General Information of the Compound
| Compound ID |
CP0534689
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| Compound Name |
2-chloro-5,8-dihydroxy-3-piperidin-1-ylnaphthalene-1,4-dione
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| Structure |
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| Formula |
C15H14ClNO4
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| Molecular Weight |
307.733
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| Canonical SMILES |
Oc1ccc(O)c2C(=O)C(N3CCCCC3)=C(Cl)C(=O)c12
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| InChI |
InChI=1S/C15H14ClNO4/c16-12-13(17-6-2-1-3-7-17)15(21)11-9(19)5-4-8(18)10(11)14(12)20/h4-5,18-19H,1-3,6-7H2
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| InChIKey |
LNUNFWDRGGXTGH-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