General Information of the Compound
| Compound ID |
CP0421938
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| Compound Name |
N-(2-imidazol-1-yl-2-phenylethyl)-5-nitro-1-benzofuran-2-carboxamide
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| Structure |
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| Formula |
C20H16N4O4
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| Molecular Weight |
376.372
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| Canonical SMILES |
[O-][N+](=O)c1ccc2oc(cc2c1)C(=O)NCC(c1ccccc1)n1ccnc1
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| InChI |
InChI=1S/C20H16N4O4/c25-20(19-11-15-10-16(24(26)27)6-7-18(15)28-19)22-12-17(23-9-8-21-13-23)14-4-2-1-3-5-14/h1-11,13,17H,12H2,(H,22,25)
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| InChIKey |
POHISOOOOXJVGV-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