General Information of the Compound
| Compound ID |
CP0380238
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| Compound Name |
5-(1-tert-butyl-4,5,6,7-tetrahydrobenzotriazol-5-yl)-3-(2-methylpropyl)-1,2,4-oxadiazole
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| Structure |
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| Formula |
C16H25N5O
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| Molecular Weight |
303.41
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| Canonical SMILES |
CC(C)Cc1noc(n1)C1CCc2c(C1)nnn2C(C)(C)C
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| InChI |
InChI=1S/C16H25N5O/c1-10(2)8-14-17-15(22-19-14)11-6-7-13-12(9-11)18-20-21(13)16(3,4)5/h10-11H,6-9H2,1-5H3
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| InChIKey |
QRGMPDLSQNWAOC-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