General Information of the Compound
| Compound ID |
CP0637942
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| Compound Name |
5-(3,5-bis(trifluoromethyl)-1H-pyrazol-1-yl)-N-(2,4,6-trifluorobenzyl)pyridin-2-amine
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| Structure |
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| Formula |
C17H9F9N4
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| Molecular Weight |
440.269
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| Canonical SMILES |
Fc1cc(F)c(CNc2ccc(-n3nc(C(F)(F)F)cc3C(F)(F)F)cn2)c(F)c1
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| InChI |
InChI=1S/C17H9F9N4/c18-8-3-11(19)10(12(20)4-8)7-28-15-2-1-9(6-27-15)30-14(17(24,25)26)5-13(29-30)16(21,22)23/h1-6H,7H2,(H,27,28)
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| InChIKey |
YJQZXLGMJDQQKZ-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