General Information of the Compound
| Compound ID |
CP0059905
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| Compound Name |
4-amino-1-benzyl-6-(trifluoromethyl)-1H-imidazo[4,5-c]pyridin-2(3H)-one
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| Structure |
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| Formula |
C14H11F3N4O
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| Molecular Weight |
308.263
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| Canonical SMILES |
Nc1nc(cc2n(Cc3ccccc3)c(=O)[nH]c12)C(F)(F)F
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| InChI |
InChI=1S/C14H11F3N4O/c15-14(16,17)10-6-9-11(12(18)19-10)20-13(22)21(9)7-8-4-2-1-3-5-8/h1-6H,7H2,(H2,18,19)(H,20,22)
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| InChIKey |
OQBWPSLLJDBFNI-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