General Information of the Compound
| Compound ID |
CP0487848
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| Compound Name |
1-[(4-acetamidopyrazol-1-yl)methyl]-N-[4-(trifluoromethyl)phenyl]pyrazole-3-carboxamide
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| Formula |
C17H15F3N6O2
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| Molecular Weight |
392.341
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| Canonical SMILES |
CC(=O)Nc1cnn(Cn2ccc(n2)C(=O)Nc2ccc(cc2)C(F)(F)F)c1
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| InChI |
InChI=1S/C17H15F3N6O2/c1-11(27)22-14-8-21-26(9-14)10-25-7-6-15(24-25)16(28)23-13-4-2-12(3-5-13)17(18,19)20/h2-9H,10H2,1H3,(H,22,27)(H,23,28)
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| InChIKey |
YYTPURZIQUWYQR-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