General Information of the Compound
| Compound ID |
CP0466168
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| Compound Name |
5-(1,4-dimethyl-1,2,3,4-tetrahydroquinoxalin-6-yl)-1,3,4-oxadiazol-2-ol
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| Structure |
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| Formula |
C12H14N4O2
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| Molecular Weight |
246.27
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| Canonical SMILES |
CN1CCN(C)c2cc(ccc12)-c1nnc(O)o1
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| InChI |
InChI=1S/C12H14N4O2/c1-15-5-6-16(2)10-7-8(3-4-9(10)15)11-13-14-12(17)18-11/h3-4,7H,5-6H2,1-2H3,(H,14,17)
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| InChIKey |
AKGIMWQJPJQMLA-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