In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 25th, 2008 | 14 | Yes |
Popular Name: 3-piperazin-1-ylquinuclidine 3-piperazin-1-ylquinuclidine
Find On: PubMed — Wikipedia — Google
CAS Number: 1301739-70-7
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) | 0.29 | 3.58 | -85.98 | 3 | 3 | 2 | 24 | 197.326 | 1 | ↓ |
Hi High (pH 8-9.5) | 0.29 | 2.22 | -33.3 | 2 | 3 | 1 | 20 | 196.318 | 1 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | US6156752 | IBM Patent Data |