General Information of the Compound
| Compound ID |
CP0010776
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| Compound Name |
US10307413, Compound 47
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| Structure |
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| Formula |
C26H35N3O3
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| Molecular Weight |
437.584
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| Canonical SMILES |
CCN(C1CCOCC1)c1cccc(c1)C(=O)NCC(O)CN1CCc2ccccc2C1
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| InChI |
InChI=1S/C26H35N3O3/c1-2-29(23-11-14-32-15-12-23)24-9-5-8-21(16-24)26(31)27-17-25(30)19-28-13-10-20-6-3-4-7-22(20)18-28/h3-9,16,23,25,30H,2,10-15,17-19H2,1H3,(H,27,31)
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| InChIKey |
RFZKJYGESZJFLV-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