General Information of the Compound
| Compound ID |
CP0772448
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| Compound Name |
N-(4-chlorophenyl)-3-(3,5-dimethyl-1-(4-methyl-6-oxo-1,6-dihydropyrimidin-2-yl)-1H-pyrazol-4-yl)propanamide
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| Structure |
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| Formula |
C19H20ClN5O2
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| Molecular Weight |
385.855
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| Canonical SMILES |
Cc1cc(=O)[nH]c(-n2nc(C)c(CCC(=O)Nc3ccc(Cl)cc3)c2C)n1
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| InChI |
InChI=1S/C19H20ClN5O2/c1-11-10-18(27)23-19(21-11)25-13(3)16(12(2)24-25)8-9-17(26)22-15-6-4-14(20)5-7-15/h4-7,10H,8-9H2,1-3H3,(H,22,26)(H,21,23,27)
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| InChIKey |
ZAIYBBDZRVKZFT-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