General Information of the Compound
| Compound ID |
CP0532285
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| Compound Name |
benzimidazolone scaffold, 8f
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| Structure |
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| Formula |
C27H30N4O
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| Molecular Weight |
426.564
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| Canonical SMILES |
Cc1ccccc1N1CCN(CCn2c3ccccc3n(-c3ccccc3C)c2=O)CC1
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| InChI |
InChI=1S/C27H30N4O/c1-21-9-3-5-11-23(21)29-18-15-28(16-19-29)17-20-30-25-13-7-8-14-26(25)31(27(30)32)24-12-6-4-10-22(24)2/h3-14H,15-20H2,1-2H3
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| InChIKey |
YKWLQTJNNWZMOA-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