General Information of the Compound
| Compound ID |
CP0526008
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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 dibenzylamide
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| Structure |
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| Formula |
C31H34N4O
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| Molecular Weight |
478.64
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| Canonical SMILES |
CCc1nc2N(CCn2c1C(=O)N(Cc1ccccc1)Cc1ccccc1)c1c(C)cc(C)cc1C
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| InChI |
InChI=1S/C31H34N4O/c1-5-27-29(35-17-16-34(31(35)32-27)28-23(3)18-22(2)19-24(28)4)30(36)33(20-25-12-8-6-9-13-25)21-26-14-10-7-11-15-26/h6-15,18-19H,5,16-17,20-21H2,1-4H3
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| InChIKey |
VFRKOGIUMXVEER-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