General Information of the Compound
| Compound ID |
CP0443678
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| Compound Name |
US8993565, 138
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| Structure |
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| Formula |
C19H23FN4O5
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| Molecular Weight |
406.414
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| Canonical SMILES |
COCCOc1cc(F)ccc1NC(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
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| InChI |
InChI=1S/C19H23FN4O5/c1-27-8-9-29-15-10-13(20)2-3-14(15)21-18(25)11-16-22-17(12-19(26)23-16)24-4-6-28-7-5-24/h2-3,10,12H,4-9,11H2,1H3,(H,21,25)(H,22,23,26)
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| InChIKey |
LTYDMDZQFFWEFT-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