General Information of the Compound
| Compound ID |
CP0541970
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| Compound Name |
benzimidazolone scaffold, 15h
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| Structure |
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| Formula |
C23H30N4O2
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| Molecular Weight |
394.519
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| Canonical SMILES |
COc1ccccc1N1CCN(CCCCCn2c3ccccc3[nH]c2=O)CC1
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| InChI |
InChI=1S/C23H30N4O2/c1-29-22-12-6-5-11-21(22)26-17-15-25(16-18-26)13-7-2-8-14-27-20-10-4-3-9-19(20)24-23(27)28/h3-6,9-12H,2,7-8,13-18H2,1H3,(H,24,28)
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| InChIKey |
DKMJRBCGZYNKDG-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