General Information of the Compound
| Compound ID |
CP0510494
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| Compound Name |
2-[[2-[(2R)-2-ethyl-2-methyl-4-(4-methylphenyl)oxan-4-yl]ethylamino]methyl]phenol
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| Structure |
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| Formula |
C24H33NO2
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| Molecular Weight |
367.533
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| Canonical SMILES |
CC[C@]1(C)CC(CCNCc2ccccc2O)(CCO1)c1ccc(C)cc1
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| InChI |
InChI=1S/C24H33NO2/c1-4-23(3)18-24(14-16-27-23,21-11-9-19(2)10-12-21)13-15-25-17-20-7-5-6-8-22(20)26/h5-12,25-26H,4,13-18H2,1-3H3/t23-,24?/m1/s1
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| InChIKey |
AZZXQPIFKYDBCE-MIHMCVIASA-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