General Information of the Compound
| Compound ID |
CP0002183
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| Compound Name |
3,7-diazabicyclo[3.3.1]nonan-3-yl(furan-2-yl)methanone
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| Structure |
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| Formula |
C12H16N2O2
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| Molecular Weight |
220.272
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| Canonical SMILES |
O=C(N1CC2CNCC(C2)C1)c1ccco1
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| InChI |
InChI=1S/C12H16N2O2/c15-12(11-2-1-3-16-11)14-7-9-4-10(8-14)6-13-5-9/h1-3,9-10,13H,4-8H2
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| InChIKey |
PSXPQUNJMZAIKK-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