General Information of the Compound
| Compound ID |
CP0881890
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| Compound Name |
N-(4-Chloro-3-((1-nicotinoylpiperidin-4-yl)oxy)phenyl)-3-(trifluoromethyl)benzamide
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| Structure |
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| Formula |
C25H21ClF3N3O3
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| Molecular Weight |
503.908
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| Canonical SMILES |
O=C(Nc1ccc(Cl)c(OC2CCN(C(=O)c3cccnc3)CC2)c1)c1cccc(C(F)(F)F)c1
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| InChI |
InChI=1S/C25H21ClF3N3O3/c26-21-7-6-19(31-23(33)16-3-1-5-18(13-16)25(27,28)29)14-22(21)35-20-8-11-32(12-9-20)24(34)17-4-2-10-30-15-17/h1-7,10,13-15,20H,8-9,11-12H2,(H,31,33)
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| InChIKey |
RDNZWWIGQMOLGY-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