General Information of the Compound
| Compound ID |
CP0416838
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| Compound Name |
N-cyclohexyl-2-[(3,5-dichloropyridin-4-yl)amino]-7-methyl-3H-furo[3,2-e]benzimidazole-5-carboxamide
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| Structure |
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| Formula |
C22H21Cl2N5O2
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| Molecular Weight |
458.349
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| Canonical SMILES |
Cc1cc2c(o1)c(cc1nc(Nc3c(Cl)cncc3Cl)[nH]c21)C(=O)NC1CCCCC1
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| InChI |
InChI=1S/C22H21Cl2N5O2/c1-11-7-13-18-17(27-22(28-18)29-19-15(23)9-25-10-16(19)24)8-14(20(13)31-11)21(30)26-12-5-3-2-4-6-12/h7-10,12H,2-6H2,1H3,(H,26,30)(H2,25,27,28,29)
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| InChIKey |
FTBDXILHVULBCJ-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