General Information of the Compound
| Compound ID |
CP0571663
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| Compound Name |
1-Benzyl-N′-dodecanoyl-4-hydroxy-2-oxo-1,2-dihydroquinoline-3-carbohydrazide
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| Structure |
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| Formula |
C29H37N3O4
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| Molecular Weight |
491.632
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| Canonical SMILES |
CCCCCCCCCCCC(=O)NNC(=O)c1c(O)c2ccccc2n(Cc2ccccc2)c1=O
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| InChI |
InChI=1S/C29H37N3O4/c1-2-3-4-5-6-7-8-9-13-20-25(33)30-31-28(35)26-27(34)23-18-14-15-19-24(23)32(29(26)36)21-22-16-11-10-12-17-22/h10-12,14-19,34H,2-9,13,20-21H2,1H3,(H,30,33)(H,31,35)
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| InChIKey |
OYWVJUQFSCWSNR-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