General Information of the Compound
| Compound ID |
CP0223867
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| Compound Name |
4-Ethyl-8-oxo-6-trifluoromethyl-3,4,8,9-tetrahydro-2H-pyrido[3,2-g]quinoline-1-carbaldehyde
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| Structure |
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| Formula |
C16H15F3N2O2
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| Molecular Weight |
324.302
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| Canonical SMILES |
CCC1CCN(C=O)c2cc3[nH]c(=O)cc(c3cc12)C(F)(F)F
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| InChI |
InChI=1S/C16H15F3N2O2/c1-2-9-3-4-21(8-22)14-7-13-11(5-10(9)14)12(16(17,18)19)6-15(23)20-13/h5-9H,2-4H2,1H3,(H,20,23)
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| InChIKey |
ICKZVZFIQAMKFY-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