General Information of the Compound
| Compound ID |
CP0393871
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| Compound Name |
1-Benzyl-7-chloro-4-hydroxy-N′-octanoyl-2-oxo-1,2-dihydroquinoline-3-carbohydrazide
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| Structure |
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| Formula |
C25H28ClN3O4
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| Molecular Weight |
469.969
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| Canonical SMILES |
CCCCCCCC(=O)NNC(=O)c1c(O)c2ccc(Cl)cc2n(Cc2ccccc2)c1=O
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| InChI |
InChI=1S/C25H28ClN3O4/c1-2-3-4-5-9-12-21(30)27-28-24(32)22-23(31)19-14-13-18(26)15-20(19)29(25(22)33)16-17-10-7-6-8-11-17/h6-8,10-11,13-15,31H,2-5,9,12,16H2,1H3,(H,27,30)(H,28,32)
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| InChIKey |
SMVTZKRCEVFVRJ-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