General Information of the Compound
| Compound ID |
CP0575130
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| Compound Name |
N-[2-chloro-5-(propanoylamino)phenyl]-1,3-benzodioxole-5-carboxamide
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| Structure |
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| Formula |
C17H15ClN2O4
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| Molecular Weight |
346.77
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| Canonical SMILES |
CCC(=O)Nc1ccc(Cl)c(NC(=O)c2ccc3OCOc3c2)c1
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| InChI |
InChI=1S/C17H15ClN2O4/c1-2-16(21)19-11-4-5-12(18)13(8-11)20-17(22)10-3-6-14-15(7-10)24-9-23-14/h3-8H,2,9H2,1H3,(H,19,21)(H,20,22)
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| InChIKey |
YSQOPHSKDNWFIP-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