General Information of the Compound
| Compound ID |
CP0522475
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| Compound Name |
5-tert-Butyl-2-[4-(3-chloro-pyridin-2-yl)-piperazin-1-yl]-benzooxazole
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| Structure |
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| Formula |
C20H23ClN4O
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| Molecular Weight |
370.884
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| Canonical SMILES |
CC(C)(C)c1ccc2oc(nc2c1)N1CCN(CC1)c1ncccc1Cl
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| InChI |
InChI=1S/C20H23ClN4O/c1-20(2,3)14-6-7-17-16(13-14)23-19(26-17)25-11-9-24(10-12-25)18-15(21)5-4-8-22-18/h4-8,13H,9-12H2,1-3H3
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| InChIKey |
QJIIZBBJVNIJTP-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