General Information of the Compound
| Compound ID |
CP0480278
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| Compound Name |
7-(4-butylphenyl)-6-fluoro-10,10-dimethyl-5,10-dihydroindeno[1,2-b]indole-2-carboxylic acid
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| Structure |
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| Formula |
C28H26FNO2
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| Molecular Weight |
427.519
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| Canonical SMILES |
CCCCc1ccc(cc1)-c1ccc2c3c([nH]c2c1F)-c1ccc(cc1C3(C)C)C(O)=O
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| InChI |
InChI=1S/C28H26FNO2/c1-4-5-6-16-7-9-17(10-8-16)19-13-14-21-23-25(30-26(21)24(19)29)20-12-11-18(27(31)32)15-22(20)28(23,2)3/h7-15,30H,4-6H2,1-3H3,(H,31,32)
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| InChIKey |
BKGSAVDMZHRMEN-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