General Information of the Compound
| Compound ID |
CP0480509
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| Compound Name |
2-[[2-[2-(5-cyano-3-hydroxypyridin-2-yl)-1,3-thiazol-4-yl]acetyl]amino]acetic acid
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| Structure |
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| Formula |
C13H10N4O4S
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| Molecular Weight |
318.314
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| Canonical SMILES |
OC(=O)CNC(=O)Cc1csc(n1)-c1ncc(cc1O)C#N
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| InChI |
InChI=1S/C13H10N4O4S/c14-3-7-1-9(18)12(16-4-7)13-17-8(6-22-13)2-10(19)15-5-11(20)21/h1,4,6,18H,2,5H2,(H,15,19)(H,20,21)
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| InChIKey |
DLXXPMPEDWANKC-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