General Information of the Compound
| Compound ID |
CP0500241
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| Compound Name |
[(E)-benzylideneamino] N-(4-undecoxyphenyl)carbamate
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| Structure |
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| Formula |
C25H34N2O3
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| Molecular Weight |
410.558
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| Canonical SMILES |
CCCCCCCCCCCOc1ccc(NC(=O)O\N=C\c2ccccc2)cc1
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| InChI |
InChI=1S/C25H34N2O3/c1-2-3-4-5-6-7-8-9-13-20-29-24-18-16-23(17-19-24)27-25(28)30-26-21-22-14-11-10-12-15-22/h10-12,14-19,21H,2-9,13,20H2,1H3,(H,27,28)/b26-21+
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| InChIKey |
FLKKARBXCBZFGH-YYADALCUSA-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