General Information of the Compound
| Compound ID |
CP0519698
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| Compound Name |
4-azatricyclo[5.2.2.02,6]undec-8-en-4-yl(cyclohexyl)methanone
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| Structure |
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| Formula |
C17H25NO
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| Molecular Weight |
259.393
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| Canonical SMILES |
O=C(C1CCCCC1)N1CC2C(C1)C1CCC2C=C1
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| InChI |
InChI=1S/C17H25NO/c19-17(14-4-2-1-3-5-14)18-10-15-12-6-7-13(9-8-12)16(15)11-18/h6-7,12-16H,1-5,8-11H2
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| InChIKey |
AVIULPKIBHPWHA-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound