General Information of the Compound
| Compound ID |
CP0394962
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| Compound Name |
N-[(4-hydroxy-3-methoxy-2-nitrophenyl)methyl]nonanamide
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| Structure |
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| Formula |
C17H26N2O5
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| Molecular Weight |
338.404
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| Canonical SMILES |
CCCCCCCCC(=O)NCc1ccc(O)c(OC)c1[N+]([O-])=O
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| InChI |
InChI=1S/C17H26N2O5/c1-3-4-5-6-7-8-9-15(21)18-12-13-10-11-14(20)17(24-2)16(13)19(22)23/h10-11,20H,3-9,12H2,1-2H3,(H,18,21)
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| InChIKey |
IPPIJLPKZDOCTM-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