General Information of the Compound
| Compound ID |
CP0013098
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| Compound Name |
5-[(1R,6R)-9-azabicyclo[4.2.1]non-2-en-2-yl]-3-methyl-1,2-oxazole
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| Structure |
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| Formula |
C12H16N2O
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| Molecular Weight |
204.273
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| Canonical SMILES |
Cc1cc(on1)C1=CCC[C@@H]2CC[C@H]1N2
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| InChI |
InChI=1S/C12H16N2O/c1-8-7-12(15-14-8)10-4-2-3-9-5-6-11(10)13-9/h4,7,9,11,13H,2-3,5-6H2,1H3/t9-,11-/m1/s1
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| InChIKey |
SQXMPQMUYIPXNQ-MWLCHTKSSA-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