General Information of the Compound
| Compound ID |
CP0820598
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| Compound Name |
5-benzyl-N-cyclopentyl-1-(4-methyl-6-oxo-1,6-dihydropyrimidin-2-yl)-1H-pyrazole-4-carboxamide
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| Structure |
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| Formula |
C21H23N5O2
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| Molecular Weight |
377.448
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| Canonical SMILES |
Cc1cc(=O)[nH]c(-n2ncc(C(=O)NC3CCCC3)c2Cc2ccccc2)n1
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| InChI |
InChI=1S/C21H23N5O2/c1-14-11-19(27)25-21(23-14)26-18(12-15-7-3-2-4-8-15)17(13-22-26)20(28)24-16-9-5-6-10-16/h2-4,7-8,11,13,16H,5-6,9-10,12H2,1H3,(H,24,28)(H,23,25,27)
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| InChIKey |
VLFIZFPYDYBGGO-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