General Information of the Compound
| Compound ID |
CP0402990
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| Compound Name |
furan-2-yl-[2-(phenoxymethyl)-6,7-dihydro-5H-pyrazolo[1,5-a]pyrimidin-4-yl]methanone
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| Structure |
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| Formula |
C18H17N3O3
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| Molecular Weight |
323.352
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| Canonical SMILES |
O=C(N1CCCn2nc(COc3ccccc3)cc12)c1ccco1
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| InChI |
InChI=1S/C18H17N3O3/c22-18(16-8-4-11-23-16)20-9-5-10-21-17(20)12-14(19-21)13-24-15-6-2-1-3-7-15/h1-4,6-8,11-12H,5,9-10,13H2
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| InChIKey |
UOXLZWIVCQPQKL-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