General Information of the Compound
| Compound ID |
CP0894954
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| Compound Name |
3-(3,5-Bis-trifluoromethyl-benzyl)-5-(1H-indol-3-ylmethyl)-1-methyl-imidazolidine-2,4-dione
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| Structure |
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| Formula |
C22H17F6N3O2
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| Molecular Weight |
469.385
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| Canonical SMILES |
CN1C(=O)N(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C(=O)C1Cc1c[nH]c2ccccc12
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| InChI |
InChI=1S/C22H17F6N3O2/c1-30-18(8-13-10-29-17-5-3-2-4-16(13)17)19(32)31(20(30)33)11-12-6-14(21(23,24)25)9-15(7-12)22(26,27)28/h2-7,9-10,18,29H,8,11H2,1H3
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| InChIKey |
ICBSQYXTXCHQCY-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