| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 31st, 2009 | 24 | Yes |
Popular Name: 8-[(1S,3R)-3-methylcyclohexyl]-1-phenyl-1,3,8-triazaspiro[4.5]decan-4-one 8-[(1S,3R)-3-methylcyclohexyl]-1…
| 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) | 3.40 | 8.89 | -33.99 | 2 | 4 | 1 | 37 | 328.48 | 2 | ↓ |
| Hi High (pH 8-9.5) | 3.40 | 6.51 | -4.86 | 1 | 4 | 0 | 36 | 327.472 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | US6043366 | IBM Patent Data |
