General Information of the Compound
| Compound ID |
CP0451055
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| Compound Name |
US9249096, 3
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| Structure |
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| Formula |
C14H16N2O3
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| Molecular Weight |
260.293
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| Canonical SMILES |
CN1CC(C(=O)NCCc2ccccc2)=C(O)C1=O
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| InChI |
InChI=1S/C14H16N2O3/c1-16-9-11(12(17)14(16)19)13(18)15-8-7-10-5-3-2-4-6-10/h2-6,17H,7-9H2,1H3,(H,15,18)
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| InChIKey |
LOQCGFYTTYMYAV-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