General Information of the Compound
| Compound ID |
CP0880710
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| Compound Name |
2-(isoindolin-2-yl)-6-(1-methyl-1H-indol-5-yl)benzo[d]oxazole
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| Structure |
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| Formula |
C24H19N3O
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| Molecular Weight |
365.436
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| Canonical SMILES |
Cn1ccc2cc(-c3ccc4nc(N5Cc6ccccc6C5)oc4c3)ccc21
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| InChI |
InChI=1S/C24H19N3O/c1-26-11-10-18-12-16(7-9-22(18)26)17-6-8-21-23(13-17)28-24(25-21)27-14-19-4-2-3-5-20(19)15-27/h2-13H,14-15H2,1H3
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| InChIKey |
BCVLOOHHYPIHBK-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