General Information of the Compound
| Compound ID |
CP0369089
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| Compound Name |
4-(3-((4-(4,4-dimethylpent-1-en-2-yl)cyclohexyl)methyl)-2-methylenebut-3-enyl)-1,2-dimethylbenzene
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| Structure |
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| Formula |
C18H23ClFN3O4
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| Molecular Weight |
399.85
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| Canonical SMILES |
CC(C)(C)OC(=O)N1CCC(CC1)NC(=O)C(=O)Nc1ccc(Cl)c(F)c1
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| InChI |
InChI=1S/C18H23ClFN3O4/c1-18(2,3)27-17(26)23-8-6-11(7-9-23)21-15(24)16(25)22-12-4-5-13(19)14(20)10-12/h4-5,10-11H,6-9H2,1-3H3,(H,21,24)(H,22,25)
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| InChIKey |
PPDMVLKBLMCDCE-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