General Information of the Compound
| Compound ID |
CP0317939
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| Compound Name |
2-[(3Z)-3-benzylidene-6-fluoro-2-methylinden-1-yl]acetic acid
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| Structure |
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| Formula |
C19H15FO2
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| Molecular Weight |
294.325
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| Canonical SMILES |
CC1=C(CC(O)=O)c2cc(F)ccc2\C1=C/c1ccccc1
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| InChI |
InChI=1S/C19H15FO2/c1-12-16(9-13-5-3-2-4-6-13)15-8-7-14(20)10-18(15)17(12)11-19(21)22/h2-10H,11H2,1H3,(H,21,22)/b16-9-
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| InChIKey |
MVHHIVKPIOEVNA-SXGWCWSVSA-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