General Information of the Compound
| Compound ID |
CP0551565
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| Compound Name |
3-[2-(4-fluoro-2-methylphenyl)-1-methylindol-5-yl]propanoic acid
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| Formula |
C19H18FNO2
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| Molecular Weight |
311.356
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| Canonical SMILES |
Cc1cc(F)ccc1-c1cc2cc(CCC(O)=O)ccc2n1C
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| InChI |
InChI=1S/C19H18FNO2/c1-12-9-15(20)5-6-16(12)18-11-14-10-13(4-8-19(22)23)3-7-17(14)21(18)2/h3,5-7,9-11H,4,8H2,1-2H3,(H,22,23)
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| InChIKey |
JTTKCHJAWAGQHR-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