General Information of the Compound
| Compound ID |
CP0470948
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| Compound Name |
2-(3-Benzo[1,3]dioxol-5-yl-ureido)-4-chloro-benzoic acid
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| Structure |
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| Formula |
C15H11ClN2O5
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| Molecular Weight |
334.715
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| Canonical SMILES |
OC(=O)c1ccc(Cl)cc1NC(=O)Nc1ccc2OCOc2c1
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| InChI |
InChI=1S/C15H11ClN2O5/c16-8-1-3-10(14(19)20)11(5-8)18-15(21)17-9-2-4-12-13(6-9)23-7-22-12/h1-6H,7H2,(H,19,20)(H2,17,18,21)
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| InChIKey |
JRTRHAJORIWUJX-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