General Information of the Compound
| Compound ID |
CP0564593
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| Compound Name |
8-[6-[3-(5-methylpyrazol-1-yl)propoxy]pyrimidin-4-yl]-2,5-dioxa-8-azaspiro[3.5]nonane
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| Structure |
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| Formula |
C17H23N5O3
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| Molecular Weight |
345.403
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| Canonical SMILES |
Cc1ccnn1CCCOc1cc(ncn1)N1CCOC2(COC2)C1
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| InChI |
InChI=1S/C17H23N5O3/c1-14-3-4-20-22(14)5-2-7-24-16-9-15(18-13-19-16)21-6-8-25-17(10-21)11-23-12-17/h3-4,9,13H,2,5-8,10-12H2,1H3
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| InChIKey |
ALYBZGIJTIELKM-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