General Information of the Compound
| Compound ID |
CP0904564
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| Compound Name |
(E)-N'-(1-(4-bromophenyl)-2-(2-methyl-5-nitro-1H-imidazol-1-yl)ethylidene)isonicotinohydrazide
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| Structure |
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| Formula |
C18H15BrN6O3
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| Molecular Weight |
443.261
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| Canonical SMILES |
Cc1ncc([N+](=O)[O-])n1C/C(=N/NC(=O)c1ccncc1)c1ccc(Br)cc1
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| InChI |
InChI=1S/C18H15BrN6O3/c1-12-21-10-17(25(27)28)24(12)11-16(13-2-4-15(19)5-3-13)22-23-18(26)14-6-8-20-9-7-14/h2-10H,11H2,1H3,(H,23,26)/b22-16-
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| InChIKey |
KHNKXWKPVCUSKW-JWGURIENSA-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