General Information of the Compound
| Compound ID |
CP0387424
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| Compound Name |
3-(4-Ethylpiperazin-1-yl)-5,7-dihydroxy-4-methyl-2H-chromen-2-one
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| Structure |
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| Formula |
C16H20N2O4
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| Molecular Weight |
304.346
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| Canonical SMILES |
CCN1CCN(CC1)c1c(C)c2c(O)cc(O)cc2oc1=O
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| InChI |
InChI=1S/C16H20N2O4/c1-3-17-4-6-18(7-5-17)15-10(2)14-12(20)8-11(19)9-13(14)22-16(15)21/h8-9,19-20H,3-7H2,1-2H3
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| InChIKey |
JTARAHFTVCXABJ-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