General Information of the Compound
| Compound ID |
CP0941581
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| Compound Name |
3-(3,5-Bis-trifluoromethyl-benzyl)-5-(1H-indol-3-ylmethyl)-2,4-dioxo-imidazolidine-1-carboxylic acid phenylamide
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| Structure |
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| Formula |
C28H20F6N4O3
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| Molecular Weight |
574.481
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| Canonical SMILES |
O=C1C(Cc2c[nH]c3ccccc23)N(C(=O)Nc2ccccc2)C(=O)N1Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1
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| InChI |
InChI=1S/C28H20F6N4O3/c29-27(30,31)18-10-16(11-19(13-18)28(32,33)34)15-37-24(39)23(12-17-14-35-22-9-5-4-8-21(17)22)38(26(37)41)25(40)36-20-6-2-1-3-7-20/h1-11,13-14,23,35H,12,15H2,(H,36,40)
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| InChIKey |
BQMHXKMRKCHCGN-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