General Information of the Compound
| Compound ID |
CP0385037
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| Compound Name |
1-(2,2-dimethylpropyl)-3-methyl-5-phenylbenzimidazol-2-one
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| Structure |
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| Formula |
C19H22N2O
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| Molecular Weight |
294.398
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| Canonical SMILES |
Cn1c2cc(ccc2n(CC(C)(C)C)c1=O)-c1ccccc1
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| InChI |
InChI=1S/C19H22N2O/c1-19(2,3)13-21-16-11-10-15(14-8-6-5-7-9-14)12-17(16)20(4)18(21)22/h5-12H,13H2,1-4H3
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| InChIKey |
OXGRLUORTBVGQN-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