General Information of the Compound
| Compound ID |
CP0421371
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| Compound Name |
5-(5-chloro-2-ethoxyphenyl)-N-(diaminomethylidene)furan-2-carboxamide
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| Structure |
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| Formula |
C14H14ClN3O3
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| Molecular Weight |
307.737
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| Canonical SMILES |
CCOc1ccc(Cl)cc1-c1ccc(o1)C(=O)NC(N)=N
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| InChI |
InChI=1S/C14H14ClN3O3/c1-2-20-10-4-3-8(15)7-9(10)11-5-6-12(21-11)13(19)18-14(16)17/h3-7H,2H2,1H3,(H4,16,17,18,19)
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| InChIKey |
POAULWSYSFAXTP-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