General Information of the Compound
| Compound ID |
CP0563839
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| Compound Name |
US8993565, 119
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| Structure |
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| Formula |
C20H24N4O3
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| Molecular Weight |
368.437
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| Canonical SMILES |
CC1CN(C(=O)Cc2nc(cc(=O)n2C)N2CCOCC2)c2ccccc12
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| InChI |
InChI=1S/C20H24N4O3/c1-14-13-24(16-6-4-3-5-15(14)16)20(26)11-17-21-18(12-19(25)22(17)2)23-7-9-27-10-8-23/h3-6,12,14H,7-11,13H2,1-2H3
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| InChIKey |
XKVQSHFPNNDYOI-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