General Information of the Compound
| Compound ID |
CP0547910
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| Compound Name |
benzyl 2-[[2-[(4-hydroxy-1-methyl-2-oxoquinoline-3-carbonyl)amino]acetyl]amino]acetate
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| Structure |
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| Formula |
C22H21N3O6
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| Molecular Weight |
423.425
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| Canonical SMILES |
Cn1c2ccccc2c(O)c(C(=O)NCC(=O)NCC(=O)OCc2ccccc2)c1=O
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| InChI |
InChI=1S/C22H21N3O6/c1-25-16-10-6-5-9-15(16)20(28)19(22(25)30)21(29)24-11-17(26)23-12-18(27)31-13-14-7-3-2-4-8-14/h2-10,28H,11-13H2,1H3,(H,23,26)(H,24,29)
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| InChIKey |
ZHXUMXQICGDIDE-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