General Information of the Compound
| Compound ID |
CP0221987
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| Compound Name |
6-(1H-pyrazol-4-yl)-N-[[3-(trifluoromethoxy)phenyl]methyl]-1H-indole-3-carboxamide
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| Structure |
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| Formula |
C20H15F3N4O2
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| Molecular Weight |
400.36
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| Canonical SMILES |
FC(F)(F)Oc1cccc(CNC(=O)c2c[nH]c3cc(ccc23)-c2cn[nH]c2)c1
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| InChI |
InChI=1S/C20H15F3N4O2/c21-20(22,23)29-15-3-1-2-12(6-15)8-25-19(28)17-11-24-18-7-13(4-5-16(17)18)14-9-26-27-10-14/h1-7,9-11,24H,8H2,(H,25,28)(H,26,27)
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| InChIKey |
UVPHWUGLYSWARJ-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