General Information of the Compound
| Compound ID |
CP0525949
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| Compound Name |
benzimidazolone scaffold, 15b
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| Structure |
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| Formula |
C20H24N4O2
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| Molecular Weight |
352.438
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| Canonical SMILES |
COc1ccccc1N1CCN(CCn2c3ccccc3[nH]c2=O)CC1
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| InChI |
InChI=1S/C20H24N4O2/c1-26-19-9-5-4-8-18(19)23-13-10-22(11-14-23)12-15-24-17-7-3-2-6-16(17)21-20(24)25/h2-9H,10-15H2,1H3,(H,21,25)
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| InChIKey |
LNDCOGLNEQSIJF-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