General Information of the Compound
| Compound ID |
CP0548463
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| Compound Name |
1-[(3-fluorophenyl)methyl]-N-[[4-methoxy-2-(trifluoromethyl)phenyl]methyl]benzimidazole-5-carboxamide
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| Structure |
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| Formula |
C24H19F4N3O2
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| Molecular Weight |
457.427
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| Canonical SMILES |
COc1ccc(CNC(=O)c2ccc3n(Cc4cccc(F)c4)cnc3c2)c(c1)C(F)(F)F
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| InChI |
InChI=1S/C24H19F4N3O2/c1-33-19-7-5-17(20(11-19)24(26,27)28)12-29-23(32)16-6-8-22-21(10-16)30-14-31(22)13-15-3-2-4-18(25)9-15/h2-11,14H,12-13H2,1H3,(H,29,32)
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| InChIKey |
DAHUJQRVFWZQQE-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