General Information of the Compound
| Compound ID |
CP0559029
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| Compound Name |
N-(4-bromophenyl)-1-(imidazol-1-ylmethyl)pyrazole-3-carboxamide
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| Formula |
C14H12BrN5O
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| Molecular Weight |
346.188
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| Canonical SMILES |
Brc1ccc(NC(=O)c2ccn(Cn3ccnc3)n2)cc1
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| InChI |
InChI=1S/C14H12BrN5O/c15-11-1-3-12(4-2-11)17-14(21)13-5-7-20(18-13)10-19-8-6-16-9-19/h1-9H,10H2,(H,17,21)
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| InChIKey |
BOHCTTWEUFWTLU-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