General Information of the Compound
| Compound ID |
CP0459129
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| Compound Name |
2-chloro-5,8-dimethoxy-3-morpholin-4-ylnaphthalene-1,4-dione
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| Structure |
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| Formula |
C16H16ClNO5
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| Molecular Weight |
337.759
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| Canonical SMILES |
COc1ccc(OC)c2C(=O)C(N3CCOCC3)=C(Cl)C(=O)c12
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| InChI |
InChI=1S/C16H16ClNO5/c1-21-9-3-4-10(22-2)12-11(9)15(19)13(17)14(16(12)20)18-5-7-23-8-6-18/h3-4H,5-8H2,1-2H3
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| InChIKey |
YZWHPRXLCBWEEP-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