General Information of the Compound
| Compound ID |
CP0394916
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| Compound Name |
3,7-dimethyl-1-(2-pyridin-3-ylethynyl)pyrrolo[1,2-a]pyrazine
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| Structure |
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| Formula |
C16H13N3
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| Molecular Weight |
247.301
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| Canonical SMILES |
Cc1cc2c(nc(C)cn2c1)C#Cc1cccnc1
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| InChI |
InChI=1S/C16H13N3/c1-12-8-16-15(18-13(2)11-19(16)10-12)6-5-14-4-3-7-17-9-14/h3-4,7-11H,1-2H3
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| InChIKey |
RBUNLEWRPDSPMK-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