General Information of the Compound
| Compound ID |
CP0430738
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| Compound Name |
3-(4-(4-Fluorophenyl)piperazin-1-yl)-5,7-dihydroxy-4-methyl-2H-chromen-2-one
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| Structure |
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| Formula |
C20H19FN2O4
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| Molecular Weight |
370.38
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| Canonical SMILES |
Cc1c(N2CCN(CC2)c2ccc(F)cc2)c(=O)oc2cc(O)cc(O)c12
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| InChI |
InChI=1S/C20H19FN2O4/c1-12-18-16(25)10-15(24)11-17(18)27-20(26)19(12)23-8-6-22(7-9-23)14-4-2-13(21)3-5-14/h2-5,10-11,24-25H,6-9H2,1H3
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| InChIKey |
OCJXIELEBZVHMT-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