General Information of the Compound
| Compound ID |
CP0537065
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| Compound Name |
N-[(3S,4S)-1-cyclohexyl-3-methoxypiperidin-4-yl]-5-(2,4-difluorophenyl)-1,2-oxazole-3-carboxamide
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| Formula |
C22H27F2N3O3
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| Molecular Weight |
419.472
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| Canonical SMILES |
CO[C@H]1CN(CC[C@@H]1NC(=O)c1cc(on1)-c1ccc(F)cc1F)C1CCCCC1
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| InChI |
InChI=1S/C22H27F2N3O3/c1-29-21-13-27(15-5-3-2-4-6-15)10-9-18(21)25-22(28)19-12-20(30-26-19)16-8-7-14(23)11-17(16)24/h7-8,11-12,15,18,21H,2-6,9-10,13H2,1H3,(H,25,28)/t18-,21-/m0/s1
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| InChIKey |
TUAXPSAOYJXKFV-RXVVDRJESA-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