General Information of the Compound
| Compound ID |
CP0479552
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| Compound Name |
1-(beta-D-Glucopyranosyl)-4-methyl-3-(5-(4-fluorophenyl)-2-thiazolylmethyl)-benzene
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| Structure |
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| Formula |
C23H24FNO6S
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| Molecular Weight |
461.511
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| Canonical SMILES |
Cc1cccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1Cc1ncc(s1)-c1ccc(F)cc1
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| InChI |
InChI=1S/C23H24FNO6S/c1-12-3-2-4-16(30-23-22(29)21(28)20(27)17(11-26)31-23)15(12)9-19-25-10-18(32-19)13-5-7-14(24)8-6-13/h2-8,10,17,20-23,26-29H,9,11H2,1H3/t17-,20-,21+,22-,23-/m1/s1
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| InChIKey |
UADPSIDGAKAZOB-LDBVRRDLSA-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