General Information of the Compound
| Compound ID |
CP0541825
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| Compound Name |
[3-(5-chloro-3-methylpyridin-2-yl)-3-fluoropiperidin-1-yl]-[2-(methylamino)pyridin-4-yl]methanone
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| Structure |
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| Formula |
C18H20ClFN4O
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| Molecular Weight |
362.836
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| Canonical SMILES |
CNc1cc(ccn1)C(=O)N1CCCC(F)(C1)c1ncc(Cl)cc1C
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| InChI |
InChI=1S/C18H20ClFN4O/c1-12-8-14(19)10-23-16(12)18(20)5-3-7-24(11-18)17(25)13-4-6-22-15(9-13)21-2/h4,6,8-10H,3,5,7,11H2,1-2H3,(H,21,22)
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| InChIKey |
KJJXBCYIKIOANE-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