General Information of the Compound
| Compound ID |
CP0667052
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| Compound Name |
rac-4-[2,5-Dioxo-4-(4-methoxyphenyl)-4-methylimidazolidin-1-yl]-2-(trifluoromethyl)benzonitrile
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| Structure |
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| Formula |
C19H14F3N3O3
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| Molecular Weight |
389.333
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| Canonical SMILES |
COc1ccc(C2(C)NC(=O)N(c3ccc(C#N)c(C(F)(F)F)c3)C2=O)cc1
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| InChI |
InChI=1S/C19H14F3N3O3/c1-18(12-4-7-14(28-2)8-5-12)16(26)25(17(27)24-18)13-6-3-11(10-23)15(9-13)19(20,21)22/h3-9H,1-2H3,(H,24,27)
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| InChIKey |
BCDCXPYBRZRXRV-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