General Information of the Compound
| Compound ID |
CP0947304
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| Compound Name |
N-(4-Chlorophenethyl)-2-(3,4-dimethoxybenzylidene)hydrazinecarboxamide
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| Structure |
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| Formula |
C18H20ClN3O3
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| Molecular Weight |
361.829
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| Canonical SMILES |
COc1ccc(/C=N/NC(=O)NCCc2ccc(Cl)cc2)cc1OC
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| InChI |
InChI=1S/C18H20ClN3O3/c1-24-16-8-5-14(11-17(16)25-2)12-21-22-18(23)20-10-9-13-3-6-15(19)7-4-13/h3-8,11-12H,9-10H2,1-2H3,(H2,20,22,23)/b21-12+
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| InChIKey |
JJCAEUBETWINGT-CIAFOILYSA-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