General Information of the Compound
| Compound ID |
CP0534231
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| Compound Name |
6-(1,3-benzothiazol-6-ylamino)-N-methyl-4-(propan-2-ylamino)pyridine-3-carboxamide
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| Structure |
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| Formula |
C17H19N5OS
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| Molecular Weight |
341.44
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| Canonical SMILES |
CNC(=O)c1cnc(Nc2ccc3ncsc3c2)cc1NC(C)C
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| InChI |
InChI=1S/C17H19N5OS/c1-10(2)21-14-7-16(19-8-12(14)17(23)18-3)22-11-4-5-13-15(6-11)24-9-20-13/h4-10H,1-3H3,(H,18,23)(H2,19,21,22)
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| InChIKey |
LLEBMWLDBMFHNV-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