General Information of the Compound
| Compound ID |
CP0510109
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| Compound Name |
[(E)-pyridin-3-ylmethylideneamino] N-(4-decoxyphenyl)carbamate
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| Structure |
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| Formula |
C23H31N3O3
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| Molecular Weight |
397.519
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| Canonical SMILES |
CCCCCCCCCCOc1ccc(NC(=O)O\N=C\c2cccnc2)cc1
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| InChI |
InChI=1S/C23H31N3O3/c1-2-3-4-5-6-7-8-9-17-28-22-14-12-21(13-15-22)26-23(27)29-25-19-20-11-10-16-24-18-20/h10-16,18-19H,2-9,17H2,1H3,(H,26,27)/b25-19+
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| InChIKey |
BRJCLGIUPYQVNY-NCELDCMTSA-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