General Information of the Compound
| Compound ID |
CP0823170
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| Compound Name |
2-(2-(5-bromo-2-(4-chlorobenzyloxy)benzylidene)hydrazinyl)-4,5-dihydro-1H-imidazole
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| Structure |
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| Formula |
C17H16BrClN4O
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| Molecular Weight |
407.699
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| Canonical SMILES |
Clc1ccc(COc2ccc(Br)cc2/C=N/NC2=NCCN2)cc1
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| InChI |
InChI=1S/C17H16BrClN4O/c18-14-3-6-16(24-11-12-1-4-15(19)5-2-12)13(9-14)10-22-23-17-20-7-8-21-17/h1-6,9-10H,7-8,11H2,(H2,20,21,23)/b22-10+
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| InChIKey |
XLMJWDVPQVWOKY-LSHDLFTRSA-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