General Information of the Compound
| Compound ID |
CP0437109
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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 (4-chloro-benzyl)-propyl-amide
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| Structure |
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| Formula |
C27H33ClN4O
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| Molecular Weight |
465.041
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| Canonical SMILES |
CCCN(Cc1ccc(Cl)cc1)C(=O)c1c(CC)nc2N(CCn12)c1c(C)cc(C)cc1C
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| InChI |
InChI=1S/C27H33ClN4O/c1-6-12-30(17-21-8-10-22(28)11-9-21)26(33)25-23(7-2)29-27-31(13-14-32(25)27)24-19(4)15-18(3)16-20(24)5/h8-11,15-16H,6-7,12-14,17H2,1-5H3
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| InChIKey |
HZQNPHFDBHQWJA-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