General Information of the Compound
| Compound ID |
CP0963777
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| Compound Name |
3-Chloro-N-(3-((1-(isoxazole-5-carbonyl)piperidin-4-yl)oxy)-4-methylphenyl)-5-(trifluoromethyl)benzamide
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| Structure |
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| Formula |
C24H21ClF3N3O4
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| Molecular Weight |
507.896
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| Canonical SMILES |
Cc1ccc(NC(=O)c2cc(Cl)cc(C(F)(F)F)c2)cc1OC1CCN(C(=O)c2ccno2)CC1
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| InChI |
InChI=1S/C24H21ClF3N3O4/c1-14-2-3-18(30-22(32)15-10-16(24(26,27)28)12-17(25)11-15)13-21(14)34-19-5-8-31(9-6-19)23(33)20-4-7-29-35-20/h2-4,7,10-13,19H,5-6,8-9H2,1H3,(H,30,32)
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| InChIKey |
JNSHRUDQFIKOMH-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