General Information of the Compound
| Compound ID |
CP0505499
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| Compound Name |
2-Ethyl-7-(2,4,6-trimethyl-phenyl)-6,7-dihydro-5H-imidazo[1,2-a]imidazole-3-carboxylic acid benzyl-(3,3,3-trifluoro-propyl)-amide
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| Structure |
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| Formula |
C27H31F3N4O
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| Molecular Weight |
484.566
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| Canonical SMILES |
CCc1nc2N(CCn2c1C(=O)N(CCC(F)(F)F)Cc1ccccc1)c1c(C)cc(C)cc1C
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| InChI |
InChI=1S/C27H31F3N4O/c1-5-22-24(25(35)32(12-11-27(28,29)30)17-21-9-7-6-8-10-21)34-14-13-33(26(34)31-22)23-19(3)15-18(2)16-20(23)4/h6-10,15-16H,5,11-14,17H2,1-4H3
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| InChIKey |
SBNGWQYGASVFKM-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