General Information of the Compound
| Compound ID |
CP0402988
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| Compound Name |
1-[2-(2,3-dihydroindol-1-ylmethyl)-6,7-dihydro-5H-pyrazolo[1,5-a]pyrimidin-4-yl]ethanone
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| Structure |
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| Formula |
C17H20N4O
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| Molecular Weight |
296.374
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| Canonical SMILES |
CC(=O)N1CCCn2nc(CN3CCc4ccccc34)cc12
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| InChI |
InChI=1S/C17H20N4O/c1-13(22)20-8-4-9-21-17(20)11-15(18-21)12-19-10-7-14-5-2-3-6-16(14)19/h2-3,5-6,11H,4,7-10,12H2,1H3
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| InChIKey |
LVYOQWSULCOSMP-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