| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 3rd, 2012 | 19 | Yes |
Popular Name: tert-Butyl 2-(3,9-diazaspiro[5.5]undecan-3-yl)acetate tert-Butyl 2-(3,9-diazaspiro[5.5…
Find On: PubMed — Wikipedia — Google
CAS Number: 189333-51-5
| 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) | 1.70 | 7.62 | -96 | 3 | 4 | 2 | 47 | 270.417 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.70 | 5.45 | -43.46 | 2 | 4 | 1 | 46 | 269.409 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | WO1997011940A1 | IBM Patent Data |
No pre-computed analogs available. Try a structural similarity search.