General Information of the Compound
| Compound ID |
CP0518110
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| Compound Name |
3-[2-(2-methoxyphenyl)-1H-indol-5-yl]propanoic acid
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| Structure |
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| Formula |
C18H17NO3
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| Molecular Weight |
295.338
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| Canonical SMILES |
COc1ccccc1-c1cc2cc(CCC(O)=O)ccc2[nH]1
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| InChI |
InChI=1S/C18H17NO3/c1-22-17-5-3-2-4-14(17)16-11-13-10-12(7-9-18(20)21)6-8-15(13)19-16/h2-6,8,10-11,19H,7,9H2,1H3,(H,20,21)
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| InChIKey |
FSRYPWFTMDSNNT-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