General Information of the Compound
| Compound ID |
CP0470695
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| Compound Name |
2-[6-[[3-(1,3,5-trimethylpyrazol-4-yl)phenyl]methoxy]-2,3-dihydro-1-benzofuran-3-yl]acetic acid
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| Structure |
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| Formula |
C23H24N2O4
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| Molecular Weight |
392.455
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| Canonical SMILES |
Cc1nn(C)c(C)c1-c1cccc(COc2ccc3C(CC(O)=O)COc3c2)c1
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| InChI |
InChI=1S/C23H24N2O4/c1-14-23(15(2)25(3)24-14)17-6-4-5-16(9-17)12-28-19-7-8-20-18(10-22(26)27)13-29-21(20)11-19/h4-9,11,18H,10,12-13H2,1-3H3,(H,26,27)
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| InChIKey |
ZZOQNTHSFVRBSR-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