General Information of the Compound
| Compound ID |
CP0535830
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| Compound Name |
N-[4-(4-amino-3-carbamoylphenoxy)phenyl]-4-chloro-3-(trifluoromethyl)benzamide
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| Structure |
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| Formula |
C21H15ClF3N3O3
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| Molecular Weight |
449.816
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| Canonical SMILES |
NC(=O)c1cc(Oc2ccc(NC(=O)c3ccc(Cl)c(c3)C(F)(F)F)cc2)ccc1N
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| InChI |
InChI=1S/C21H15ClF3N3O3/c22-17-7-1-11(9-16(17)21(23,24)25)20(30)28-12-2-4-13(5-3-12)31-14-6-8-18(26)15(10-14)19(27)29/h1-10H,26H2,(H2,27,29)(H,28,30)
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| InChIKey |
UCNMNNLFLYZRLD-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