General Information of the Compound
| Compound ID |
CP0506087
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| Compound Name |
4-chloro-N-(3-hydroxyphenyl)-5-(4-(trifluoromethyl)phenyl)isoxazole-3-carboxamide
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| Structure |
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| Formula |
C17H10ClF3N2O3
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| Molecular Weight |
382.725
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| Canonical SMILES |
Oc1cccc(NC(=O)c2noc(c2Cl)-c2ccc(cc2)C(F)(F)F)c1
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| InChI |
InChI=1S/C17H10ClF3N2O3/c18-13-14(16(25)22-11-2-1-3-12(24)8-11)23-26-15(13)9-4-6-10(7-5-9)17(19,20)21/h1-8,24H,(H,22,25)
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| InChIKey |
GKCADXGQKUQVGX-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