General Information of the Compound
| Compound ID |
CP0958747
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| Compound Name |
(R)-N-(2-(4-hydroxy-4-(trifluoromethyl)piperidin-1-yl)-3-phenylpropyl)-2,2-dimethylpentanamide
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| Structure |
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| Formula |
C22H33F3N2O2
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| Molecular Weight |
414.512
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| Canonical SMILES |
CCCC(C)(C)C(=O)NC[C@@H](Cc1ccccc1)N1CCC(O)(C(F)(F)F)CC1
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| InChI |
InChI=1S/C22H33F3N2O2/c1-4-10-20(2,3)19(28)26-16-18(15-17-8-6-5-7-9-17)27-13-11-21(29,12-14-27)22(23,24)25/h5-9,18,29H,4,10-16H2,1-3H3,(H,26,28)/t18-/m1/s1
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| InChIKey |
DEGUDXJXTJSIFF-GOSISDBHSA-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