General Information of the Compound
| Compound ID |
CP0009376
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| Compound Name |
7-(5-fluoropyridin-3-yl)-3-methyl-3-azabicyclo[3.3.1]non-6-ene
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| Structure |
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| Formula |
C14H17FN2
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| Molecular Weight |
232.302
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| Canonical SMILES |
CN1CC2CC(C1)C=C(C2)c1cncc(F)c1
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| InChI |
InChI=1S/C14H17FN2/c1-17-8-10-2-11(9-17)4-12(3-10)13-5-14(15)7-16-6-13/h3,5-7,10-11H,2,4,8-9H2,1H3
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| InChIKey |
ZMEGTXPZASMCHV-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