General Information of the Compound
| Compound ID |
CP0556460
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| Compound Name |
US8993565, 27
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| Structure |
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| Formula |
C15H16FN5O3
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| Molecular Weight |
333.323
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| Canonical SMILES |
Fc1ccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)nc1
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| InChI |
InChI=1S/C15H16FN5O3/c16-10-1-2-11(17-9-10)19-14(22)7-12-18-13(8-15(23)20-12)21-3-5-24-6-4-21/h1-2,8-9H,3-7H2,(H,17,19,22)(H,18,20,23)
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| InChIKey |
NXIPJVYIWQZDTK-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