General Information of the Compound
| Compound ID |
CP0266261
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| Compound Name |
5-methyl-4-nitro-N-prop-2-ynyl-1,2-oxazole-3-carboxamide
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| Formula |
C8H7N3O4
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| Molecular Weight |
209.161
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| Canonical SMILES |
Cc1onc(C(=O)NCC#C)c1[N+]([O-])=O
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| InChI |
InChI=1S/C8H7N3O4/c1-3-4-9-8(12)6-7(11(13)14)5(2)15-10-6/h1H,4H2,2H3,(H,9,12)
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| InChIKey |
CDKAWFTZOAVFMM-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