General Information of the Compound
| Compound ID |
CP0477875
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| Compound Name |
5-(7-fluoro-1,3,3-trimethyl-2-oxoindol-5-yl)-1-methylpyrrole-2-carbonitrile
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| Structure |
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| Formula |
C17H16FN3O
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| Molecular Weight |
297.333
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| Canonical SMILES |
CN1C(=O)C(C)(C)c2cc(cc(F)c12)-c1ccc(C#N)n1C
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| InChI |
InChI=1S/C17H16FN3O/c1-17(2)12-7-10(14-6-5-11(9-19)20(14)3)8-13(18)15(12)21(4)16(17)22/h5-8H,1-4H3
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| InChIKey |
PIGYOAAVIHCBRV-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