General Information of the Compound
| Compound ID |
CP0401224
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| Compound Name |
2-(1,3-dimethyl-2,4-dioxopyrrolo[3,2-d]pyrimidin-5-yl)-N-[4-(trifluoromethyl)phenyl]acetamide
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| Structure |
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| Formula |
C17H15F3N4O3
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| Molecular Weight |
380.326
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| Canonical SMILES |
Cn1c2ccn(CC(=O)Nc3ccc(cc3)C(F)(F)F)c2c(=O)n(C)c1=O
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| InChI |
InChI=1S/C17H15F3N4O3/c1-22-12-7-8-24(14(12)15(26)23(2)16(22)27)9-13(25)21-11-5-3-10(4-6-11)17(18,19)20/h3-8H,9H2,1-2H3,(H,21,25)
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| InChIKey |
XTJCMZFNEXELMO-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