General Information of the Compound
| Compound ID |
CP0123935
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| Compound Name |
5-(1-methylimidazol-4-yl)-2-[1-[2-[4-(trifluoromethoxy)phenyl]acetyl]piperidin-4-yl]oxypyridine-3-carboxamide
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| Structure |
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| Formula |
C24H24F3N5O4
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| Molecular Weight |
503.481
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| Canonical SMILES |
Cn1cnc(c1)-c1cnc(OC2CCN(CC2)C(=O)Cc2ccc(OC(F)(F)F)cc2)c(c1)C(N)=O
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| InChI |
InChI=1S/C24H24F3N5O4/c1-31-13-20(30-14-31)16-11-19(22(28)34)23(29-12-16)35-17-6-8-32(9-7-17)21(33)10-15-2-4-18(5-3-15)36-24(25,26)27/h2-5,11-14,17H,6-10H2,1H3,(H2,28,34)
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| InChIKey |
XBJKLAZNUXEFFR-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