General Information of the Compound
| Compound ID |
CP0404682
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| Compound Name |
2-[6-[(4-methyl-2-thiophen-3-yl-1,3-thiazol-5-yl)methoxy]-2,3-dihydro-1-benzofuran-3-yl]acetic acid
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| Structure |
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| Formula |
C19H17NO4S2
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| Molecular Weight |
387.482
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| Canonical SMILES |
Cc1nc(sc1COc1ccc2C(CC(O)=O)COc2c1)-c1ccsc1
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| InChI |
InChI=1S/C19H17NO4S2/c1-11-17(26-19(20-11)12-4-5-25-10-12)9-23-14-2-3-15-13(6-18(21)22)8-24-16(15)7-14/h2-5,7,10,13H,6,8-9H2,1H3,(H,21,22)
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| InChIKey |
MYTUSWJUIZROPQ-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