General Information of the Compound
| Compound ID |
CP0967635
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| Compound Name |
(E)-5-fluoro-2-(3-methyl-2-(prop-1-enyl)benzamido)-2,3-dihydro-1H-indene-2-carboxylic acid
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| Structure |
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| Formula |
C21H22FNO3
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| Molecular Weight |
355.409
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| Canonical SMILES |
CCCc1c(C)cccc1C(=O)NC1(C(=O)O)Cc2ccc(F)cc2C1
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| InChI |
InChI=1S/C21H22FNO3/c1-3-5-17-13(2)6-4-7-18(17)19(24)23-21(20(25)26)11-14-8-9-16(22)10-15(14)12-21/h4,6-10H,3,5,11-12H2,1-2H3,(H,23,24)(H,25,26)
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| InChIKey |
JGXLGRFTGRPCTJ-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