General Information of the Compound
| Compound ID |
CP0438403
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| Compound Name |
4-Chloro-2-[3-(3-methoxy-phenyl)-ureido]-benzoic acid
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| Structure |
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| Formula |
C15H13ClN2O4
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| Molecular Weight |
320.732
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| Canonical SMILES |
COc1cccc(NC(=O)Nc2cc(Cl)ccc2C(O)=O)c1
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| InChI |
InChI=1S/C15H13ClN2O4/c1-22-11-4-2-3-10(8-11)17-15(21)18-13-7-9(16)5-6-12(13)14(19)20/h2-8H,1H3,(H,19,20)(H2,17,18,21)
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| InChIKey |
QSDFTOLEIPASGM-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