General Information of the Compound
| Compound ID |
CP0904565
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| Compound Name |
(E)-N'-(1-(4-bromophenyl)-2-(2-methyl-5-nitro-1H-imidazol-1-yl)ethylidene)-4-methylbenzohydrazide
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| Structure |
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| Formula |
C20H18BrN5O3
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| Molecular Weight |
456.3
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| Canonical SMILES |
Cc1ccc(C(=O)N/N=C(/Cn2c([N+](=O)[O-])cnc2C)c2ccc(Br)cc2)cc1
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| InChI |
InChI=1S/C20H18BrN5O3/c1-13-3-5-16(6-4-13)20(27)24-23-18(15-7-9-17(21)10-8-15)12-25-14(2)22-11-19(25)26(28)29/h3-11H,12H2,1-2H3,(H,24,27)/b23-18-
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| InChIKey |
CNRVBTVLAUEOKD-NKFKGCMQSA-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