General Information of the Compound
| Compound ID |
CP0530771
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| Compound Name |
3,4-dichloro-N-(4-nitro-2-phenylmethoxyphenyl)benzamide
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| Structure |
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| Formula |
C20H14Cl2N2O4
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| Molecular Weight |
417.248
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| Canonical SMILES |
[O-][N+](=O)c1ccc(NC(=O)c2ccc(Cl)c(Cl)c2)c(OCc2ccccc2)c1
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| InChI |
InChI=1S/C20H14Cl2N2O4/c21-16-8-6-14(10-17(16)22)20(25)23-18-9-7-15(24(26)27)11-19(18)28-12-13-4-2-1-3-5-13/h1-11H,12H2,(H,23,25)
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| InChIKey |
ACGOMTBIEIVSSK-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