General Information of the Compound
| Compound ID |
CP0503242
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| Compound Name |
N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-2-methyl-6-(4-methylpiperazin-1-yl)-4-phenylpyridine-3-carboxamide
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| Structure |
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| Formula |
C27H26F6N4O
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| Molecular Weight |
536.52
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| Canonical SMILES |
CN1CCN(CC1)c1cc(-c2ccccc2)c(C(=O)NCc2cc(cc(c2)C(F)(F)F)C(F)(F)F)c(C)n1
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| InChI |
InChI=1S/C27H26F6N4O/c1-17-24(25(38)34-16-18-12-20(26(28,29)30)14-21(13-18)27(31,32)33)22(19-6-4-3-5-7-19)15-23(35-17)37-10-8-36(2)9-11-37/h3-7,12-15H,8-11,16H2,1-2H3,(H,34,38)
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| InChIKey |
GVBGRESFEXAWSN-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