General Information of the Compound
| Compound ID |
CP0394921
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| Compound Name |
3-methyl-1-(2-pyrimidin-5-ylethynyl)pyrrolo[1,2-a]pyrazine
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| Structure |
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| Formula |
C14H10N4
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| Molecular Weight |
234.262
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| Canonical SMILES |
Cc1cn2cccc2c(n1)C#Cc1cncnc1
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| InChI |
InChI=1S/C14H10N4/c1-11-9-18-6-2-3-14(18)13(17-11)5-4-12-7-15-10-16-8-12/h2-3,6-10H,1H3
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| InChIKey |
SRURFOIYHUOUAQ-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