General Information of the Compound
| Compound ID |
CP0963496
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| Compound Name |
2-(isoindolin-2-yl)-5-(1-methyl-1H-indazol-4-yl)benzo[d]oxazole
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| Structure |
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| Formula |
C23H18N4O
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| Molecular Weight |
366.424
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| Canonical SMILES |
Cn1ncc2c(-c3ccc4oc(N5Cc6ccccc6C5)nc4c3)cccc21
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| InChI |
InChI=1S/C23H18N4O/c1-26-21-8-4-7-18(19(21)12-24-26)15-9-10-22-20(11-15)25-23(28-22)27-13-16-5-2-3-6-17(16)14-27/h2-12H,13-14H2,1H3
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| InChIKey |
ISIVDHLDBCHKDM-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