General Information of the Compound
| Compound ID |
CP0550900
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| Compound Name |
1-[[5-benzoyl-4-(trifluoromethyl)pyrimidin-2-yl]amino]-3-methylpyrrole-2,5-dione
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| Structure |
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| Formula |
C17H11F3N4O3
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| Molecular Weight |
376.294
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| Canonical SMILES |
CC1=CC(=O)N(Nc2ncc(C(=O)c3ccccc3)c(n2)C(F)(F)F)C1=O
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| InChI |
InChI=1S/C17H11F3N4O3/c1-9-7-12(25)24(15(9)27)23-16-21-8-11(14(22-16)17(18,19)20)13(26)10-5-3-2-4-6-10/h2-8H,1H3,(H,21,22,23)
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| InChIKey |
GEVKCFZCFWBZDR-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