| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 18th, 2011 | 18 | Yes |
Popular Name: ETHYL 4-OXO-1-(4-PYRIDINYL)CYCLOHEXANECARBOXYLATE ETHYL 4-OXO-1-(4-PYRIDINYL)CYCLO…
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CAS Number: 1255098-68-0
| 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) | 1.04 | 6.79 | -8.46 | 0 | 4 | 0 | 56 | 247.294 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.04 | 7.24 | -43.58 | 1 | 4 | 1 | 58 | 248.302 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Purity | 97% | Fluorochem |
No pre-computed analogs available. Try a structural similarity search.
