General Information of the Compound
| Compound ID |
CP0379585
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| Compound Name |
4-[4-[[4-[(5R)-3-cyclohexyl-2-oxo-5-phenylimidazolidin-1-yl]piperidin-1-yl]methyl]phenoxy]-N,N-dimethylbenzamide
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| Structure |
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| Formula |
C36H44N4O3
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| Molecular Weight |
580.773
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| Canonical SMILES |
CN(C)C(=O)c1ccc(Oc2ccc(CN3CCC(CC3)N3[C@@H](CN(C4CCCCC4)C3=O)c3ccccc3)cc2)cc1
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| InChI |
InChI=1S/C36H44N4O3/c1-37(2)35(41)29-15-19-33(20-16-29)43-32-17-13-27(14-18-32)25-38-23-21-31(22-24-38)40-34(28-9-5-3-6-10-28)26-39(36(40)42)30-11-7-4-8-12-30/h3,5-6,9-10,13-20,30-31,34H,4,7-8,11-12,21-26H2,1-2H3/t34-/m0/s1
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| InChIKey |
FYFQDKSOZLVEKB-UMSFTDKQSA-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