General Information of the Compound
| Compound ID |
CP0498799
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| Compound Name |
ethyl 7-[3-[[4-methyl-3-(trifluoromethyl)benzoyl]amino]phenyl]pyrazolo[1,5-a]pyrimidine-3-carboxylate
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| Structure |
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| Formula |
C24H19F3N4O3
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| Molecular Weight |
468.435
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| Canonical SMILES |
CCOC(=O)c1cnn2c(ccnc12)-c1cccc(NC(=O)c2ccc(C)c(c2)C(F)(F)F)c1
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| InChI |
InChI=1S/C24H19F3N4O3/c1-3-34-23(33)18-13-29-31-20(9-10-28-21(18)31)15-5-4-6-17(11-15)30-22(32)16-8-7-14(2)19(12-16)24(25,26)27/h4-13H,3H2,1-2H3,(H,30,32)
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| InChIKey |
LNEZCTJJIDDWKC-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