General Information of the Compound
| Compound ID |
CP0945629
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| Compound Name |
US8993565, 120
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| Structure |
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| Formula |
C20H24N4O4
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| Molecular Weight |
384.436
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| Canonical SMILES |
COCC1Cc2ccccc2N1C(=O)Cc1nc(N2CCOCC2)cc(=O)[nH]1
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| InChI |
InChI=1S/C20H24N4O4/c1-27-13-15-10-14-4-2-3-5-16(14)24(15)20(26)11-17-21-18(12-19(25)22-17)23-6-8-28-9-7-23/h2-5,12,15H,6-11,13H2,1H3,(H,21,22,25)
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| InChIKey |
BLWXPEAUTRMTKD-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