General Information of the Compound
| Compound ID |
CP0566966
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| Compound Name |
(2,6-dimethylpiperidin-1-yl)-[6-[[4-(2,4-dimethyl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]amino]pyridin-3-yl]methanone
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| Structure |
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| Formula |
C21H25N5OS2
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| Molecular Weight |
427.599
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| Canonical SMILES |
CC1CCCC(C)N1C(=O)c1ccc(Nc2nc(cs2)-c2sc(C)nc2C)nc1
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| InChI |
InChI=1S/C21H25N5OS2/c1-12-6-5-7-13(2)26(12)20(27)16-8-9-18(22-10-16)25-21-24-17(11-28-21)19-14(3)23-15(4)29-19/h8-13H,5-7H2,1-4H3,(H,22,24,25)
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| InChIKey |
UZFGAPNWQXVTKH-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