| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 31st, 2009 | 28 | Yes |
Popular Name: 8-[(2S,4aS,8aR)-4a-methyldecalin-2-yl]-1-phenyl-1,3,8-triazaspiro[4.5]decan-4-one 8-[(2S,4aS,8aR)-4a-methyldecalin…
None
| 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) | 4.54 | 10.5 | -36.12 | 2 | 4 | 1 | 37 | 382.572 | 2 | ↓ |
| Hi High (pH 8-9.5) | 4.54 | 8.14 | -4.64 | 1 | 4 | 0 | 36 | 381.564 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | US6043366 | IBM Patent Data |
