General Information of the Compound
| Compound ID |
CP0212774
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| Compound Name |
3-(1,3-thiazol-4-ylmethylamino)pyridine-4-carboxylic acid
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| Structure |
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| Formula |
C10H9N3O2S
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| Molecular Weight |
235.268
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| Canonical SMILES |
OC(=O)c1ccncc1NCc1cscn1
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| InChI |
InChI=1S/C10H9N3O2S/c14-10(15)8-1-2-11-4-9(8)12-3-7-5-16-6-13-7/h1-2,4-6,12H,3H2,(H,14,15)
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| InChIKey |
PQUWXOGWGNTLLP-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