General Information of the Compound
| Compound ID |
CP0490392
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| Compound Name |
(5-chloro-6-(4-(4-phenyl-5-(4-(trifluoromethyl)phenyl)-1H-imidazol-2-yl)piperazin-1-yl)pyridin-3-yl)methanol
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| Structure |
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| Formula |
C26H23ClF3N5O
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| Molecular Weight |
513.951
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| Canonical SMILES |
OCc1cnc(N2CCN(CC2)c2nc(c([nH]2)-c2ccc(cc2)C(F)(F)F)-c2ccccc2)c(Cl)c1
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| InChI |
InChI=1S/C26H23ClF3N5O/c27-21-14-17(16-36)15-31-24(21)34-10-12-35(13-11-34)25-32-22(18-4-2-1-3-5-18)23(33-25)19-6-8-20(9-7-19)26(28,29)30/h1-9,14-15,36H,10-13,16H2,(H,32,33)
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| InChIKey |
AMCYXPADENABGR-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