General Information of the Compound
| Compound ID |
CP0463417
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| Compound Name |
5-butyl-6-oxo-8,9,10,11-tetrahydro-7H-cyclohepta[c]quinoline-2-carboxamide
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| Structure |
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| Formula |
C19H24N2O2
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| Molecular Weight |
312.413
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| Canonical SMILES |
CCCCn1c2ccc(cc2c2CCCCCc2c1=O)C(N)=O
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| InChI |
InChI=1S/C19H24N2O2/c1-2-3-11-21-17-10-9-13(18(20)22)12-16(17)14-7-5-4-6-8-15(14)19(21)23/h9-10,12H,2-8,11H2,1H3,(H2,20,22)
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| InChIKey |
KTJJEQUDVFRYSN-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