General Information of the Compound
| Compound ID |
CP0507597
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| Compound Name |
3-(1-ethyl-5-methyl-1H-pyrazol-4-yl)-N-(2-morpholinoethyl)-4,5-dihydroisoxazole-5-carboxamide
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| Structure |
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| Formula |
C16H25N5O3
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| Molecular Weight |
335.408
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| Canonical SMILES |
CCn1ncc(C2=NOC(C2)C(=O)NCCN2CCOCC2)c1C
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| InChI |
InChI=1S/C16H25N5O3/c1-3-21-12(2)13(11-18-21)14-10-15(24-19-14)16(22)17-4-5-20-6-8-23-9-7-20/h11,15H,3-10H2,1-2H3,(H,17,22)
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| InChIKey |
KGVCXMBIHCWOCU-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