General Information of the Compound
| Compound ID |
CP0779089
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| Compound Name |
1-Benzyl-5-(3-nitro-phenyl)-1,3-dihydro-benzoimidazol-2-one
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| Structure |
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| Formula |
C20H15N3O3
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| Molecular Weight |
345.358
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| Canonical SMILES |
O=[N+]([O-])c1cccc(-c2ccc3c(c2)nc(O)n3Cc2ccccc2)c1
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| InChI |
InChI=1S/C20H15N3O3/c24-20-21-18-12-16(15-7-4-8-17(11-15)23(25)26)9-10-19(18)22(20)13-14-5-2-1-3-6-14/h1-12H,13H2,(H,21,24)
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| InChIKey |
IFPXBLQVJULITA-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