General Information of the Compound
| Compound ID |
CP0638698
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| Compound Name |
6-(1-ethyl-3-(trifluoromethyl)-1H-pyrazol-5-yl)-N-(2-fluorobenzyl)pyridin-3-amine
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| Structure |
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| Formula |
C18H16F4N4
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| Molecular Weight |
364.346
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| Canonical SMILES |
CCn1nc(C(F)(F)F)cc1-c1ccc(NCc2ccccc2F)cn1
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| InChI |
InChI=1S/C18H16F4N4/c1-2-26-16(9-17(25-26)18(20,21)22)15-8-7-13(11-24-15)23-10-12-5-3-4-6-14(12)19/h3-9,11,23H,2,10H2,1H3
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| InChIKey |
LVINYKJQMUCKRG-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