General Information of the Compound
| Compound ID |
CP0519401
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| Compound Name |
N-[6-amino-5-[2-(trifluoromethoxy)phenyl]pyridin-2-yl]-3-methyltriazole-4-carboxamide
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| Structure |
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| Formula |
C16H13F3N6O2
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| Molecular Weight |
378.314
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| Canonical SMILES |
Cn1nncc1C(=O)Nc1ccc(c(N)n1)-c1ccccc1OC(F)(F)F
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| InChI |
InChI=1S/C16H13F3N6O2/c1-25-11(8-21-24-25)15(26)23-13-7-6-10(14(20)22-13)9-4-2-3-5-12(9)27-16(17,18)19/h2-8H,1H3,(H3,20,22,23,26)
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| InChIKey |
RRCJRMMIGQKZFZ-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