General Information of the Compound
| Compound ID |
CP0538966
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| Compound Name |
US8993565, 19
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| Structure |
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| Formula |
C20H26N4O3
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| Molecular Weight |
370.453
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| Canonical SMILES |
CC(C)(C)c1cccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)c1
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| InChI |
InChI=1S/C20H26N4O3/c1-20(2,3)14-5-4-6-15(11-14)21-18(25)12-16-22-17(13-19(26)23-16)24-7-9-27-10-8-24/h4-6,11,13H,7-10,12H2,1-3H3,(H,21,25)(H,22,23,26)
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| InChIKey |
DNIDQMGFVSJKSV-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