General Information of the Compound
| Compound ID |
CP0903728
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| Compound Name |
7-hydroxy-3-(4-methylthiazol-2-yl)-6-pentyl-4H-chromen-4-one
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| Structure |
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| Formula |
C18H19NO3S
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| Molecular Weight |
329.421
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| Canonical SMILES |
CCCCCc1cc2c(=O)c(-c3nc(C)cs3)coc2cc1O
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| InChI |
InChI=1S/C18H19NO3S/c1-3-4-5-6-12-7-13-16(8-15(12)20)22-9-14(17(13)21)18-19-11(2)10-23-18/h7-10,20H,3-6H2,1-2H3
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| InChIKey |
CWZXOOMHRFLNOE-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