General Information of the Compound
| Compound ID |
CP0477863
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| Compound Name |
1-[2-(4-bromophenyl)ethynyl]-3-methylpyrrolo[1,2-a]pyrazine
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| Structure |
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| Formula |
C16H11BrN2
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| Molecular Weight |
311.182
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| Canonical SMILES |
Cc1cn2cccc2c(n1)C#Cc1ccc(Br)cc1
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| InChI |
InChI=1S/C16H11BrN2/c1-12-11-19-10-2-3-16(19)15(18-12)9-6-13-4-7-14(17)8-5-13/h2-5,7-8,10-11H,1H3
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| InChIKey |
ORMIXFREJLULCD-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