General Information of the Compound
| Compound ID |
CP0573913
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| Compound Name |
1-[[4-(propylamino)pyrazol-1-yl]methyl]-N-[4-(trifluoromethyl)phenyl]pyrazole-3-carboxamide
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| Formula |
C18H19F3N6O
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| Molecular Weight |
392.385
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| Canonical SMILES |
CCCNc1cnn(Cn2ccc(n2)C(=O)Nc2ccc(cc2)C(F)(F)F)c1
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| InChI |
InChI=1S/C18H19F3N6O/c1-2-8-22-15-10-23-27(11-15)12-26-9-7-16(25-26)17(28)24-14-5-3-13(4-6-14)18(19,20)21/h3-7,9-11,22H,2,8,12H2,1H3,(H,24,28)
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| InChIKey |
HHXKFEOBTAANKG-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