General Information of the Compound
| Compound ID |
CP0304526
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| Compound Name |
3-(thiophen-2-ylmethylamino)pyridine-4-carboxylic acid
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| Structure |
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| Formula |
C11H10N2O2S
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| Molecular Weight |
234.28
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| Canonical SMILES |
OC(=O)c1ccncc1NCc1cccs1
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| InChI |
InChI=1S/C11H10N2O2S/c14-11(15)9-3-4-12-7-10(9)13-6-8-2-1-5-16-8/h1-5,7,13H,6H2,(H,14,15)
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| InChIKey |
OWXQOOHJEULHGO-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