General Information of the Compound
| Compound ID |
CP0429583
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| Compound Name |
ethyl 7-[3-[[4-(trifluoromethyl)benzoyl]amino]phenyl]pyrazolo[1,5-a]pyrimidine-3-carboxylate
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| Structure |
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| Formula |
C23H17F3N4O3
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| Molecular Weight |
454.408
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| Canonical SMILES |
CCOC(=O)c1cnn2c(ccnc12)-c1cccc(NC(=O)c2ccc(cc2)C(F)(F)F)c1
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| InChI |
InChI=1S/C23H17F3N4O3/c1-2-33-22(32)18-13-28-30-19(10-11-27-20(18)30)15-4-3-5-17(12-15)29-21(31)14-6-8-16(9-7-14)23(24,25)26/h3-13H,2H2,1H3,(H,29,31)
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| InChIKey |
JIVQWFZRSLHDMU-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