General Information of the Compound
| Compound ID |
CP0416392
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| Compound Name |
N-[1-(5-chloro-2-methoxypyridin-4-yl)azetidin-3-yl]-3-methyl-2-(trifluoromethyl)benzimidazole-5-carboxamide
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| Structure |
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| Formula |
C19H17ClF3N5O2
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| Molecular Weight |
439.825
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| Canonical SMILES |
COc1cc(N2CC(C2)NC(=O)c2ccc3nc(n(C)c3c2)C(F)(F)F)c(Cl)cn1
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| InChI |
InChI=1S/C19H17ClF3N5O2/c1-27-15-5-10(3-4-13(15)26-18(27)19(21,22)23)17(29)25-11-8-28(9-11)14-6-16(30-2)24-7-12(14)20/h3-7,11H,8-9H2,1-2H3,(H,25,29)
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| InChIKey |
IIOVZGPJOGMNRG-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