General Information of the Compound
| Compound ID |
CP0388210
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| Compound Name |
2-chloro-N-(6-(4-methoxy-6-(trifluoromethyl)pyrimidin-2-yl)pyridin-3-yl)acetamide
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| Structure |
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| Formula |
C13H10ClF3N4O2
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| Molecular Weight |
346.696
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| Canonical SMILES |
COc1cc(nc(n1)-c1ccc(NC(=O)CCl)cn1)C(F)(F)F
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| InChI |
InChI=1S/C13H10ClF3N4O2/c1-23-11-4-9(13(15,16)17)20-12(21-11)8-3-2-7(6-18-8)19-10(22)5-14/h2-4,6H,5H2,1H3,(H,19,22)
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| InChIKey |
HQPHWNQQDMBMDB-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