General Information of the Compound
| Compound ID |
CP0411959
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| Compound Name |
4-chloro-N-[[3-[2-(4-fluorophenyl)ethoxy]phenyl]methyl]-N-(pyridin-4-ylmethyl)benzamide
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| Structure |
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| Formula |
C28H24ClFN2O2
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| Molecular Weight |
474.963
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| Canonical SMILES |
Fc1ccc(CCOc2cccc(CN(Cc3ccncc3)C(=O)c3ccc(Cl)cc3)c2)cc1
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| InChI |
InChI=1S/C28H24ClFN2O2/c29-25-8-6-24(7-9-25)28(33)32(19-22-12-15-31-16-13-22)20-23-2-1-3-27(18-23)34-17-14-21-4-10-26(30)11-5-21/h1-13,15-16,18H,14,17,19-20H2
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| InChIKey |
FBJCRXMJZDRJQE-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