General Information of the Compound
| Compound ID |
CP0528872
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| Compound Name |
US8933079, 11.2
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| Structure |
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| Formula |
C24H27N3O4
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| Molecular Weight |
421.497
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| Canonical SMILES |
COc1ccc(COc2ccn(CC(=O)c3ccc(CN(C)C)cc3C)c(=O)c2)nc1
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| InChI |
InChI=1S/C24H27N3O4/c1-17-11-18(14-26(2)3)5-8-22(17)23(28)15-27-10-9-20(12-24(27)29)31-16-19-6-7-21(30-4)13-25-19/h5-13H,14-16H2,1-4H3
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| InChIKey |
RCGWWFBTKWIBAQ-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