In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 15th, 2013 | 17 | Yes |
Popular Name: TRANS-2-(4-FLUOROBENZOYL)CYCLOPENTANE-1-CARBOXYLICACID TRANS-2-(4-FLUOROBENZOYL)CYCLOPE…
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CAS Number: 733741-06-5
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) | 2.52 | 8.16 | -45.93 | 0 | 3 | -1 | 57 | 235.234 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.