General Information of the Compound
| Compound ID |
CP0430977
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| Compound Name |
3-chloro-4-hydroxy-N-[(E)-[5-[[4-(trifluoromethoxy)phenyl]methoxy]naphthalen-1-yl]methylideneamino]benzamide
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| Structure |
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| Formula |
C26H18ClF3N2O4
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| Molecular Weight |
514.887
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| Canonical SMILES |
Oc1ccc(cc1Cl)C(=O)N\N=C\c1cccc2c(OCc3ccc(OC(F)(F)F)cc3)cccc12
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| InChI |
InChI=1S/C26H18ClF3N2O4/c27-22-13-17(9-12-23(22)33)25(34)32-31-14-18-3-1-5-21-20(18)4-2-6-24(21)35-15-16-7-10-19(11-8-16)36-26(28,29)30/h1-14,33H,15H2,(H,32,34)/b31-14+
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| InChIKey |
VEHKHQXOBRPGMA-XAZZYMPDSA-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