General Information of the Compound
| Compound ID |
CP0474391
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| Compound Name |
benzimidazolone scaffold, 8e
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| Structure |
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| Formula |
C26H28N4O
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| Molecular Weight |
412.537
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| Canonical SMILES |
Cc1ccccc1N1CCN(CCn2c3ccccc3n(-c3ccccc3)c2=O)CC1
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| InChI |
InChI=1S/C26H28N4O/c1-21-9-5-6-12-23(21)28-18-15-27(16-19-28)17-20-29-24-13-7-8-14-25(24)30(26(29)31)22-10-3-2-4-11-22/h2-14H,15-20H2,1H3
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| InChIKey |
SNISZSUHCOKDDB-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