General Information of the Compound
| Compound ID |
CP0564634
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| Compound Name |
4-[1-[2-(3,5-difluoropyridin-2-yl)-2-oxoethyl]-4-methyl-2,5-dioxoimidazolidin-4-yl]benzonitrile
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| Structure |
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| Formula |
C18H12F2N4O3
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| Molecular Weight |
370.315
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| Canonical SMILES |
CC1(NC(=O)N(CC(=O)c2ncc(F)cc2F)C1=O)c1ccc(cc1)C#N
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| InChI |
InChI=1S/C18H12F2N4O3/c1-18(11-4-2-10(7-21)3-5-11)16(26)24(17(27)23-18)9-14(25)15-13(20)6-12(19)8-22-15/h2-6,8H,9H2,1H3,(H,23,27)
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| InChIKey |
NPWUFMSZZXYILP-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