | 4 | 3 | 3 | 25 | 212.361 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| PUBCHEM_PATENT_ID | US6156752 | IBM Patent Data |
