| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 11th, 2004 | 15 | Yes |
Popular Name: Di-sec-butylphenol, 2,6-isomer (~94%), 2,4-isomer (~4%) Di-sec-butylphenol, 2,6-isomer (…
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CAS Number: [5510-99-6]
| 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) | 4.39 | 1.4 | -2.94 | 1 | 1 | 0 | 20 | 206.329 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | WO1998015274A1 | IBM Patent Data |
No pre-computed analogs available. Try a structural similarity search.