General Information of the Compound
| Compound ID |
CP0559324
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| Compound Name |
3,3-dimethylbutan-2-yl 8-methyl-1-oxo-2-prop-2-enyl-3,4-dihydropyrrolo[1,2-a]pyrazine-7-carboxylate
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| Structure |
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| Formula |
C18H26N2O3
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| Molecular Weight |
318.417
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| Canonical SMILES |
CC(OC(=O)c1cn2CCN(CC=C)C(=O)c2c1C)C(C)(C)C
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| InChI |
InChI=1S/C18H26N2O3/c1-7-8-19-9-10-20-11-14(12(2)15(20)16(19)21)17(22)23-13(3)18(4,5)6/h7,11,13H,1,8-10H2,2-6H3
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| InChIKey |
DJWWZIMSVRVAGX-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