General Information of the Compound
| Compound ID |
CP0537865
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| Compound Name |
(1-butyl-7-fluoroindol-3-yl)-(6-fluoro-1-methylbenzimidazol-2-yl)methanone
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| Formula |
C21H19F2N3O
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| Molecular Weight |
367.399
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| Canonical SMILES |
CCCCn1cc(C(=O)c2nc3ccc(F)cc3n2C)c2cccc(F)c12
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| InChI |
InChI=1S/C21H19F2N3O/c1-3-4-10-26-12-15(14-6-5-7-16(23)19(14)26)20(27)21-24-17-9-8-13(22)11-18(17)25(21)2/h5-9,11-12H,3-4,10H2,1-2H3
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| InChIKey |
BCXKEPWQDBIUCL-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