General Information of the Compound
| Compound ID |
CP0555911
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| Compound Name |
N-(3-amino-4-ethylphenyl)-4-oxo-1H-quinoline-3-carboxamide
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| Structure |
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| Formula |
C18H17N3O2
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| Molecular Weight |
307.353
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| Canonical SMILES |
CCc1ccc(NC(=O)c2c[nH]c3ccccc3c2=O)cc1N
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| InChI |
InChI=1S/C18H17N3O2/c1-2-11-7-8-12(9-15(11)19)21-18(23)14-10-20-16-6-4-3-5-13(16)17(14)22/h3-10H,2,19H2,1H3,(H,20,22)(H,21,23)
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| InChIKey |
YEXNCJOLYHJHPB-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