General Information of the Compound
| Compound ID |
CP0919134
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| Compound Name |
2-(5-Hydroxy-1-pyridin-3-yl-pentyl)-3,5,6-trimethyl-[1,4]benzoquinone
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| Structure |
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| Formula |
C19H23NO3
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| Molecular Weight |
313.397
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| Canonical SMILES |
CC1=C(C)C(=O)C(C(CCCCO)c2cccnc2)=C(C)C1=O
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| InChI |
InChI=1S/C19H23NO3/c1-12-13(2)19(23)17(14(3)18(12)22)16(8-4-5-10-21)15-7-6-9-20-11-15/h6-7,9,11,16,21H,4-5,8,10H2,1-3H3
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| InChIKey |
JHIMZIRSNXIKSN-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