General Information of the Compound
| Compound ID |
CP0564734
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| Compound Name |
5-[4-(2-chlorophenoxy)-3-[(4-methylphenyl)carbamoylamino]phenyl]-2-methoxybenzoic acid
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| Structure |
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| Formula |
C28H23ClN2O5
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| Molecular Weight |
502.954
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| Canonical SMILES |
COc1ccc(cc1C(O)=O)-c1ccc(Oc2ccccc2Cl)c(NC(=O)Nc2ccc(C)cc2)c1
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| InChI |
InChI=1S/C28H23ClN2O5/c1-17-7-11-20(12-8-17)30-28(34)31-23-16-19(18-9-13-24(35-2)21(15-18)27(32)33)10-14-26(23)36-25-6-4-3-5-22(25)29/h3-16H,1-2H3,(H,32,33)(H2,30,31,34)
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| InChIKey |
DGLBJRJMJNMNFV-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