General Information of the Compound
| Compound ID |
CP0475626
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| Compound Name |
2-[1-[(5-chloro-2-propan-2-yl-1-benzofuran-7-yl)methyl]-5-methylpyrazol-3-yl]-1H-benzimidazole
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| Structure |
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| Formula |
C23H21ClN4O
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| Molecular Weight |
404.901
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| Canonical SMILES |
CC(C)c1cc2cc(Cl)cc(Cn3nc(cc3C)-c3nc4ccccc4[nH]3)c2o1
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| InChI |
InChI=1S/C23H21ClN4O/c1-13(2)21-11-15-9-17(24)10-16(22(15)29-21)12-28-14(3)8-20(27-28)23-25-18-6-4-5-7-19(18)26-23/h4-11,13H,12H2,1-3H3,(H,25,26)
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| InChIKey |
BBFRJBLIFQOIMY-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