General Information of the Compound
| Compound ID |
CP0571531
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| Compound Name |
3-amino-4-[3-(hydroxymethyl)piperidin-1-yl]thieno[2,3-b]pyridine-2-carboxamide
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| Structure |
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| Formula |
C14H18N4O2S
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| Molecular Weight |
306.391
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| Canonical SMILES |
NC(=O)c1sc2nccc(N3CCCC(CO)C3)c2c1N
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| InChI |
InChI=1S/C14H18N4O2S/c15-11-10-9(18-5-1-2-8(6-18)7-19)3-4-17-14(10)21-12(11)13(16)20/h3-4,8,19H,1-2,5-7,15H2,(H2,16,20)
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| InChIKey |
IVOTYNUCUYJBAJ-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