General Information of the Compound
| Compound ID |
CP0541654
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| Compound Name |
(R)-2-methyl-1-(4-phenyl-5-(4-(trifluoromethyl)phenyl)-1H-imidazol-2-yl)-4-(3-(trifluoromethyl)pyridin-2-yl)piperazine
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| Structure |
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| Formula |
C27H23F6N5
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| Molecular Weight |
531.504
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| Canonical SMILES |
C[C@@H]1CN(CCN1c1nc(c([nH]1)-c1ccc(cc1)C(F)(F)F)-c1ccccc1)c1ncccc1C(F)(F)F
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| InChI |
InChI=1S/C27H23F6N5/c1-17-16-37(24-21(27(31,32)33)8-5-13-34-24)14-15-38(17)25-35-22(18-6-3-2-4-7-18)23(36-25)19-9-11-20(12-10-19)26(28,29)30/h2-13,17H,14-16H2,1H3,(H,35,36)/t17-/m1/s1
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| InChIKey |
JUZWMCRZHNBIHC-QGZVFWFLSA-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