In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 6th, 2004 | 19 | Yes |
Popular Name: 4'-(Trans-4-n-butylcyclohexyl)acetophenone 4'-(Trans-4-n-butylcyclohexyl)ac…
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CAS Number: 83626-30-6
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) | 5.72 | 11.26 | -5.95 | 0 | 1 | 0 | 17 | 258.405 | 5 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | EP0421438A2; EP0421438B1; US5151214 | IBM Patent Data |